data_2ayx_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 2ayx _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 ' 705' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.259 0 CA-C-O 120.989 0.423 . . . . 0.0 110.403 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 127.97 -6.72 6.87 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.971 -0.633 . . . . 0.0 111.751 -176.018 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 2.9 mmmt -66.7 134.78 52.94 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 175.483 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 708' ' ' ARG . . . . . . . . . . . . . 10.5 mtt180 -102.7 146.25 28.49 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 121.473 0.654 . . . . 0.0 111.953 -171.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 709' ' ' CYS . . . . . 0.429 ' O ' ' HA ' ' A' ' 733' ' ' VAL . 61.8 m -134.86 119.73 18.46 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.986 -1.007 . . . . 0.0 109.019 174.146 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 710' ' ' TRP . . . . . 0.485 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 81.5 m95 -92.14 134.94 34.39 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 -177.288 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 711' ' ' LEU . . . . . 0.421 ' O ' ' HG ' ' A' ' 711' ' ' LEU . 0.1 OUTLIER -126.16 125.55 42.67 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.611 0.72 . . . . 0.0 111.11 -177.958 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -120.9 65.59 0.86 Allowed 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.181 -0.918 . . . . 0.0 108.86 176.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 713' ' ' VAL . . . . . 0.766 HG12 ' HB3' ' A' ' 750' ' ' ASP . 21.1 t -114.76 113.54 43.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.348 -177.514 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 41.8 mtm180 -77.13 -23.61 51.71 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.186 0.517 . . . . 0.0 109.622 179.146 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -72.83 97.42 2.24 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.481 175.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -61.94 -31.52 71.85 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.897 -174.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.32 -48.25 78.83 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.136 0.493 . . . . 0.0 110.275 179.153 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 718' ' ' LEU . . . . . 0.564 HD12 ' HA ' ' A' ' 786' ' ' ALA . 1.4 tt -72.49 -42.53 64.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.496 178.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 719' ' ' CYS . . . . . 0.7 ' HB2' ' HB ' ' A' ' 713' ' ' VAL . 0.0 OUTLIER -58.93 -52.18 66.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.804 -177.852 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 720' ' ' GLN . . . . . 0.632 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 22.5 tt0 -62.23 -42.36 99.24 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.979 -179.124 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -59.39 -53.06 62.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.038 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.98 -44.76 88.23 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.253 -177.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 723' ' ' GLU . . . . . 0.632 ' HG2' ' HA ' ' A' ' 720' ' ' GLN . 2.0 pt-20 -64.55 -40.12 94.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.644 -174.535 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 724' ' ' THR . . . . . 0.519 ' N ' ' HG3' ' A' ' 723' ' ' GLU . 9.2 m -70.04 -38.61 75.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.853 0.358 . . . . 0.0 110.96 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 20.3 m -64.39 -38.28 90.47 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.507 -178.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 726' ' ' LEU . . . . . 0.403 HD21 HD12 ' A' ' 795' ' ' LEU . 5.4 mt -74.58 -36.34 63.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.055 0.455 . . . . 0.0 110.97 -178.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -75.66 6.91 4.24 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.65 -178.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 8.3 mtm-85 -76.7 -16.51 59.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.881 0.372 . . . . 0.0 111.077 179.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 14.5 m -107.72 -99.68 0.36 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.759 177.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 730' ' ' GLY . . . . . . . . . . . . . . . -144.88 31.88 1.73 Allowed Glycine 0 N--CA 1.448 -0.514 0 N-CA-C 110.933 -0.867 . . . . 0.0 110.933 179.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 731' ' ' ILE . . . . . . . . . . . . . 26.6 mm -100.24 132.64 45.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.303 -0.448 . . . . 0.0 110.045 -176.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 732' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -100.72 105.4 17.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.094 0.473 . . . . 0.0 110.536 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 733' ' ' VAL . . . . . 0.429 ' HA ' ' O ' ' A' ' 709' ' ' CYS . 4.5 t -84.08 126.9 40.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.624 177.121 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 734' ' ' THR . . . . . 0.431 ' HB ' ' CE3' ' A' ' 710' ' ' TRP . 0.2 OUTLIER -124.36 140.14 53.23 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.921 0.391 . . . . 0.0 111.131 -175.77 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 1.4 m -65.79 115.52 6.01 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.977 178.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 736' ' ' TYR . . . . . 0.485 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 70.3 t80 -89.57 114.08 25.59 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.474 -179.157 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -117.98 -49.77 2.5 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.475 178.169 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -157.32 38.86 0.55 Allowed Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.965 -0.636 . . . . 0.0 111.563 -179.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 15.5 mp0 -86.2 175.68 8.37 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.475 -0.362 . . . . 0.0 110.775 -177.022 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 740' ' ' GLU . . . . . 0.432 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 11.5 mt-10 -95.12 147.78 33.59 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.683 -178.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 741' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 740' ' ' GLU . 3.1 Cg_endo -84.77 122.45 2.66 Favored 'Trans proline' 0 N--CA 1.455 -0.774 0 C-N-CA 122.803 2.335 . . . . 0.0 112.471 -179.076 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 742' ' ' THR . . . . . 0.646 HG23 ' HD2' ' A' ' 743' ' ' PRO . 0.3 OUTLIER -103.32 138.11 19.45 Favored Pre-proline 0 C--N 1.322 -0.615 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.269 177.344 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 743' ' ' PRO . . . . . 0.646 ' HD2' HG23 ' A' ' 742' ' ' THR . 36.4 Cg_endo -66.02 -0.98 4.55 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.954 2.436 . . . . 0.0 113.131 -178.706 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -108.31 -6.51 16.26 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.088 0.47 . . . . 0.0 110.261 178.057 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 87.6 m-20 -108.49 157.66 18.25 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.596 -170.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 746' ' ' VAL . . . . . 0.438 ' HA ' ' O ' ' A' ' 761' ' ' ALA . 1.3 p -123.71 137.35 57.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.484 -179.254 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 747' ' ' LEU . . . . . 0.472 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 0.6 OUTLIER -106.72 111.55 24.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.513 -179.43 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 2.9 mt -100.78 110.72 28.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 176.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 4.9 t -118.76 166.61 12.57 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.709 0.29 . . . . 0.0 111.012 -176.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 750' ' ' ASP . . . . . 0.766 ' HB3' HG12 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -111.74 136.89 50.39 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.589 177.663 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 751' ' ' GLU . . . . . 0.677 ' HG3' ' H ' ' A' ' 752' ' ' VAL . 3.0 tp10 66.51 174.74 0.24 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.917 -1.038 . . . . 0.0 111.433 -178.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 752' ' ' VAL . . . . . 0.677 ' H ' ' HG3' ' A' ' 751' ' ' GLU . 2.9 p -56.96 120.89 3.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 121.477 0.656 . . . . 0.0 111.233 -179.63 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 2.7 p -99.34 158.74 3.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.336 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -113.17 25.96 10.89 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.141 0.496 . . . . 0.0 110.5 -178.516 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.67 169.29 10.52 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.1 -179.448 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -108.84 -39.69 5.26 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.723 -178.278 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 757' ' ' TRP . . . . . 0.472 ' CD2' ' HB2' ' A' ' 747' ' ' LEU . 76.6 t-105 61.9 85.09 0.13 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.51 0.672 . . . . 0.0 111.233 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 25.7 mm100 -78.01 67.4 3.85 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.1 176.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 759' ' ' GLY . . . . . 0.477 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -129.46 -147.12 6.23 Favored Glycine 0 N--CA 1.444 -0.801 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.291 -177.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.38 -47.22 20.4 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.717 0.294 . . . . 0.0 110.802 -179.352 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 761' ' ' ALA . . . . . 0.438 ' O ' ' HA ' ' A' ' 746' ' ' VAL . . . -166.75 158.56 13.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.689 -179.064 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 762' ' ' VAL . . . . . 0.451 HG21 ' N ' ' A' ' 763' ' ' VAL . 1.5 p -131.69 137.37 55.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.53 175.258 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 763' ' ' VAL . . . . . 0.451 ' N ' HG21 ' A' ' 762' ' ' VAL . 77.7 t -115.96 121.82 68.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.04 -179.217 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 764' ' ' THR . . . . . 0.478 ' HB ' HG11 ' A' ' 782' ' ' VAL . 5.7 m -110.92 98.78 7.81 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.242 0.544 . . . . 0.0 111.468 -178.175 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 765' ' ' PHE . . . . . 0.448 ' CZ ' HD13 ' A' ' 791' ' ' LEU . 20.6 m-85 -76.83 119.73 21.0 Favored 'General case' 0 C--O 1.221 -0.398 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 174.004 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -94.13 133.82 37.21 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 120.355 -0.538 . . . . 0.0 110.879 -174.103 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 767' ' ' ARG . . . . . 0.573 ' NE ' ' HA ' ' A' ' 767' ' ' ARG . 0.1 OUTLIER -110.08 -36.43 5.85 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.711 -179.374 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.37 -58.13 0.26 Allowed 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.76 0.281 . . . . 0.0 111.76 177.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 34.1 m170 -114.1 146.32 40.43 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 121.752 0.787 . . . . 0.0 112.514 -172.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 770' ' ' ILE . . . . . 0.541 HG23 ' H ' ' A' ' 771' ' ' GLY . 0.6 OUTLIER -110.37 -179.47 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.688 0 CA-C-N 114.448 -1.251 . . . . 0.0 109.644 -179.123 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 771' ' ' GLY . . . . . 0.541 ' H ' HG23 ' A' ' 770' ' ' ILE . . . 170.29 -33.56 0.16 Allowed Glycine 0 N--CA 1.451 -0.346 0 N-CA-C 110.668 -0.973 . . . . 0.0 110.668 -178.252 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 772' ' ' ILE . . . . . 1.063 HG13 ' HD2' ' A' ' 773' ' ' PRO . 1.2 tp -80.64 148.4 65.56 Favored Pre-proline 0 C--N 1.32 -0.685 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 171.503 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 773' ' ' PRO . . . . . 1.063 ' HD2' HG13 ' A' ' 772' ' ' ILE . 33.4 Cg_endo -65.45 -108.33 0.0 OUTLIER 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 122.652 2.235 . . . . 0.0 113.829 -179.433 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . 0.503 ' HG ' ' H ' ' A' ' 776' ' ' LYS . 1.0 OUTLIER 174.36 -154.75 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 -177.365 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 775' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -60.3 -0.01 0.21 Allowed 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 776' ' ' LYS . . . . . 0.503 ' H ' ' HG ' ' A' ' 774' ' ' LEU . 0.0 OUTLIER -75.01 -11.51 60.12 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 121.334 0.588 . . . . 0.0 109.829 171.487 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 777' ' ' ALA . . . . . 0.418 ' HB1' ' HD2' ' A' ' 778' ' ' PRO . . . -102.91 158.76 31.13 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.597 176.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 778' ' ' PRO . . . . . 0.418 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 54.7 Cg_endo -70.35 63.09 2.13 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.974 2.449 . . . . 0.0 113.445 -177.631 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 116.09 49.24 0.46 Allowed Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.807 176.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 780' ' ' GLU . . . . . 0.437 ' HG2' ' CG1' ' A' ' 762' ' ' VAL . 0.7 OUTLIER -130.78 140.06 50.26 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 177.165 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 45.5 m95 -141.47 112.64 7.41 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 110.487 -0.19 . . . . 0.0 110.487 -178.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . 0.478 HG11 ' HB ' ' A' ' 764' ' ' THR . 31.2 m -106.67 143.84 16.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-O 121.151 0.501 . . . . 0.0 111.063 179.138 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 783' ' ' HIS . . . . . . . . . . . . . 7.5 t-160 -165.47 121.38 1.36 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.189 174.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.45 100.74 9.46 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.106 176.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 785' ' ' VAL . . . . . 0.414 ' HB ' ' HD3' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -154.94 176.54 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.0 -0.545 . . . . 0.0 109.69 179.941 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 786' ' ' ALA . . . . . 0.564 ' HA ' HD12 ' A' ' 718' ' ' LEU . . . -115.87 39.92 2.92 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.515 178.518 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 787' ' ' ALA . . . . . 0.465 ' HB2' ' HG ' ' A' ' 718' ' ' LEU . . . 62.91 69.99 0.8 Allowed Pre-proline 0 CA--C 1.529 0.156 0 CA-C-N 115.795 -0.638 . . . . 0.0 111.595 178.841 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 788' ' ' PRO . . . . . 0.672 ' HD2' ' OE1' ' A' ' 790' ' ' GLU . 12.1 Cg_exo -70.18 -66.54 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.772 2.315 . . . . 0.0 111.529 175.608 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 789' ' ' HIS . . . . . 0.414 ' HB3' ' O ' ' A' ' 788' ' ' PRO . 1.8 p80 177.08 -3.96 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.214 178.653 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 790' ' ' GLU . . . . . 0.672 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -84.38 -48.68 9.42 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.803 0.297 . . . . 0.0 111.803 -172.065 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 791' ' ' LEU . . . . . 0.565 ' N ' ' HD2' ' A' ' 792' ' ' PRO . 1.1 mt -70.43 -42.84 16.02 Favored Pre-proline 0 C--N 1.326 -0.438 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -177.187 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 792' ' ' PRO . . . . . 0.565 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 8.8 Cg_endo -54.23 -36.85 87.38 Favored 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 121.653 1.569 . . . . 0.0 111.713 170.83 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -69.84 -37.21 76.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.612 177.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 794' ' ' LEU . . . . . 0.433 HD21 ' HA ' ' A' ' 794' ' ' LEU . 1.6 tm? -61.59 -39.02 89.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.104 176.758 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 795' ' ' LEU . . . . . 0.473 HD22 ' HA ' ' A' ' 795' ' ' LEU . 0.2 OUTLIER -63.23 -43.76 97.15 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.995 0.426 . . . . 0.0 110.658 178.531 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -66.63 -30.96 71.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.628 178.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.3 -44.24 65.55 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.753 178.384 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -65.55 -31.11 52.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.968 -179.078 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 799' ' ' TYR . . . . . 0.415 ' HD1' ' HA ' ' A' ' 799' ' ' TYR . 0.2 OUTLIER -83.7 -27.6 28.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.418 177.189 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.462 0.157 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.169 179.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 31.7 t0 . . . . . 0 C--O 1.234 0.282 0 CA-C-O 121.263 0.554 . . . . 0.0 110.721 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 3.2 ttm -96.23 108.14 20.57 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.594 175.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 826' ' ' MET . . . . . 0.576 ' HG2' HG13 ' A' ' 869' ' ' ILE . 2.3 tpp -100.16 118.27 36.15 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.794 -178.509 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 827' ' ' ILE . . . . . 0.612 ' HB ' HD23 ' A' ' 844' ' ' LEU . 4.8 mm -108.58 128.79 63.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.657 178.129 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 828' ' ' LEU . . . . . 0.592 HD12 ' HB1' ' A' ' 854' ' ' ALA . 0.5 OUTLIER -105.41 128.76 53.69 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.424 -177.892 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 829' ' ' VAL . . . . . 0.563 ' HB ' HD12 ' A' ' 873' ' ' LEU . 1.2 p -114.77 114.87 47.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 121.084 0.469 . . . . 0.0 110.532 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 830' ' ' VAL . . . . . 0.612 HG22 ' HB2' ' A' ' 854' ' ' ALA . 80.3 t -109.23 105.45 18.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.918 177.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 831' ' ' ASP . . . . . 0.853 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 33.3 t0 -117.55 137.41 52.59 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.739 -177.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.05 -21.95 60.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.666 178.653 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 1.2 m170 -111.48 106.82 57.02 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.581 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -49.29 -44.57 33.46 Favored 'Trans proline' 0 CA--C 1.533 0.463 0 C-N-CA 123.965 3.11 . . . . 0.0 114.672 -174.047 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 835' ' ' ILE . . . . . 0.557 HG22 ' N ' ' A' ' 836' ' ' ASN . 0.4 OUTLIER -65.39 -36.21 77.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.862 0.363 . . . . 0.0 111.081 -178.253 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 836' ' ' ASN . . . . . 0.557 ' N ' HG22 ' A' ' 835' ' ' ILE . 5.0 m120 -75.33 -35.47 61.21 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 178.186 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 837' ' ' ARG . . . . . 0.853 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 1.3 ttp180 -53.36 -45.91 69.35 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.427 175.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -72.03 -28.75 63.57 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.982 178.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.99 -53.21 27.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.53 -0.304 . . . . 0.0 111.807 -177.093 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 840' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 836' ' ' ASN . 0.0 OUTLIER -72.24 -27.69 62.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.944 0.402 . . . . 0.0 109.963 -179.997 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 841' ' ' ALA . . . . . 0.474 ' HB3' ' O ' ' A' ' 837' ' ' ARG . . . -64.63 -35.53 81.31 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.079 174.854 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -64.8 -43.94 91.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.211 176.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 843' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.11 -46.45 85.54 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.128 176.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 844' ' ' LEU . . . . . 0.612 HD23 ' HB ' ' A' ' 827' ' ' ILE . 0.1 OUTLIER -60.5 -42.62 96.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.071 178.177 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -68.04 -22.36 74.12 Favored Glycine 0 N--CA 1.45 -0.369 0 CA-C-N 116.05 -0.523 . . . . 0.0 112.282 178.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 35.8 m -75.32 -30.34 60.29 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.515 -0.18 . . . . 0.0 110.515 177.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 847' ' ' LEU . . . . . 0.481 ' HA ' HD12 ' A' ' 847' ' ' LEU . 0.1 OUTLIER -68.52 -44.51 74.45 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 120.911 0.386 . . . . 0.0 110.168 173.41 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 105.19 59.56 0.65 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.79 -0.719 . . . . 0.0 113.35 174.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -143.45 -178.59 5.95 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 122.781 -0.246 . . . . 0.0 110.348 177.51 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -74.86 122.26 23.11 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 -177.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -122.47 120.55 34.24 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.516 -177.056 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 852' ' ' LYS . . . . . 0.418 ' HB3' HD13 ' A' ' 828' ' ' LEU . 0.0 OUTLIER -110.85 115.26 29.23 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.405 178.84 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.78 114.84 26.61 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.026 -177.344 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 854' ' ' ALA . . . . . 0.612 ' HB2' HG22 ' A' ' 830' ' ' VAL . . . -132.42 171.81 13.27 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.112 0.482 . . . . 0.0 111.629 -179.391 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 855' ' ' ASN . . . . . 0.469 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 6.3 t-20 -160.8 97.53 1.18 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.305 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 856' ' ' ASP . . . . . 0.469 ' HB2' ' O ' ' A' ' 855' ' ' ASN . 48.8 t0 170.06 156.28 0.06 Allowed 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.293 179.354 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -88.61 -49.36 3.66 Favored Glycine 0 N--CA 1.447 -0.606 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.071 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -74.27 -34.83 38.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 O-C-N 122.773 -0.251 . . . . 0.0 111.138 -178.144 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 859' ' ' ASP . . . . . 0.44 ' HB2' ' OD2' ' A' ' 856' ' ' ASP . 3.7 t0 -69.05 -19.12 64.09 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 111.925 0.343 . . . . 0.0 111.925 -178.163 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -64.78 -53.02 53.58 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.5 0.666 . . . . 0.0 109.582 173.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 861' ' ' LEU . . . . . 0.679 HD12 ' HA ' ' A' ' 890' ' ' ILE . 9.6 tp -61.15 -41.54 96.94 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.481 -0.782 . . . . 0.0 109.731 175.183 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 862' ' ' ASN . . . . . 0.406 ' HB3' ' HA ' ' A' ' 859' ' ' ASP . 48.2 t30 -60.03 -29.23 68.36 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.742 -1.117 . . . . 0.0 110.834 178.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 863' ' ' VAL . . . . . 0.77 HG11 HD11 ' A' ' 869' ' ' ILE . 0.5 OUTLIER -72.92 -34.62 46.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.621 -179.211 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 864' ' ' LEU . . . . . 0.483 HD22 HD22 ' A' ' 897' ' ' LEU . 6.3 mt -64.71 -33.33 75.71 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.224 0.535 . . . . 0.0 109.774 175.305 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -78.14 -24.88 47.2 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.875 178.199 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 9.0 mtmt -77.93 -48.55 16.07 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.93 -178.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 2.1 p30 -156.72 176.55 12.59 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.21 -177.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 79.2 t60 -91.31 97.3 11.02 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.109 0.481 . . . . 0.0 112.01 -174.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 869' ' ' ILE . . . . . 0.77 HD11 HG11 ' A' ' 863' ' ' VAL . 0.7 OUTLIER -94.31 133.65 34.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 166.806 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -86.37 -43.99 12.41 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.71 0.29 . . . . 0.0 111.143 -174.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 871' ' ' ILE . . . . . 0.581 ' HB ' HG22 ' A' ' 827' ' ' ILE . 43.2 mm -122.59 126.31 73.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.217 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 872' ' ' VAL . . . . . 0.471 HG22 HG23 ' A' ' 869' ' ' ILE . 3.6 t -106.46 122.48 60.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 120.683 0.278 . . . . 0.0 110.334 178.343 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 873' ' ' LEU . . . . . 0.563 HD12 ' HB ' ' A' ' 829' ' ' VAL . 0.1 OUTLIER -104.86 121.55 43.91 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.114 177.113 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -109.45 106.34 16.05 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 177.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 875' ' ' ASP . . . . . 0.52 ' CG ' ' HZ2' ' A' ' 925' ' ' LYS . 7.0 t0 -106.13 119.92 40.46 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.491 -175.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 10.5 t -126.26 119.87 55.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.213 -176.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 877' ' ' ASN . . . . . 0.723 ' HB2' ' HE2' ' A' ' 925' ' ' LYS . 0.1 OUTLIER -109.78 -36.35 5.94 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.156 175.186 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 1.5 mmm . . . . . 0 C--N 1.323 -0.58 0 CA-C-O 121.017 0.437 . . . . 0.0 111.308 -178.384 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.444 0 N-CA-C 113.711 0.244 . . . . 0.0 113.711 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -70.88 -43.04 69.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.442 0.639 . . . . 0.0 109.479 -177.609 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 885' ' ' ARG . . . . . 0.442 ' HG2' ' HG3' ' A' ' 889' ' ' ARG . 0.0 OUTLIER -58.21 -32.97 68.78 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.325 177.1 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.75 -56.22 19.51 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.909 -176.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 887' ' ' THR . . . . . 0.515 ' O ' HG21 ' A' ' 890' ' ' ILE . 0.1 OUTLIER -65.83 -44.32 85.89 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.434 -176.741 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 6.3 tp60 -61.24 -50.36 73.38 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.184 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 889' ' ' ARG . . . . . 0.442 ' HG3' ' HG2' ' A' ' 885' ' ' ARG . 2.9 mtt180 -66.51 -41.45 88.82 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.436 -176.196 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 890' ' ' ILE . . . . . 0.699 HG12 ' HG ' ' A' ' 895' ' ' LEU . 10.5 tt -64.53 -41.71 93.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 C-N-CA 121.159 -0.216 . . . . 0.0 111.398 -176.305 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 891' ' ' ARG . . . . . 0.955 ' HA ' ' HB2' ' A' ' 895' ' ' LEU . 10.5 ptt85 -76.35 -32.32 58.57 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.671 179.001 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -70.02 -45.58 66.91 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.319 -176.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 893' ' ' LEU . . . . . 0.473 HD21 ' HA ' ' A' ' 893' ' ' LEU . 3.9 mt -75.06 -26.91 59.72 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.865 0.321 . . . . 0.0 111.865 -175.587 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 146.48 71.88 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.027 -1.082 . . . . 0.0 113.47 175.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 895' ' ' LEU . . . . . 0.955 ' HB2' ' HA ' ' A' ' 891' ' ' ARG . 0.5 OUTLIER -85.22 127.87 34.46 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 173.977 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -129.38 -9.29 4.67 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.126 0.489 . . . . 0.0 111.367 -177.727 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 897' ' ' LEU . . . . . 0.483 HD22 HD22 ' A' ' 864' ' ' LEU . 0.4 OUTLIER -122.89 157.98 58.57 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.832 -172.368 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -71.33 140.14 36.34 Favored 'Trans proline' 0 C--O 1.241 0.643 0 C-N-CA 123.069 2.513 . . . . 0.0 112.718 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 899' ' ' VAL . . . . . 0.911 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 43.3 t -114.53 132.98 62.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.733 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 900' ' ' ILE . . . . . 0.417 HG12 ' HB2' ' A' ' 921' ' ' SER . 89.6 mt -103.5 114.33 42.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.955 175.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 901' ' ' GLY . . . . . 0.515 ' O ' ' HA ' ' A' ' 922' ' ' CYS . . . -94.17 109.75 3.87 Favored Glycine 0 N--CA 1.443 -0.866 0 C-N-CA 120.738 -0.744 . . . . 0.0 111.518 177.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 902' ' ' VAL . . . . . 0.573 ' HB ' HD12 ' A' ' 923' ' ' LEU . 0.1 OUTLIER -108.6 118.76 56.88 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 177.707 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.95 154.06 48.53 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.859 -171.258 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -83.0 105.76 14.26 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.018 174.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 69.07 104.08 0.06 Allowed 'General case' 0 N--CA 1.467 0.409 0 O-C-N 123.803 0.689 . . . . 0.0 110.944 179.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -81.13 53.25 1.96 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.747 -175.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 1.3 mt -80.79 -58.91 2.88 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.006 0.431 . . . . 0.0 110.368 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -94.0 -19.49 20.84 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.374 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.56 -54.03 50.62 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.158 -178.172 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 910' ' ' GLU . . . . . 0.461 ' HA ' ' NH1' ' A' ' 913' ' ' ARG . 9.8 tp10 -50.85 -46.44 60.15 Favored 'General case' 0 N--CA 1.463 0.189 0 O-C-N 123.581 0.551 . . . . 0.0 111.453 -176.172 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 10.1 tmtt? -64.77 -52.49 56.64 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.399 -176.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -69.61 -43.94 71.73 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 111.699 0.259 . . . . 0.0 111.699 -174.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 913' ' ' ARG . . . . . 0.461 ' NH1' ' HA ' ' A' ' 910' ' ' GLU . 0.1 OUTLIER -65.98 -27.26 68.0 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 121.184 -0.206 . . . . 0.0 111.135 -176.9 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 78.3 m -74.63 -39.8 61.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.77 0.319 . . . . 0.0 110.377 175.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.61 -42.92 95.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.612 179.698 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -72.72 -42.71 63.86 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.804 179.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 50.7 50.0 19.81 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.807 -176.339 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -123.56 16.45 7.94 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.218 -178.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 919' ' ' MET . . . . . 0.911 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -113.77 -113.18 0.34 Allowed 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 179.221 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 920' ' ' ASP . . . . . 0.601 ' HB2' ' O ' ' A' ' 919' ' ' MET . 5.3 t70 164.52 -58.48 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.482 0 O-C-N 124.199 0.937 . . . . 0.0 109.89 174.697 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 921' ' ' SER . . . . . 0.417 ' HB2' HG12 ' A' ' 900' ' ' ILE . 57.9 m -113.87 164.59 13.56 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.035 177.805 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 922' ' ' CYS . . . . . 0.515 ' HA ' ' O ' ' A' ' 901' ' ' GLY . 0.1 OUTLIER -148.78 140.13 23.3 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.513 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 923' ' ' LEU . . . . . 0.573 HD12 ' HB ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -147.68 177.86 8.95 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.773 0.321 . . . . 0.0 110.439 178.184 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.87 146.18 24.61 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.991 -178.674 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 925' ' ' LYS . . . . . 0.723 ' HE2' ' HB2' ' A' ' 877' ' ' ASN . 3.7 tmtm? -45.73 -51.62 28.45 Favored Pre-proline 0 N--CA 1.47 0.572 0 O-C-N 123.67 0.606 . . . . 0.0 112.308 177.375 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -72.1 64.61 3.41 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 121.742 1.628 . . . . 0.0 112.169 175.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 2.1 p -71.65 148.94 9.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.043 0.449 . . . . 0.0 110.633 179.199 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.82 160.25 14.76 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.552 179.298 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 929' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.67 -45.36 81.74 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.107 -179.14 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -65.99 -44.61 84.34 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.824 0.345 . . . . 0.0 110.692 -176.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 931' ' ' VAL . . . . . 0.445 ' O ' ' HG3' ' A' ' 934' ' ' GLN . 74.4 t -63.65 -42.94 97.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.785 -178.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 932' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -66.7 -33.9 66.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.444 178.43 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.84 -48.67 58.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.002 -178.763 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 934' ' ' GLN . . . . . 0.445 ' HG3' ' O ' ' A' ' 931' ' ' VAL . 0.6 OUTLIER -65.7 -40.97 92.82 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 121.132 -0.227 . . . . 0.0 111.161 -177.573 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 12.4 m -64.41 -43.77 93.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.731 0.301 . . . . 0.0 111.087 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 936' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.78 -41.94 91.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.856 178.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 39.6 m -65.43 -44.46 87.29 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.229 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.15 -40.34 89.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.081 0.467 . . . . 0.0 110.503 178.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 939' ' ' TYR . . . . . 0.486 ' HD1' ' HA ' ' A' ' 939' ' ' TYR . 0.5 OUTLIER -72.85 -36.3 67.4 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.879 -178.902 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -62.15 -39.07 91.4 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.068 0.461 . . . . 0.0 110.905 177.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 941' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.31 -24.11 43.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.349 178.319 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 942' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.6 -47.75 68.8 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.418 178.512 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 5.8 m -69.51 -28.76 39.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.042 176.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -58.57 -33.52 70.05 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.195 173.763 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 3.3 mmtp -69.1 -48.77 61.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.842 177.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.1 -42.39 72.76 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.835 -0.62 . . . . 0.0 112.658 -175.174 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 11.1 mtm-85 -89.18 -33.74 16.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.755 0.312 . . . . 0.0 111.202 -175.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 1.2 t0 . . . . . 0 C--O 1.234 0.239 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.369 -177.625 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.452 -0.333 0 CA-C-O 120.547 0.213 . . . . 0.0 111.034 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 80.99 45.84 7.41 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.848 -0.691 . . . . 0.0 113.473 173.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 707' ' ' LYS . . . . . 0.417 ' HZ3' ' CD ' ' A' ' 744' ' ' GLU . 4.4 tptt -145.59 153.74 41.39 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 176.452 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 708' ' ' ARG . . . . . 0.657 ' HG2' HG13 ' A' ' 732' ' ' VAL . 0.0 OUTLIER -118.59 156.39 29.26 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.216 0.532 . . . . 0.0 111.849 -172.716 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 709' ' ' CYS . . . . . 0.454 ' SG ' HG23 ' A' ' 731' ' ' ILE . 0.5 OUTLIER -142.19 145.25 33.95 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.794 173.741 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 710' ' ' TRP . . . . . . . . . . . . . 66.4 m95 -114.26 131.99 56.3 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 177.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 711' ' ' LEU . . . . . 0.486 HD23 ' HA ' ' A' ' 735' ' ' THR . 0.3 OUTLIER -122.86 131.31 53.69 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.476 0.655 . . . . 0.0 111.658 -175.898 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -126.81 65.56 1.27 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.816 -1.084 . . . . 0.0 109.128 174.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 713' ' ' VAL . . . . . 0.835 ' HA ' ' HB2' ' A' ' 750' ' ' ASP . 13.4 t -113.1 134.3 56.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.681 -175.085 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -100.97 -27.6 13.2 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.68 -174.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 -74.57 124.97 27.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.942 173.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -70.37 -40.26 74.12 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.173 -173.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.66 -41.49 95.14 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.164 0.507 . . . . 0.0 110.479 178.63 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 718' ' ' LEU . . . . . 0.652 HD13 ' HD2' ' A' ' 765' ' ' PHE . 0.4 OUTLIER -71.87 -49.37 38.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.704 -179.41 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 719' ' ' CYS . . . . . 0.654 ' HB2' ' HB ' ' A' ' 713' ' ' VAL . 0.0 OUTLIER -60.25 -52.21 66.24 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.824 -177.752 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 720' ' ' GLN . . . . . 0.656 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 0.1 OUTLIER -63.49 -40.29 96.7 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -175.957 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 721' ' ' PHE . . . . . 0.411 ' CD2' ' HB2' ' A' ' 787' ' ' ALA . 38.6 t80 -64.11 -43.48 95.22 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.808 0.337 . . . . 0.0 110.58 -179.241 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 722' ' ' LEU . . . . . 0.462 HD23 ' HD3' ' A' ' 792' ' ' PRO . 0.4 OUTLIER -68.4 -48.41 64.75 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.789 -179.261 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 723' ' ' GLU . . . . . 0.656 ' HG2' ' HA ' ' A' ' 720' ' ' GLN . 1.5 pt-20 -63.05 -42.49 99.74 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.379 -176.493 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 724' ' ' THR . . . . . 0.578 ' N ' ' HG3' ' A' ' 723' ' ' GLU . 20.1 m -70.84 -34.18 71.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.445 0.164 . . . . 0.0 111.359 -178.059 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 72.6 m -68.87 -37.76 79.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.775 0.321 . . . . 0.0 110.927 179.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 726' ' ' LEU . . . . . 0.526 HD22 HD12 ' A' ' 795' ' ' LEU . 14.1 mt -73.41 -42.49 62.02 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.081 0.467 . . . . 0.0 110.493 179.333 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -75.77 10.08 1.99 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.532 178.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.81 -35.14 64.85 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.809 0.338 . . . . 0.0 110.183 179.069 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 13.1 m -100.25 -94.22 0.27 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.677 177.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 730' ' ' GLY . . . . . . . . . . . . . . . -152.28 38.21 0.78 Allowed Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 111.336 -0.705 . . . . 0.0 111.336 -179.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 731' ' ' ILE . . . . . 0.454 HG23 ' SG ' ' A' ' 709' ' ' CYS . 42.9 mm -101.42 128.31 53.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 178.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 732' ' ' VAL . . . . . 0.657 HG13 ' HG2' ' A' ' 708' ' ' ARG . 0.9 OUTLIER -98.02 114.73 36.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.368 0.604 . . . . 0.0 110.84 -176.403 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 733' ' ' VAL . . . . . 0.437 HG23 HD22 ' A' ' 711' ' ' LEU . 5.2 p -98.22 147.79 6.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.023 177.557 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 22.3 m -141.67 137.3 31.67 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.849 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 735' ' ' THR . . . . . 0.486 ' HA ' HD23 ' A' ' 711' ' ' LEU . 0.6 OUTLIER -54.9 125.34 19.83 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.727 174.669 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 736' ' ' TYR . . . . . 0.638 ' HH ' ' HE2' ' A' ' 755' ' ' LYS . 21.8 t80 -74.74 83.76 2.12 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.172 0.51 . . . . 0.0 111.059 -179.294 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -70.24 -60.46 2.27 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.133 175.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 179.99 49.02 0.08 OUTLIER Glycine 0 N--CA 1.445 -0.734 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.513 179.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.89 147.07 23.97 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.86 0.362 . . . . 0.0 110.278 -178.703 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 34.7 mp0 -68.63 143.93 95.63 Favored Pre-proline 0 C--N 1.32 -0.71 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.765 -178.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 741' ' ' PRO . . . . . 0.492 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 40.4 Cg_endo -66.14 135.0 38.7 Favored 'Trans proline' 0 C--O 1.234 0.305 0 C-N-CA 122.931 2.421 . . . . 0.0 113.417 -176.429 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 742' ' ' THR . . . . . 0.555 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.0 OUTLIER -117.92 139.59 26.69 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.416 177.491 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 743' ' ' PRO . . . . . 0.564 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 33.5 Cg_endo -64.15 -17.12 58.55 Favored 'Trans proline' 0 N--CA 1.476 0.481 0 C-N-CA 123.042 2.495 . . . . 0.0 113.633 -176.076 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 744' ' ' GLU . . . . . 0.417 ' CD ' ' HZ3' ' A' ' 707' ' ' LYS . 0.9 OUTLIER -97.97 -2.89 39.44 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.915 0.388 . . . . 0.0 110.645 179.492 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -109.56 155.28 21.59 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.232 -170.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 746' ' ' VAL . . . . . 0.884 HG22 HD11 ' A' ' 795' ' ' LEU . 17.3 m -120.09 148.16 23.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.518 -0.764 . . . . 0.0 110.878 -178.266 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 747' ' ' LEU . . . . . 0.49 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 0.2 OUTLIER -117.73 106.03 12.62 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.142 178.296 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 10.4 mt -95.28 108.84 21.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 177.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -114.31 147.38 39.18 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.168 0.509 . . . . 0.0 111.625 -171.433 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 750' ' ' ASP . . . . . 0.835 ' HB2' ' HA ' ' A' ' 713' ' ' VAL . 31.0 t0 -98.1 121.75 40.4 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.427 179.573 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 57.1 -150.54 0.44 Allowed 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.063 -176.677 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 752' ' ' VAL . . . . . . . . . . . . . 6.6 t -97.61 106.21 18.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 O-C-N 122.015 -0.428 . . . . 0.0 112.13 -173.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 2.1 t -103.42 -8.12 9.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.433 169.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 3.9 m 52.59 45.48 28.54 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.82 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 755' ' ' LYS . . . . . 0.638 ' HE2' ' HH ' ' A' ' 736' ' ' TYR . 0.0 OUTLIER -96.13 116.83 29.58 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.254 177.547 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 756' ' ' LYS . . . . . 0.449 ' HD3' ' HA ' ' A' ' 756' ' ' LYS . 1.8 mmpt? -81.98 81.78 7.83 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.445 0.641 . . . . 0.0 109.801 176.213 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 757' ' ' TRP . . . . . 0.614 ' HB3' ' HB ' ' A' ' 762' ' ' VAL . 74.2 t-105 -72.03 103.46 3.26 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.222 -177.469 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.62 87.94 7.53 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 175.514 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 759' ' ' GLY . . . . . 0.564 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -161.91 -139.18 2.58 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.159 -179.017 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 14.8 ttt85 -70.04 -59.49 2.88 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.809 0.338 . . . . 0.0 110.455 -179.308 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -163.86 144.43 8.57 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.264 -178.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 762' ' ' VAL . . . . . 0.614 ' HB ' ' HB3' ' A' ' 757' ' ' TRP . 2.0 p -118.66 119.53 61.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.519 174.671 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 763' ' ' VAL . . . . . 0.447 HG13 HD21 ' A' ' 791' ' ' LEU . 45.6 t -107.88 108.34 25.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.642 -178.475 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 764' ' ' THR . . . . . . . . . . . . . 84.9 m -96.89 116.35 29.03 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.511 179.113 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 765' ' ' PHE . . . . . 0.652 ' HD2' HD13 ' A' ' 718' ' ' LEU . 1.6 m-30 -99.74 93.7 5.95 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 177.343 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 1.3 p -118.67 132.51 56.17 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.679 -177.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 767' ' ' ARG . . . . . 0.828 ' HA ' ' HB3' ' A' ' 784' ' ' SER . 0.4 OUTLIER -109.46 -58.94 1.97 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.753 0.311 . . . . 0.0 110.945 -173.278 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -102.33 -25.87 13.5 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.195 -178.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -109.59 92.77 4.18 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.034 0.445 . . . . 0.0 110.079 179.607 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 3.1 mp -101.09 109.08 24.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.607 -179.065 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -133.44 -9.92 1.98 Allowed Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.927 -179.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 772' ' ' ILE . . . . . 0.473 ' HA ' ' HD3' ' A' ' 773' ' ' PRO . 14.2 mt -104.84 138.39 19.49 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.741 0.27 . . . . 0.0 110.379 -178.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 773' ' ' PRO . . . . . 0.473 ' HD3' ' HA ' ' A' ' 772' ' ' ILE . 14.6 Cg_exo -69.14 162.81 40.23 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 123.315 2.677 . . . . 0.0 112.725 -179.854 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . 0.421 ' HB3' HG23 ' A' ' 782' ' ' VAL . 0.7 OUTLIER -98.89 -156.29 0.54 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.97 -178.399 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 775' ' ' GLU . . . . . 0.442 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 1.4 mp0 -61.42 72.43 0.01 OUTLIER 'General case' 0 C--O 1.234 0.251 0 CA-C-O 122.161 0.981 . . . . 0.0 112.343 176.262 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 5.2 ptmt -131.4 -25.12 2.21 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 114.067 -1.424 . . . . 0.0 108.541 170.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 777' ' ' ALA . . . . . 0.48 ' HB3' ' HB2' ' A' ' 780' ' ' GLU . . . -95.81 163.98 19.88 Favored Pre-proline 0 C--O 1.235 0.34 0 CA-C-N 114.812 -1.086 . . . . 0.0 109.511 175.644 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -68.04 70.82 0.85 Allowed 'Trans proline' 0 CA--C 1.533 0.463 0 C-N-CA 122.726 2.284 . . . . 0.0 113.237 -178.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 117.44 18.08 5.46 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.672 -0.775 . . . . 0.0 113.162 175.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 780' ' ' GLU . . . . . 0.48 ' HB2' ' HB3' ' A' ' 777' ' ' ALA . 2.2 tt0 -94.28 125.83 39.15 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 179.608 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 22.4 m95 -133.38 136.77 45.51 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . 0.421 HG23 ' HB3' ' A' ' 774' ' ' LEU . 27.9 m -134.35 161.71 40.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.824 174.523 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 783' ' ' HIS . . . . . . . . . . . . . 4.6 t-160 -172.98 146.34 1.5 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.582 174.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 784' ' ' SER . . . . . 0.828 ' HB3' ' HA ' ' A' ' 767' ' ' ARG . 0.9 OUTLIER -100.22 100.36 11.18 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 173.52 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -162.65 177.43 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.53 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -121.03 63.43 0.87 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.483 177.551 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 787' ' ' ALA . . . . . 0.411 ' HB2' ' CD2' ' A' ' 721' ' ' PHE . . . 54.75 68.44 2.62 Favored Pre-proline 0 N--CA 1.468 0.427 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.75 178.382 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 788' ' ' PRO . . . . . 0.828 ' HG2' ' HG2' ' A' ' 790' ' ' GLU . 76.5 Cg_endo -89.08 41.24 0.54 Allowed 'Trans proline' 0 N--CA 1.46 -0.443 0 C-N-CA 122.936 2.424 . . . . 0.0 112.978 -177.601 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 73.78 -28.17 0.19 Allowed 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 175.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 790' ' ' GLU . . . . . 0.828 ' HG2' ' HG2' ' A' ' 788' ' ' PRO . 1.2 pt-20 -65.68 -37.88 87.7 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.084 0.402 . . . . 0.0 112.084 -176.295 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 791' ' ' LEU . . . . . 0.462 ' N ' ' HG3' ' A' ' 790' ' ' GLU . 0.2 OUTLIER -67.04 -55.0 17.31 Favored Pre-proline 0 C--N 1.327 -0.375 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -177.491 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 792' ' ' PRO . . . . . 0.462 ' HD3' HD23 ' A' ' 722' ' ' LEU . 9.7 Cg_endo -55.35 -34.1 87.61 Favored 'Trans proline' 0 C--N 1.354 0.856 0 C-N-CA 121.854 1.703 . . . . 0.0 112.238 176.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -67.86 -44.45 77.06 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 120.96 0.41 . . . . 0.0 110.725 177.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 794' ' ' LEU . . . . . 0.4 ' O ' ' HB ' ' A' ' 798' ' ' ILE . 0.1 OUTLIER -63.36 -39.63 95.06 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.364 178.505 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 795' ' ' LEU . . . . . 0.884 HD11 HG22 ' A' ' 746' ' ' VAL . 0.0 OUTLIER -62.06 -34.68 76.71 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.812 179.646 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -62.85 -53.42 54.4 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.297 179.052 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 797' ' ' ARG . . . . . 0.59 ' HA ' HD11 ' A' ' 800' ' ' LEU . 0.0 OUTLIER -72.04 -21.56 61.52 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.944 0.402 . . . . 0.0 111.2 -179.449 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 798' ' ' ILE . . . . . 0.4 ' HB ' ' O ' ' A' ' 794' ' ' LEU . 0.1 OUTLIER -69.25 -28.42 38.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 121.186 0.517 . . . . 0.0 109.893 175.758 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -80.85 -61.14 2.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.663 173.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 800' ' ' LEU . . . . . 0.59 HD11 ' HA ' ' A' ' 797' ' ' ARG . 2.5 tp . . . . . 0 N--CA 1.468 0.432 0 O-C-N 124.233 0.958 . . . . 0.0 111.819 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 30.7 t0 . . . . . 0 C--O 1.232 0.145 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 825' ' ' MET . . . . . 0.527 ' HG2' HD13 ' A' ' 827' ' ' ILE . 9.3 ttt -88.04 111.77 21.9 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.591 178.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 826' ' ' MET . . . . . 0.571 ' HE2' ' HB2' ' A' ' 852' ' ' LYS . 0.9 OUTLIER -94.82 122.76 37.77 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.516 0.674 . . . . 0.0 111.367 -172.192 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 827' ' ' ILE . . . . . 0.527 HD13 ' HG2' ' A' ' 825' ' ' MET . 1.5 mm -115.11 125.39 72.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.529 176.018 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 828' ' ' LEU . . . . . 0.429 HD13 ' CG1' ' A' ' 863' ' ' VAL . 0.8 OUTLIER -93.42 115.95 28.49 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.625 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 829' ' ' VAL . . . . . 0.717 ' HB ' HG21 ' A' ' 853' ' ' THR . 0.0 OUTLIER -103.02 97.51 5.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.93 179.944 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 830' ' ' VAL . . . . . 0.483 ' H ' HG22 ' A' ' 830' ' ' VAL . 0.0 OUTLIER -113.54 112.65 41.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.17 -179.476 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 831' ' ' ASP . . . . . 0.676 ' HB2' ' HB3' ' A' ' 875' ' ' ASP . 0.0 OUTLIER -127.22 161.98 27.27 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.942 -175.534 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 832' ' ' ASP . . . . . 0.44 ' CG ' ' H ' ' A' ' 877' ' ' ASN . 1.6 p-10 -96.24 -13.64 23.27 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -175.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -122.25 102.49 39.95 Favored Pre-proline 0 C--N 1.322 -0.601 0 O-C-N 122.343 -0.223 . . . . 0.0 110.778 -175.456 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 834' ' ' PRO . . . . . 0.478 ' HB2' ' HB2' ' A' ' 743' ' ' PRO . 92.7 Cg_exo -42.82 -37.31 5.83 Favored 'Trans proline' 0 CA--C 1.533 0.47 0 C-N-CA 124.054 3.169 . . . . 0.0 114.776 -172.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -65.18 -36.54 78.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-O 121.096 0.474 . . . . 0.0 110.904 179.265 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 836' ' ' ASN . . . . . 0.624 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 0.7 OUTLIER -74.86 -40.72 60.83 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 179.039 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 837' ' ' ARG . . . . . 0.64 ' HG2' HG22 ' A' ' 853' ' ' THR . 3.9 ttt-85 -52.36 -41.25 62.92 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.431 177.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 1.3 tmm_? -67.4 -41.76 84.38 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.448 177.004 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 2.7 mt -63.8 -50.82 67.46 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.351 -176.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 840' ' ' LEU . . . . . 0.624 ' HG ' ' O ' ' A' ' 836' ' ' ASN . 0.0 OUTLIER -69.15 -32.21 71.41 Favored 'General case' 0 CA--C 1.517 -0.302 0 O-C-N 121.997 -0.439 . . . . 0.0 110.623 -178.621 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 841' ' ' ALA . . . . . 0.527 ' HB3' ' O ' ' A' ' 837' ' ' ARG . . . -65.08 -45.99 83.0 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 120.957 0.408 . . . . 0.0 110.49 177.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -62.75 -42.43 99.67 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.403 178.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 843' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -62.68 -40.97 98.76 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.886 178.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 844' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.52 -32.55 74.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.155 0.503 . . . . 0.0 109.762 176.667 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -66.9 -36.56 91.25 Favored Glycine 0 N--CA 1.446 -0.638 0 CA-C-N 115.489 -0.778 . . . . 0.0 112.027 174.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.24 -29.34 70.45 Favored 'General case' 0 N--CA 1.456 -0.138 0 CA-C-O 120.952 0.406 . . . . 0.0 110.494 176.748 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 847' ' ' LEU . . . . . 0.485 HD21 ' HA ' ' A' ' 847' ' ' LEU . 5.8 mt -74.62 -52.01 12.9 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.214 -0.448 . . . . 0.0 109.938 174.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 103.6 42.82 1.93 Allowed Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.641 176.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 1.7 m-30 -113.32 165.94 11.95 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.74 129.75 38.56 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 176.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.61 147.86 41.68 Favored 'General case' 0 C--N 1.321 -0.665 0 C-N-CA 120.584 -0.446 . . . . 0.0 111.35 -176.59 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 852' ' ' LYS . . . . . 0.571 ' HB2' ' HE2' ' A' ' 826' ' ' MET . 0.1 OUTLIER -127.84 109.59 11.77 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 173.54 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 853' ' ' THR . . . . . 0.717 HG21 ' HB ' ' A' ' 829' ' ' VAL . 0.2 OUTLIER -102.42 114.73 29.17 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -173.053 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 854' ' ' ALA . . . . . . . . . . . . . . . -134.24 178.83 6.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.156 179.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 20.1 p-10 -139.52 75.26 1.5 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.804 0.812 . . . . 0.0 111.239 179.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 856' ' ' ASP . . . . . 0.412 ' O ' HG11 ' A' ' 830' ' ' VAL . 27.9 t70 -172.17 159.13 4.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.577 176.146 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -94.14 -44.66 3.49 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.421 -0.895 . . . . 0.0 113.098 -177.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 2.0 p -75.22 -34.03 30.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 117.173 0.487 . . . . 0.0 111.947 -173.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.51 -20.34 62.85 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 120.94 -0.304 . . . . 0.0 110.687 179.266 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -63.66 -38.65 91.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.02 0.438 . . . . 0.0 109.971 174.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 861' ' ' LEU . . . . . 0.417 HD12 ' HB3' ' A' ' 889' ' ' ARG . 0.0 OUTLIER -69.13 -38.41 78.83 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.975 176.373 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 14.1 t30 -59.07 -52.88 63.82 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.028 177.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 863' ' ' VAL . . . . . 0.429 ' CG1' HD13 ' A' ' 828' ' ' LEU . 0.4 OUTLIER -65.73 -31.59 54.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.855 179.022 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 864' ' ' LEU . . . . . 0.588 ' HA ' HD11 ' A' ' 869' ' ' ILE . 0.8 OUTLIER -58.42 -34.32 70.65 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.176 0.512 . . . . 0.0 110.763 177.017 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 1.3 m -92.15 -17.06 25.44 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.604 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 1.1 mmmm -101.88 -2.76 29.2 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -174.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -162.04 161.04 28.22 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 -178.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 868' ' ' HIS . . . . . 0.558 ' O ' ' HG2' ' A' ' 826' ' ' MET . 0.0 OUTLIER -78.96 137.8 37.77 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 110.344 -0.243 . . . . 0.0 110.344 -178.306 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 869' ' ' ILE . . . . . 0.588 HD11 ' HA ' ' A' ' 864' ' ' LEU . 6.7 mt -135.27 142.47 39.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.525 178.572 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 870' ' ' ASP . . . . . 0.406 ' N ' HG21 ' A' ' 869' ' ' ILE . 4.5 m-20 -99.6 -62.95 1.17 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.829 177.779 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 871' ' ' ILE . . . . . . . . . . . . . 18.0 mm -121.61 140.74 44.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.215 178.234 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 872' ' ' VAL . . . . . 0.529 HG21 HG23 ' A' ' 869' ' ' ILE . 55.5 t -119.13 122.04 68.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 175.628 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 873' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -112.15 122.49 47.89 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 178.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -109.83 104.19 13.1 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.05 179.729 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 875' ' ' ASP . . . . . 0.676 ' HB3' ' HB2' ' A' ' 831' ' ' ASP . 37.5 t0 -97.46 112.09 24.08 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.061 -176.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 876' ' ' VAL . . . . . 0.402 ' O ' ' HA ' ' A' ' 903' ' ' THR . 1.1 t -128.38 124.89 62.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.48 0.657 . . . . 0.0 112.223 -172.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 877' ' ' ASN . . . . . 0.44 ' H ' ' CG ' ' A' ' 832' ' ' ASP . 1.3 t30 -98.94 -38.87 8.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.098 -0.955 . . . . 0.0 109.24 171.631 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 878' ' ' MET . . . . . 0.413 ' HE2' ' HB3' ' A' ' 878' ' ' MET . 0.1 OUTLIER . . . . . 0 C--N 1.323 -0.571 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.642 177.31 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.65 0 CA-C-O 120.12 -0.267 . . . . 0.0 113.173 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 23.2 p90 -126.51 -33.2 2.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 117.289 0.544 . . . . 0.0 111.077 -177.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 885' ' ' ARG . . . . . 0.691 ' O ' ' HB2' ' A' ' 889' ' ' ARG . 0.0 OUTLIER -60.22 -32.67 71.34 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.12 -178.777 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.32 -46.95 75.13 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.675 0.274 . . . . 0.0 110.694 -177.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.22 -37.48 61.08 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.063 0.459 . . . . 0.0 111.236 -176.701 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 -70.95 -47.24 60.1 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.823 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 889' ' ' ARG . . . . . 0.691 ' HB2' ' O ' ' A' ' 885' ' ' ARG . 0.0 OUTLIER -62.88 -39.12 93.49 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.394 -178.708 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 890' ' ' ILE . . . . . . . . . . . . . 4.3 tt -67.63 -40.38 83.99 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 C-N-CA 120.769 -0.373 . . . . 0.0 111.116 -178.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 891' ' ' ARG . . . . . 0.494 ' HA ' ' CB ' ' A' ' 895' ' ' LEU . 2.5 ptm180 -75.82 -23.87 55.81 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 120.74 0.305 . . . . 0.0 110.807 178.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -74.44 -44.3 52.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.868 -179.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 1.2 mt -67.85 -44.52 76.94 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.953 -178.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 155.76 67.41 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.399 178.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 895' ' ' LEU . . . . . 0.494 ' CB ' ' HA ' ' A' ' 891' ' ' ARG . 3.6 tp -76.12 111.27 11.35 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.794 0.331 . . . . 0.0 110.556 179.296 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -134.62 25.01 3.73 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.244 0.545 . . . . 0.0 110.339 177.295 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 897' ' ' LEU . . . . . 0.407 ' HA ' ' HD3' ' A' ' 898' ' ' PRO . 0.4 OUTLIER -135.76 150.13 70.91 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.863 -177.857 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 898' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 897' ' ' LEU . 14.4 Cg_exo -69.47 118.4 5.66 Favored 'Trans proline' 0 C--O 1.236 0.396 0 C-N-CA 122.812 2.341 . . . . 0.0 112.742 -178.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 899' ' ' VAL . . . . . 0.778 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 94.6 t -104.15 117.8 50.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 121.087 0.47 . . . . 0.0 109.905 175.567 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 900' ' ' ILE . . . . . 0.556 HG21 ' HB2' ' A' ' 921' ' ' SER . 5.9 mt -90.69 107.58 18.69 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.241 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 901' ' ' GLY . . . . . 0.556 ' O ' ' HA ' ' A' ' 922' ' ' CYS . . . -91.19 113.95 4.4 Favored Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.835 -0.698 . . . . 0.0 111.828 179.38 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 902' ' ' VAL . . . . . 0.499 ' HA ' ' O ' ' A' ' 923' ' ' LEU . 0.3 OUTLIER -113.47 130.63 67.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 -179.9 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 903' ' ' THR . . . . . 0.503 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.3 OUTLIER -131.08 160.97 33.11 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.7 -177.422 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -121.58 105.28 10.3 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.68 0.276 . . . . 0.0 111.582 -178.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 8.3 t30 61.14 51.33 4.45 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.559 172.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -90.46 -27.09 19.48 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 175.308 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 907' ' ' LEU . . . . . 0.481 HD13 ' HA ' ' A' ' 907' ' ' LEU . 0.0 OUTLIER 65.57 20.48 11.64 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.883 174.26 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -161.63 30.76 0.13 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.246 -0.888 . . . . 0.0 108.785 178.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.31 -34.36 77.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.884 -1.053 . . . . 0.0 111.182 -173.279 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 910' ' ' GLU . . . . . 0.59 ' HG2' ' N ' ' A' ' 911' ' ' LYS . 1.6 pm0 -67.6 -45.0 76.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.978 0.418 . . . . 0.0 110.52 -179.434 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 911' ' ' LYS . . . . . 0.59 ' N ' ' HG2' ' A' ' 910' ' ' GLU . 0.1 OUTLIER -72.29 -31.85 66.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.914 -177.926 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.02 -43.23 79.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.106 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 913' ' ' ARG . . . . . 0.495 ' HG3' ' N ' ' A' ' 914' ' ' CYS . 0.0 OUTLIER -66.64 -35.3 79.84 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 121.144 -0.222 . . . . 0.0 110.747 -179.663 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 914' ' ' CYS . . . . . 0.495 ' N ' ' HG3' ' A' ' 913' ' ' ARG . 91.3 m -72.4 -35.93 68.54 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.868 0.366 . . . . 0.0 110.648 178.343 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 1.1 tp -65.87 -41.42 91.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.102 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -75.2 -40.1 59.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.019 -179.38 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 50.45 45.16 26.7 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.909 177.758 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -145.09 25.59 1.9 Allowed Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.422 -178.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 919' ' ' MET . . . . . 0.778 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -119.4 -111.46 0.34 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.559 0.179 . . . . 0.0 110.814 -177.832 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 920' ' ' ASP . . . . . 0.499 ' HB2' ' O ' ' A' ' 919' ' ' MET . 13.8 t70 167.0 -53.95 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.971 0.908 . . . . 0.0 109.673 176.653 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 921' ' ' SER . . . . . 0.556 ' HB2' HG21 ' A' ' 900' ' ' ILE . 0.0 OUTLIER -118.32 172.13 7.66 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.052 -177.717 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 922' ' ' CYS . . . . . 0.556 ' HA ' ' O ' ' A' ' 901' ' ' GLY . 0.5 OUTLIER -154.18 139.1 17.2 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.019 -179.513 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 923' ' ' LEU . . . . . 0.499 ' O ' ' HA ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -156.92 -175.47 5.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.772 175.178 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 924' ' ' SER . . . . . 0.503 ' HA ' ' O ' ' A' ' 903' ' ' THR . 0.5 OUTLIER -105.05 160.27 15.18 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.608 -179.059 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 925' ' ' LYS . . . . . 0.527 ' HB3' ' HD3' ' A' ' 926' ' ' PRO . 2.1 tttp -53.59 -48.36 93.34 Favored Pre-proline 0 CA--C 1.544 0.715 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 926' ' ' PRO . . . . . 0.527 ' HD3' ' HB3' ' A' ' 925' ' ' LYS . 31.8 Cg_exo -60.6 98.5 0.13 Allowed 'Trans proline' 0 C--N 1.357 0.981 0 C-N-CA 122.101 1.867 . . . . 0.0 112.53 175.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 927' ' ' VAL . . . . . 0.658 HG13 HG12 ' A' ' 932' ' ' ILE . 19.8 t -134.74 125.7 46.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.825 179.224 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -88.7 173.84 8.36 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.696 -0.229 . . . . 0.0 110.751 177.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 929' ' ' LEU . . . . . 0.476 HD22 ' HA ' ' A' ' 929' ' ' LEU . 0.5 OUTLIER -61.13 -32.67 72.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.621 0.248 . . . . 0.0 110.76 -179.129 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -70.9 -39.03 73.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.883 0.373 . . . . 0.0 110.38 -178.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 931' ' ' VAL . . . . . 0.416 ' HB ' HG12 ' A' ' 927' ' ' VAL . 46.8 t -70.59 -41.24 77.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.306 178.173 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 932' ' ' ILE . . . . . 0.658 HG12 HG13 ' A' ' 927' ' ' VAL . 0.3 OUTLIER -61.77 -41.46 90.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 109.97 -0.382 . . . . 0.0 109.97 177.308 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 933' ' ' LYS . . . . . 0.475 ' N ' HG23 ' A' ' 932' ' ' ILE . 0.0 OUTLIER -66.87 -48.9 67.37 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.213 -177.776 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 934' ' ' GLN . . . . . 0.525 ' O ' ' HB2' ' A' ' 938' ' ' LEU . 0.0 OUTLIER -64.02 -31.71 73.0 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 121.22 -0.192 . . . . 0.0 111.225 -176.751 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 15.8 m -74.52 -46.41 39.36 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 120.687 0.279 . . . . 0.0 111.008 178.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 936' ' ' LEU . . . . . 0.516 HD13 ' HA ' ' A' ' 936' ' ' LEU . 0.0 OUTLIER -63.5 -43.18 97.99 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.496 -179.943 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 37.6 m -66.61 -41.09 88.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.544 179.057 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 938' ' ' LEU . . . . . 0.525 ' HB2' ' O ' ' A' ' 934' ' ' GLN . 0.3 OUTLIER -59.53 -46.11 89.83 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.333 0.587 . . . . 0.0 110.607 179.251 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -77.76 -25.36 49.06 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.245 -177.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -62.86 -39.72 95.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.903 0.382 . . . . 0.0 110.386 174.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 941' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.26 -34.85 71.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.137 177.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 942' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.06 -47.89 75.72 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.772 179.133 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 35.4 m -71.25 -28.49 32.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.651 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.74 -50.54 71.92 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.827 177.359 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 945' ' ' LYS . . . . . 0.507 ' H ' ' HG2' ' A' ' 945' ' ' LYS . 0.0 OUTLIER -77.31 -22.67 51.6 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.789 0.328 . . . . 0.0 111.392 -178.97 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 49.3 m -73.6 -29.86 62.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.921 0.391 . . . . 0.0 110.724 177.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -95.83 -61.51 1.44 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.675 -178.749 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 1.7 t70 . . . . . 0 C--N 1.325 -0.475 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.785 -178.548 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 705' ' ' SER . . . . . 0.441 ' HA ' ' HA3' ' A' ' 730' ' ' GLY . 0.5 OUTLIER . . . . . 0 N--CA 1.453 -0.304 0 CA-C-O 120.719 0.295 . . . . 0.0 110.665 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 116.1 -25.94 9.07 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.148 177.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 707' ' ' LYS . . . . . 0.512 ' HA ' ' HD2' ' A' ' 707' ' ' LYS . 10.2 mmmt -69.78 132.75 46.56 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 176.51 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 708' ' ' ARG . . . . . 0.437 ' HA ' HG21 ' A' ' 732' ' ' VAL . 24.9 mtt85 -100.61 161.56 13.51 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.478 0.656 . . . . 0.0 111.33 -173.542 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 1.1 m -136.78 113.85 10.59 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.253 -0.885 . . . . 0.0 108.722 173.038 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 710' ' ' TRP . . . . . 0.461 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 87.8 m95 -90.5 112.57 24.28 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.401 0.619 . . . . 0.0 110.153 -173.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 711' ' ' LEU . . . . . 0.42 HD13 ' HB2' ' A' ' 719' ' ' CYS . 0.4 OUTLIER -111.83 119.84 39.93 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.109 -0.95 . . . . 0.0 111.061 -170.194 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -126.66 63.84 1.28 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.825 177.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 713' ' ' VAL . . . . . 0.707 HG12 ' HB3' ' A' ' 750' ' ' ASP . 90.4 t -117.27 121.42 67.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.273 -179.239 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 13.8 mtt85 -71.81 -34.0 68.98 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.589 -179.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -69.7 108.01 3.71 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.525 178.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 716' ' ' ALA . . . . . 0.581 ' O ' ' HB2' ' A' ' 720' ' ' GLN . . . -65.15 -32.31 73.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.829 -174.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.11 -44.97 78.58 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.304 0.573 . . . . 0.0 110.344 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.93 -49.04 64.17 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.774 177.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 719' ' ' CYS . . . . . 0.578 ' SG ' ' HA ' ' A' ' 716' ' ' ALA . 3.0 p -63.73 -42.46 97.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.999 -175.744 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 720' ' ' GLN . . . . . 0.581 ' HB2' ' O ' ' A' ' 716' ' ' ALA . 0.1 OUTLIER -65.47 -36.73 84.76 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 111.568 0.21 . . . . 0.0 111.568 -179.26 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -55.44 -59.27 5.05 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.925 0.393 . . . . 0.0 110.508 178.641 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 722' ' ' LEU . . . . . 0.41 HD23 ' HD3' ' A' ' 792' ' ' PRO . 6.9 mt -65.38 -47.26 77.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.28 -178.443 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 723' ' ' GLU . . . . . 0.526 ' HB3' ' O ' ' A' ' 719' ' ' CYS . 0.1 OUTLIER -60.11 -48.47 81.57 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.337 -174.411 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 724' ' ' THR . . . . . . . . . . . . . 45.7 m -67.36 -36.4 81.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.186 -177.109 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 42.9 m -68.27 -37.34 80.62 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.787 0.327 . . . . 0.0 111.297 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 726' ' ' LEU . . . . . . . . . . . . . 14.2 mt -76.51 -38.13 55.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.443 -175.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 2.5 pp0? -74.77 0.44 15.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.621 0.248 . . . . 0.0 111.531 -178.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 2.2 mtm180 -64.27 -35.18 80.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.824 0.345 . . . . 0.0 110.204 178.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 729' ' ' SER . . . . . 0.429 ' HB2' ' H ' ' A' ' 730' ' ' GLY . 0.0 OUTLIER -93.32 -100.24 0.14 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.26 177.418 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 730' ' ' GLY . . . . . 0.441 ' HA3' ' HA ' ' A' ' 705' ' ' SER . . . -143.46 20.97 2.23 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.802 -0.713 . . . . 0.0 111.717 178.721 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 731' ' ' ILE . . . . . . . . . . . . . 20.6 mm -83.32 116.21 27.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.925 0.393 . . . . 0.0 110.226 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 732' ' ' VAL . . . . . 0.437 HG21 ' HA ' ' A' ' 708' ' ' ARG . 0.0 OUTLIER -87.19 97.29 6.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.118 0.485 . . . . 0.0 110.966 -176.64 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 733' ' ' VAL . . . . . 0.403 HG21 ' HA ' ' A' ' 723' ' ' GLU . 6.1 t -77.34 135.85 25.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.556 176.134 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -143.98 135.33 25.77 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.823 0.344 . . . . 0.0 111.219 -173.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.17 112.61 1.59 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.937 176.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 736' ' ' TYR . . . . . 0.461 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 66.7 t80 -90.24 99.33 12.37 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.984 -176.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 737' ' ' GLU . . . . . 0.422 ' H ' ' HG3' ' A' ' 737' ' ' GLU . 0.0 OUTLIER -103.23 -51.21 3.29 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 173.167 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -160.41 75.57 0.19 Allowed Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.907 -0.663 . . . . 0.0 111.91 175.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 739' ' ' GLN . . . . . 0.438 ' HG2' ' CZ3' ' A' ' 710' ' ' TRP . 1.2 mp0 -111.93 -161.39 0.75 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.475 0.178 . . . . 0.0 110.74 -178.24 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -104.48 136.54 19.16 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.364 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 741' ' ' PRO . . . . . 0.469 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 64.8 Cg_endo -84.04 123.35 3.12 Favored 'Trans proline' 0 N--CA 1.454 -0.845 0 C-N-CA 122.473 2.115 . . . . 0.0 111.894 176.421 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 742' ' ' THR . . . . . 0.55 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.1 OUTLIER -96.77 140.64 22.24 Favored Pre-proline 0 C--N 1.316 -0.889 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.863 176.886 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 743' ' ' PRO . . . . . 0.55 ' HD2' HG22 ' A' ' 742' ' ' THR . 28.3 Cg_endo -61.87 -13.67 32.19 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 123.171 2.581 . . . . 0.0 113.306 -173.818 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 744' ' ' GLU . . . . . 0.454 ' C ' ' HZ3' ' A' ' 707' ' ' LYS . 0.0 OUTLIER -116.36 5.87 13.6 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.031 178.888 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -102.09 153.78 19.6 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 120.979 0.419 . . . . 0.0 110.458 -177.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 746' ' ' VAL . . . . . 0.846 HG21 HD13 ' A' ' 795' ' ' LEU . 26.9 m -117.49 147.98 20.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 121.323 0.583 . . . . 0.0 111.927 -175.085 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 747' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -106.53 125.5 51.08 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.861 175.833 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 748' ' ' ILE . . . . . 0.446 HD12 HG22 ' A' ' 748' ' ' ILE . 2.5 mm -113.97 107.11 22.08 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 175.456 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 749' ' ' THR . . . . . 0.43 ' OG1' HG23 ' A' ' 753' ' ' VAL . 1.8 t -118.1 153.26 34.07 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.73 -0.214 . . . . 0.0 110.747 -176.787 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 750' ' ' ASP . . . . . 0.707 ' HB3' HG12 ' A' ' 713' ' ' VAL . 1.6 p-10 -100.9 146.76 26.94 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.587 -0.279 . . . . 0.0 110.475 175.146 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 61.88 -170.88 0.16 Allowed 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.768 178.263 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 752' ' ' VAL . . . . . . . . . . . . . 9.7 t -82.44 126.65 40.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.161 177.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 753' ' ' VAL . . . . . 0.43 HG23 ' OG1' ' A' ' 749' ' ' THR . 5.4 m -132.36 157.53 43.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.059 -179.599 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.57 76.09 10.21 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.911 0.386 . . . . 0.0 110.168 176.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.5 149.58 36.17 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.005 -177.696 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 11.6 tptt -121.55 -36.13 3.11 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.595 175.076 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 757' ' ' TRP . . . . . 0.469 ' CH2' ' HA ' ' A' ' 741' ' ' PRO . 68.0 t-105 69.27 95.89 0.07 Allowed 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.342 176.661 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -83.96 51.12 1.97 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.255 0.55 . . . . 0.0 110.402 177.681 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 759' ' ' GLY . . . . . . . . . . . . . . . -121.26 -135.07 4.72 Favored Glycine 0 N--CA 1.444 -0.778 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.667 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 3.3 ttt-85 -81.58 -60.94 2.08 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.94 0.4 . . . . 0.0 111.24 178.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -158.31 148.34 19.93 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.947 -176.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 4.5 p -117.9 127.47 75.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-O 121.41 0.624 . . . . 0.0 110.234 176.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 763' ' ' VAL . . . . . 0.615 HG11 HD23 ' A' ' 791' ' ' LEU . 46.2 t -111.27 122.23 65.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.761 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.722 177.443 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 764' ' ' THR . . . . . 0.71 HG22 ' HG ' ' A' ' 766' ' ' CYS . 3.9 m -107.7 116.54 32.13 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.436 -176.189 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 765' ' ' PHE . . . . . 0.48 ' HE1' HG21 ' A' ' 785' ' ' VAL . 12.3 m-85 -90.24 83.86 6.02 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.609 174.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 766' ' ' CYS . . . . . 0.71 ' HG ' HG22 ' A' ' 764' ' ' THR . 0.0 OUTLIER -96.38 131.34 43.03 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 -177.431 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.25 -30.24 5.66 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.886 0.374 . . . . 0.0 110.787 -175.576 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 13.2 mmm180 -102.09 -59.02 1.77 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.928 -179.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -116.56 133.35 56.12 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.87 -176.818 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 3.2 mp -117.71 91.27 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 121.203 0.525 . . . . 0.0 109.739 176.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -135.02 11.56 4.47 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.03 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 772' ' ' ILE . . . . . 0.619 HG12 ' HD2' ' A' ' 773' ' ' PRO . 0.1 OUTLIER -96.49 152.56 38.72 Favored Pre-proline 0 C--N 1.324 -0.521 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 -178.536 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 773' ' ' PRO . . . . . 0.619 ' HD2' HG12 ' A' ' 772' ' ' ILE . 84.7 Cg_exo -49.63 118.62 3.89 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 123.105 2.537 . . . . 0.0 113.005 178.521 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . 0.58 ' HB2' HG22 ' A' ' 782' ' ' VAL . 0.6 OUTLIER -98.19 -168.22 1.62 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.534 178.98 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 775' ' ' GLU . . . . . 0.553 ' HG3' ' HA ' ' A' ' 781' ' ' TRP . 1.3 mp0 -63.96 72.99 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 121.793 0.806 . . . . 0.0 112.874 178.339 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -129.62 6.09 5.16 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 114.751 -1.113 . . . . 0.0 108.532 169.199 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -139.96 162.99 47.43 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 114.296 -1.32 . . . . 0.0 108.751 179.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -80.13 36.11 0.6 Allowed 'Trans proline' 0 CA--C 1.53 0.323 0 C-N-CA 122.414 2.076 . . . . 0.0 113.255 -175.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 177.32 31.53 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.246 -0.978 . . . . 0.0 112.72 -179.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 780' ' ' GLU . . . . . 0.465 ' HG2' ' HB2' ' A' ' 773' ' ' PRO . 0.9 OUTLIER -137.68 123.37 19.86 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 179.798 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 781' ' ' TRP . . . . . 0.553 ' HA ' ' HG3' ' A' ' 775' ' ' GLU . 25.2 m95 -137.55 143.86 41.79 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 123.188 0.305 . . . . 0.0 110.243 -177.336 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . 0.58 HG22 ' HB2' ' A' ' 774' ' ' LEU . 35.7 m -126.34 146.96 31.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 120.872 0.367 . . . . 0.0 110.516 171.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 783' ' ' HIS . . . . . 0.458 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 2.1 t-160 -160.64 138.73 9.79 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.828 0.347 . . . . 0.0 110.71 175.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 1.7 m -105.33 100.64 10.22 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.579 174.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 785' ' ' VAL . . . . . 0.48 HG21 ' HE1' ' A' ' 765' ' ' PHE . 0.0 OUTLIER -165.93 -176.76 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 178.323 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -111.66 31.65 6.01 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.867 0.365 . . . . 0.0 110.212 176.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 55.01 67.93 2.89 Favored Pre-proline 0 N--CA 1.467 0.383 0 CA-C-N 115.084 -0.962 . . . . 0.0 112.441 178.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 788' ' ' PRO . . . . . 0.552 ' HD2' ' OE1' ' A' ' 790' ' ' GLU . 16.9 Cg_exo -67.29 -66.21 0.04 OUTLIER 'Trans proline' 0 CA--C 1.529 0.255 0 C-N-CA 122.461 2.108 . . . . 0.0 111.955 179.096 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -170.39 24.32 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.937 0.399 . . . . 0.0 111.403 179.721 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 790' ' ' GLU . . . . . 0.552 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -104.45 -48.38 3.84 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.952 0.406 . . . . 0.0 110.212 -178.983 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 791' ' ' LEU . . . . . 0.615 HD23 HG11 ' A' ' 763' ' ' VAL . 0.4 OUTLIER -67.34 -47.54 48.6 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.622 179.794 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 792' ' ' PRO . . . . . 0.515 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 9.6 Cg_endo -57.98 -27.3 78.63 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 121.698 1.599 . . . . 0.0 111.952 175.192 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -76.19 -44.05 39.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.792 0.329 . . . . 0.0 110.599 177.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 794' ' ' LEU . . . . . 0.513 ' HA ' HD23 ' A' ' 794' ' ' LEU . 1.1 tm? -60.54 -42.69 97.02 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 121.166 0.507 . . . . 0.0 110.136 176.053 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 795' ' ' LEU . . . . . 0.846 HD13 HG21 ' A' ' 746' ' ' VAL . 0.2 OUTLIER -63.87 -39.06 93.32 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.602 179.343 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -61.41 -47.3 86.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.362 175.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 797' ' ' ARG . . . . . 0.421 ' CZ ' ' HB2' ' A' ' 797' ' ' ARG . 0.0 OUTLIER -59.43 -41.92 90.68 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.058 179.375 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -75.56 -17.72 15.75 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.709 -177.361 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 2.3 m-30 -103.6 9.8 37.23 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.677 0.275 . . . . 0.0 110.66 178.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 95.4 mt . . . . . 0 N--CA 1.468 0.468 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.452 179.919 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 22.3 t70 . . . . . 0 CA--C 1.518 -0.264 0 CA-C-O 121.072 0.463 . . . . 0.0 110.357 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 825' ' ' MET . . . . . 0.424 ' HA ' ' OD2' ' A' ' 870' ' ' ASP . 0.0 OUTLIER -105.26 139.73 39.47 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.516 -179.852 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 826' ' ' MET . . . . . 0.686 ' HB2' ' HA ' ' A' ' 869' ' ' ILE . 0.0 OUTLIER -123.31 135.51 54.24 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.904 0.383 . . . . 0.0 110.75 177.574 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 827' ' ' ILE . . . . . 0.626 ' HB ' HD21 ' A' ' 844' ' ' LEU . 2.3 mm -120.02 120.34 62.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 176.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 828' ' ' LEU . . . . . 0.71 HD13 ' HB3' ' A' ' 852' ' ' LYS . 0.9 OUTLIER -105.2 123.48 47.91 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.78 0.324 . . . . 0.0 110.705 -178.759 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 829' ' ' VAL . . . . . 0.547 HG21 HD11 ' A' ' 840' ' ' LEU . 1.0 OUTLIER -102.29 118.81 49.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.092 0.472 . . . . 0.0 110.441 177.332 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 830' ' ' VAL . . . . . 0.471 ' HA ' ' O ' ' A' ' 854' ' ' ALA . 0.2 OUTLIER -109.22 86.98 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.75 177.594 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 831' ' ' ASP . . . . . 0.685 ' HA ' ' O ' ' A' ' 875' ' ' ASP . 0.1 OUTLIER -106.7 147.47 29.55 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.873 0.368 . . . . 0.0 110.883 -176.101 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -89.24 -25.64 21.62 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -175.743 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 833' ' ' HIS . . . . . 0.435 ' HA ' ' HD2' ' A' ' 834' ' ' PRO . 0.6 OUTLIER -114.71 106.21 52.39 Favored Pre-proline 0 N--CA 1.464 0.275 0 O-C-N 121.941 -0.475 . . . . 0.0 111.681 -174.167 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 834' ' ' PRO . . . . . 0.435 ' HD2' ' HA ' ' A' ' 833' ' ' HIS . 1.7 Cg_endo -40.75 -47.07 4.75 Favored 'Trans proline' 0 C--N 1.349 0.555 1 C-N-CA 125.319 4.013 . . . . 0.0 115.604 -169.59 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 1.1 pp -59.32 -38.78 76.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 CA-C-O 121.243 0.544 . . . . 0.0 111.164 -176.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 836' ' ' ASN . . . . . 0.574 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 3.2 m-80 -68.63 -46.46 69.18 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.669 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 837' ' ' ARG . . . . . 0.553 ' HB2' ' OD2' ' A' ' 831' ' ' ASP . 0.0 OUTLIER -52.49 -45.73 66.31 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.495 178.262 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -59.06 -41.81 88.83 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.166 -179.563 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.02 -53.55 25.02 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -176.484 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 840' ' ' LEU . . . . . 0.574 ' HG ' ' O ' ' A' ' 836' ' ' ASN . 0.0 OUTLIER -73.78 -27.95 61.41 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.583 -175.824 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -69.45 -29.9 67.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.963 0.411 . . . . 0.0 110.091 177.076 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -69.49 -41.16 76.49 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.961 175.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 843' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -62.84 -39.15 93.47 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.849 176.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 844' ' ' LEU . . . . . 0.626 HD21 ' HB ' ' A' ' 827' ' ' ILE . 0.0 OUTLIER -63.61 -31.31 72.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.636 174.957 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -69.78 -27.35 73.33 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.154 176.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.06 -45.64 17.94 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.653 0.263 . . . . 0.0 110.683 177.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -152.77 84.5 1.23 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.122 0.487 . . . . 0.0 110.345 176.732 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . -155.03 23.57 0.6 Allowed Glycine 0 N--CA 1.443 -0.835 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.029 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 11.2 m-85 55.52 -128.06 2.12 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.67 108.42 18.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.801 0.334 . . . . 0.0 110.225 176.58 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 851' ' ' CYS . . . . . 0.454 ' HB3' HD22 ' A' ' 844' ' ' LEU . 0.0 OUTLIER -80.97 125.97 30.8 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.597 -177.526 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 852' ' ' LYS . . . . . 0.71 ' HB3' HD13 ' A' ' 828' ' ' LEU . 0.0 OUTLIER -122.42 146.75 47.07 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 174.827 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -131.51 142.81 50.03 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -173.687 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 854' ' ' ALA . . . . . 0.471 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -156.46 165.48 36.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.011 175.612 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 855' ' ' ASN . . . . . 0.431 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 0.9 OUTLIER -148.76 74.04 1.25 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.887 0.375 . . . . 0.0 111.23 176.598 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 856' ' ' ASP . . . . . 0.431 ' HB2' ' O ' ' A' ' 855' ' ' ASN . 7.1 t70 172.73 145.27 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.916 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -66.0 -39.5 94.84 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.034 177.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 1.5 t -73.53 -32.28 35.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 O-C-N 122.713 -0.287 . . . . 0.0 110.87 -178.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -70.52 -34.02 71.82 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.005 0.431 . . . . 0.0 110.271 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 860' ' ' ALA . . . . . 0.468 ' HB2' HG13 ' A' ' 830' ' ' VAL . . . -64.72 -37.42 87.52 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.192 176.117 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 861' ' ' LEU . . . . . 0.58 HD21 HD12 ' A' ' 890' ' ' ILE . 1.4 mt -71.18 -35.31 71.54 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.42 176.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 40.8 t30 -65.8 -49.81 66.93 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.105 -179.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 863' ' ' VAL . . . . . 0.538 HG13 HD23 ' A' ' 828' ' ' LEU . 10.7 p -64.93 -32.26 57.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.361 178.664 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 864' ' ' LEU . . . . . 0.507 HD21 ' HA ' ' A' ' 864' ' ' LEU . 0.5 OUTLIER -64.59 -42.75 95.39 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.624 175.642 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 16.5 m -69.08 -22.19 64.02 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.859 -179.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -79.16 -27.77 42.72 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.924 175.419 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 19.4 t30 62.61 94.66 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.133 -0.94 . . . . 0.0 112.644 175.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -171.18 53.08 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.251 170.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 869' ' ' ILE . . . . . 0.686 ' HA ' ' HB2' ' A' ' 826' ' ' MET . 0.1 OUTLIER -152.11 154.66 7.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.525 179.316 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 870' ' ' ASP . . . . . 0.424 ' OD2' ' HA ' ' A' ' 825' ' ' MET . 13.7 m-20 -112.11 -49.46 2.97 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.568 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 871' ' ' ILE . . . . . 0.478 HG21 HD23 ' A' ' 873' ' ' LEU . 41.8 mm -118.62 133.86 64.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.023 177.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 872' ' ' VAL . . . . . 0.697 HG22 HD21 ' A' ' 828' ' ' LEU . 13.5 t -116.72 128.48 74.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.954 -0.388 . . . . 0.0 109.954 177.034 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 873' ' ' LEU . . . . . 0.478 HD23 HG21 ' A' ' 871' ' ' ILE . 0.2 OUTLIER -109.74 113.24 25.84 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.875 0.369 . . . . 0.0 110.686 179.835 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.81 96.32 9.71 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 175.408 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 875' ' ' ASP . . . . . 0.696 ' CG ' ' HZ1' ' A' ' 925' ' ' LYS . 48.0 t0 -105.83 117.9 35.21 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.005 -173.376 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 876' ' ' VAL . . . . . 0.484 HG13 ' H ' ' A' ' 878' ' ' MET . 2.4 t -141.58 133.31 27.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.114 0.483 . . . . 0.0 111.517 -175.019 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 877' ' ' ASN . . . . . 0.44 ' HB2' ' CE ' ' A' ' 925' ' ' LYS . 40.4 t-20 -127.47 54.77 1.65 Allowed 'General case' 0 C--O 1.234 0.273 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 171.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 878' ' ' MET . . . . . 0.484 ' H ' HG13 ' A' ' 876' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--N 1.322 -0.607 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.915 -179.535 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.614 0 N-CA-C 110.264 -1.134 . . . . 0.0 110.264 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -177.66 -24.05 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -173.212 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 885' ' ' ARG . . . . . 0.442 ' C ' ' HD2' ' A' ' 885' ' ' ARG . 2.1 tmm_? -55.2 -49.6 71.53 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.989 -178.602 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 886' ' ' LEU . . . . . 0.5 ' HG ' ' N ' ' A' ' 887' ' ' THR . 0.2 OUTLIER -65.51 -34.22 77.75 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.359 -177.652 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 887' ' ' THR . . . . . 0.868 HG22 ' HG2' ' A' ' 919' ' ' MET . 0.0 OUTLIER -75.81 -33.33 60.1 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-O 120.742 0.306 . . . . 0.0 111.502 -178.413 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -57.26 -41.81 80.35 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 173.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 889' ' ' ARG . . . . . 0.482 ' HG2' HD22 ' A' ' 861' ' ' LEU . 0.0 OUTLIER -70.07 -33.53 72.04 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.2 177.344 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 890' ' ' ILE . . . . . 0.58 HD12 HD21 ' A' ' 861' ' ' LEU . 1.5 tp -68.09 -36.97 77.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 N-CA-C 111.798 0.295 . . . . 0.0 111.798 -177.654 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 891' ' ' ARG . . . . . 0.535 ' HA ' HD23 ' A' ' 895' ' ' LEU . 1.9 ptm180 -75.39 -28.58 59.52 Favored 'General case' 0 N--CA 1.46 0.067 0 C-N-CA 120.289 -0.564 . . . . 0.0 110.459 177.605 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -69.99 -34.61 73.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.061 0.458 . . . . 0.0 110.797 175.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 893' ' ' LEU . . . . . 0.468 ' HA ' HD23 ' A' ' 893' ' ' LEU . 2.7 mt -74.64 -45.72 42.91 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.808 179.423 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 122.61 70.23 0.25 Allowed Glycine 0 N--CA 1.448 -0.513 0 N-CA-C 111.386 -0.685 . . . . 0.0 111.386 -178.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 895' ' ' LEU . . . . . 0.535 HD23 ' HA ' ' A' ' 891' ' ' ARG . 0.6 OUTLIER -64.45 117.36 7.19 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.393 0.616 . . . . 0.0 110.843 -176.883 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.57 0.5 24.58 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.26 -178.257 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 897' ' ' LEU . . . . . 0.625 HD11 HG23 ' A' ' 872' ' ' VAL . 1.0 OUTLIER -126.81 154.02 75.98 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.788 -175.595 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -73.09 127.79 12.41 Favored 'Trans proline' 0 C--O 1.239 0.533 0 C-N-CA 123.084 2.522 . . . . 0.0 112.326 179.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 899' ' ' VAL . . . . . 0.792 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 3.2 t -108.42 116.07 50.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.365 178.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 900' ' ' ILE . . . . . 0.418 HD13 HG23 ' A' ' 900' ' ' ILE . 42.0 mt -95.09 106.67 18.48 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.887 178.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -86.94 93.32 1.87 Allowed Glycine 0 N--CA 1.445 -0.762 0 C-N-CA 120.867 -0.682 . . . . 0.0 112.341 -177.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 902' ' ' VAL . . . . . 0.596 ' O ' ' HA ' ' A' ' 875' ' ' ASP . 0.2 OUTLIER -91.0 108.76 20.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-O 121.663 0.744 . . . . 0.0 109.603 178.007 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -126.33 152.86 45.66 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.919 -179.014 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -71.23 105.39 3.42 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 168.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -48.31 110.76 0.37 Allowed 'General case' 0 CA--C 1.515 -0.376 0 O-C-N 124.073 0.858 . . . . 0.0 110.96 -171.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -85.52 -56.96 3.26 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.199 -175.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -166.84 -50.04 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 178.054 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -134.48 42.65 2.84 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.012 0.434 . . . . 0.0 111.335 -174.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.03 -31.72 72.44 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.394 -178.483 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 910' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -39.65 94.96 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.163 176.375 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.47 -36.61 79.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.109 178.293 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -60.39 -47.9 84.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.169 176.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.85 -43.77 90.86 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.147 179.761 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 75.6 m -63.99 -32.5 74.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.807 0.337 . . . . 0.0 110.794 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 2.5 tp -70.59 -51.57 27.42 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.454 -179.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.54 -44.08 45.38 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.708 -175.392 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 51.19 42.48 28.86 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.208 0.528 . . . . 0.0 111.143 -176.226 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 918' ' ' GLY . . . . . 0.42 ' O ' HD13 ' A' ' 895' ' ' LEU . . . -119.59 -25.75 2.55 Favored Glycine 0 N--CA 1.447 -0.629 0 CA-C-N 115.716 -0.674 . . . . 0.0 112.225 -177.423 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 919' ' ' MET . . . . . 0.868 ' HG2' HG22 ' A' ' 887' ' ' THR . 2.1 mtt -78.41 -102.83 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.774 0.321 . . . . 0.0 110.158 177.12 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 920' ' ' ASP . . . . . 0.49 ' HB2' ' O ' ' A' ' 919' ' ' MET . 19.6 t70 170.3 -65.31 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 123.699 0.8 . . . . 0.0 109.772 175.196 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -113.26 158.32 20.66 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.802 -177.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 922' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -116.72 118.99 34.08 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 175.553 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 923' ' ' LEU . . . . . 0.485 ' HA ' HD21 ' A' ' 923' ' ' LEU . 0.3 OUTLIER -116.02 161.23 19.17 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.119 -178.858 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 2.6 m -102.15 137.62 40.17 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.313 178.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 925' ' ' LYS . . . . . 0.696 ' HZ1' ' CG ' ' A' ' 875' ' ' ASP . 0.0 OUTLIER -52.0 -41.46 79.86 Favored Pre-proline 0 CA--C 1.541 0.597 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 177.726 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -67.78 65.94 0.88 Allowed 'Trans proline' 0 C--N 1.357 1.004 0 C-N-CA 121.975 1.783 . . . . 0.0 112.417 171.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 927' ' ' VAL . . . . . 0.412 ' O ' HG13 ' A' ' 927' ' ' VAL . 5.3 p -99.19 145.65 9.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.139 179.053 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 34.0 p -102.91 174.06 6.04 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.586 0.231 . . . . 0.0 110.441 179.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 929' ' ' LEU . . . . . 0.442 ' HA ' HD23 ' A' ' 929' ' ' LEU . 0.0 OUTLIER -60.85 -34.74 75.06 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 175.141 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -74.45 -45.62 45.17 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.209 -177.69 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 79.0 t -67.4 -38.99 81.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 120.905 0.383 . . . . 0.0 110.735 -179.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 932' ' ' ILE . . . . . 0.494 HG23 ' N ' ' A' ' 933' ' ' LYS . 0.4 OUTLIER -63.47 -37.59 79.96 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 175.583 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 933' ' ' LYS . . . . . 0.494 ' N ' HG23 ' A' ' 932' ' ' ILE . 20.2 ttmt -63.66 -48.38 77.43 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.579 177.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -55.04 -54.97 36.2 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.346 178.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 1.5 m -62.11 -46.29 89.69 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.725 -176.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 936' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.7 -44.51 96.06 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.61 -0.268 . . . . 0.0 110.797 -179.507 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 56.1 m -64.33 -48.24 76.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.307 -179.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 3.1 tp -63.1 -37.38 86.97 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.433 -176.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -79.43 -34.2 41.87 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.779 -0.368 . . . . 0.0 111.034 -179.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 940' ' ' ALA . . . . . 0.465 ' O ' HG23 ' A' ' 943' ' ' VAL . . . -66.43 -38.85 88.35 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.841 178.085 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 941' ' ' GLU . . . . . 0.534 ' HG3' ' N ' ' A' ' 942' ' ' ARG . 0.0 OUTLIER -70.3 -33.82 72.0 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 177.001 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 942' ' ' ARG . . . . . 0.534 ' N ' ' HG3' ' A' ' 941' ' ' GLU . 1.6 tpm_? -64.84 -48.17 75.31 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.85 179.565 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 943' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 940' ' ' ALA . 31.4 m -69.2 -29.57 43.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 178.118 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 944' ' ' ARG . . . . . 0.451 ' HB2' ' O ' ' A' ' 940' ' ' ALA . 0.0 OUTLIER -64.58 -35.13 79.98 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.78 176.814 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 1.1 mmtp -65.08 -42.34 94.22 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.296 0.57 . . . . 0.0 110.362 176.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 5.0 m -72.18 -17.68 61.92 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.297 179.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.4 -61.15 1.76 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.863 0.364 . . . . 0.0 110.972 -179.497 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 . . . . . 0 C--N 1.326 -0.444 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.055 -177.469 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.421 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 122.85 -11.23 8.84 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.482 -179.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 4.1 mmtt -74.41 147.0 42.46 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 178.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 708' ' ' ARG . . . . . 0.47 ' HA ' HG22 ' A' ' 732' ' ' VAL . 2.7 mtm180 -102.81 156.47 17.63 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.078 0.466 . . . . 0.0 111.754 -172.128 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 709' ' ' CYS . . . . . 0.797 ' HG ' ' HE2' ' A' ' 799' ' ' TYR . 1.0 OUTLIER -142.37 115.04 8.58 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.973 174.794 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 710' ' ' TRP . . . . . 0.484 ' CZ3' ' HB ' ' A' ' 734' ' ' THR . 91.1 m95 -91.41 118.12 30.27 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 -178.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 711' ' ' LEU . . . . . 0.682 HD21 HG11 ' A' ' 733' ' ' VAL . 1.9 pt? -118.72 127.61 53.72 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.496 0.665 . . . . 0.0 111.605 -177.423 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -127.05 58.73 1.43 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.541 175.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 713' ' ' VAL . . . . . 0.867 HG13 ' HB2' ' A' ' 750' ' ' ASP . 21.2 t -96.93 121.42 47.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.628 -179.547 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 714' ' ' ARG . . . . . 0.569 ' H ' ' HB3' ' A' ' 750' ' ' ASP . 38.0 mtp85 -66.96 -46.86 73.39 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.193 -175.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 715' ' ' ASN . . . . . 0.476 ' O ' ' HB2' ' A' ' 719' ' ' CYS . 7.6 p30 -78.96 133.39 36.88 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.236 179.131 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -77.69 -17.39 57.7 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.529 -175.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.43 -56.58 19.64 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.098 0.475 . . . . 0.0 110.182 178.382 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 718' ' ' LEU . . . . . 0.471 ' HB3' HG11 ' A' ' 713' ' ' VAL . 0.6 OUTLIER -72.58 -39.47 67.37 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.552 178.579 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 719' ' ' CYS . . . . . 0.723 ' SG ' ' HB ' ' A' ' 713' ' ' VAL . 0.1 OUTLIER -55.48 -52.64 62.97 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.12 -178.905 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 720' ' ' GLN . . . . . 0.516 ' O ' ' HG2' ' A' ' 723' ' ' GLU . 0.6 OUTLIER -67.85 -42.85 80.75 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.392 -177.705 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 721' ' ' PHE . . . . . 0.465 ' HE2' ' HG3' ' A' ' 792' ' ' PRO . 57.2 t80 -58.18 -54.76 43.31 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.734 0.302 . . . . 0.0 110.738 -179.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.09 -44.36 94.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.892 -177.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 723' ' ' GLU . . . . . 0.535 ' HA ' HG13 ' A' ' 733' ' ' VAL . 6.3 pt-20 -62.64 -36.3 82.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.881 -178.233 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 724' ' ' THR . . . . . . . . . . . . . 87.8 m -65.12 -44.56 88.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.178 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.98 -37.66 85.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.987 0.422 . . . . 0.0 111.173 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 726' ' ' LEU . . . . . 0.483 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 23.7 mt -74.49 -48.09 29.34 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.988 -177.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.71 -5.74 44.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.733 -177.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.13 -27.65 59.87 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 175.424 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 729' ' ' SER . . . . . 0.49 ' HB2' ' H ' ' A' ' 730' ' ' GLY . 0.3 OUTLIER -90.03 -104.15 0.09 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.897 175.796 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 730' ' ' GLY . . . . . 0.49 ' H ' ' HB2' ' A' ' 729' ' ' SER . . . -148.26 31.24 1.3 Allowed Glycine 0 N--CA 1.446 -0.691 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 175.216 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 731' ' ' ILE . . . . . 0.483 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 15.3 mm -95.77 126.0 48.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.736 0.303 . . . . 0.0 110.369 -177.307 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 732' ' ' VAL . . . . . 0.47 HG22 ' HA ' ' A' ' 708' ' ' ARG . 0.0 OUTLIER -85.86 98.53 6.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 121.275 0.559 . . . . 0.0 110.553 179.629 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 733' ' ' VAL . . . . . 0.682 HG11 HD21 ' A' ' 711' ' ' LEU . 0.1 OUTLIER -71.59 113.33 8.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.159 177.867 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 734' ' ' THR . . . . . 0.484 ' HB ' ' CZ3' ' A' ' 710' ' ' TRP . 0.2 OUTLIER -118.46 127.03 53.26 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.19 0.519 . . . . 0.0 110.824 -178.408 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -55.66 124.61 17.97 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.972 174.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 736' ' ' TYR . . . . . 0.672 ' HE2' ' HD3' ' A' ' 755' ' ' LYS . 9.4 t80 -81.19 70.07 7.95 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.622 0.725 . . . . 0.0 109.846 177.063 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 737' ' ' GLU . . . . . 0.419 ' H ' ' HG3' ' A' ' 737' ' ' GLU . 3.5 mt-10 -75.51 -25.04 56.91 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.788 -177.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 154.3 60.9 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.344 0 N-CA-C 111.431 -0.668 . . . . 0.0 111.431 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 26.7 mp0 -112.55 -178.84 3.5 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.77 0.319 . . . . 0.0 110.89 -175.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.6 143.99 51.96 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.941 -177.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 741' ' ' PRO . . . . . 0.405 ' HA ' ' CZ3' ' A' ' 757' ' ' TRP . 1.3 Cg_endo -82.32 123.17 3.84 Favored 'Trans proline' 0 N--CA 1.452 -0.925 0 C-N-CA 122.644 2.229 . . . . 0.0 111.701 175.837 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 742' ' ' THR . . . . . 0.412 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.1 OUTLIER -110.73 136.18 20.71 Favored Pre-proline 0 C--N 1.32 -0.703 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.755 178.966 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 743' ' ' PRO . . . . . 0.412 ' HD2' HG22 ' A' ' 742' ' ' THR . 37.8 Cg_endo -66.5 -1.91 6.46 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 123.053 2.502 . . . . 0.0 112.883 -179.279 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.27 -9.63 18.44 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.498 178.279 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -109.27 152.18 25.56 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.415 -0.812 . . . . 0.0 111.204 -170.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 16.2 m -116.68 147.85 19.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.429 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 747' ' ' LEU . . . . . 0.651 HD21 HG22 ' A' ' 749' ' ' THR . 0.4 OUTLIER -108.14 135.22 49.85 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.001 177.813 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 748' ' ' ILE . . . . . 0.469 HG12 HD21 ' A' ' 795' ' ' LEU . 1.7 mt -117.77 118.09 57.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 173.531 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 749' ' ' THR . . . . . 0.651 HG22 HD21 ' A' ' 747' ' ' LEU . 2.5 p -125.18 150.19 47.19 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -167.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 750' ' ' ASP . . . . . 0.867 ' HB2' HG13 ' A' ' 713' ' ' VAL . 34.8 t0 -113.54 116.59 29.78 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.773 175.005 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 751' ' ' GLU . . . . . 0.678 ' HG3' ' H ' ' A' ' 752' ' ' VAL . 1.8 tp10 68.17 -177.85 0.21 Allowed 'General case' 0 CA--C 1.536 0.432 0 O-C-N 123.868 0.73 . . . . 0.0 111.063 -177.173 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 752' ' ' VAL . . . . . 0.678 ' H ' ' HG3' ' A' ' 751' ' ' GLU . 15.2 t -75.19 100.2 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.298 -176.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 19.5 m -90.33 -0.29 8.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.483 176.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 58.31 41.35 23.38 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.351 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 755' ' ' LYS . . . . . 0.672 ' HD3' ' HE2' ' A' ' 736' ' ' TYR . 0.1 OUTLIER -120.03 126.97 52.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.318 180.0 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 2.1 tmtm? -81.43 -42.27 20.63 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.06 -179.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 757' ' ' TRP . . . . . 0.405 ' CZ3' ' HA ' ' A' ' 741' ' ' PRO . 76.0 t-105 62.46 90.44 0.07 Allowed 'General case' 0 CA--C 1.53 0.21 0 O-C-N 123.71 0.631 . . . . 0.0 111.657 179.388 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -83.23 58.82 4.66 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.148 0.499 . . . . 0.0 109.822 175.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 759' ' ' GLY . . . . . . . . . . . . . . . -117.62 -144.28 7.68 Favored Glycine 0 N--CA 1.444 -0.791 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.901 -178.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -75.81 -53.27 8.74 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.96 0.41 . . . . 0.0 110.242 179.217 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -161.49 156.56 23.7 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.386 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 3.0 p -140.75 126.87 20.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-O 121.126 0.489 . . . . 0.0 109.852 179.004 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 763' ' ' VAL . . . . . 0.528 HG21 HD13 ' A' ' 795' ' ' LEU . 18.6 t -111.65 105.29 18.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.05 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 764' ' ' THR . . . . . 0.473 ' HA ' ' OG1' ' A' ' 749' ' ' THR . 33.4 m -97.66 119.68 36.66 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.219 0.533 . . . . 0.0 110.607 178.749 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 765' ' ' PHE . . . . . 0.761 ' HZ ' ' HG ' ' A' ' 791' ' ' LEU . 33.0 m-85 -76.98 123.88 26.97 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.633 175.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 766' ' ' CYS . . . . . 0.486 ' SG ' ' HB ' ' A' ' 782' ' ' VAL . 0.0 OUTLIER -95.58 131.64 41.57 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 176.925 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.72 -69.34 0.74 Allowed 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.902 0.382 . . . . 0.0 110.672 -177.034 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 768' ' ' ARG . . . . . 0.433 ' HA ' ' HD2' ' A' ' 768' ' ' ARG . 0.0 OUTLIER -118.69 -30.09 5.21 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.261 -177.988 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -114.77 134.06 55.41 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.312 0.577 . . . . 0.0 110.965 -178.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 770' ' ' ILE . . . . . 0.48 HG21 ' N ' ' A' ' 771' ' ' GLY . 2.7 mp -97.51 156.28 3.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 173.131 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 771' ' ' GLY . . . . . 0.48 ' N ' HG21 ' A' ' 770' ' ' ILE . . . 175.45 -43.37 0.12 Allowed Glycine 0 CA--C 1.505 -0.571 0 N-CA-C 110.612 -0.995 . . . . 0.0 110.612 -177.474 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 772' ' ' ILE . . . . . 0.456 ' HA ' ' HD3' ' A' ' 773' ' ' PRO . 17.5 mm -87.03 123.4 70.3 Favored Pre-proline 0 C--N 1.321 -0.643 0 N-CA-C 108.374 -0.972 . . . . 0.0 108.374 169.358 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 773' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' A' ' 772' ' ' ILE . 23.7 Cg_exo -62.63 -85.62 0.01 OUTLIER 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.982 2.455 . . . . 0.0 112.673 -175.371 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . 0.598 ' O ' ' HB3' ' A' ' 780' ' ' GLU . 0.9 OUTLIER 171.53 -155.41 0.01 OUTLIER 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 -179.901 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 775' ' ' GLU . . . . . 0.577 ' HA ' ' O ' ' A' ' 780' ' ' GLU . 2.6 mp0 -60.3 75.13 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 122.082 0.944 . . . . 0.0 112.269 174.242 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 12.5 mmmt -119.19 -45.71 2.54 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 114.17 -1.377 . . . . 0.0 109.008 171.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -91.57 165.88 19.66 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 115.333 -0.848 . . . . 0.0 110.233 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_endo -60.91 91.81 0.1 OUTLIER 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.829 2.352 . . . . 0.0 113.18 -178.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 99.05 15.06 34.37 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.797 176.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 780' ' ' GLU . . . . . 0.598 ' HB3' ' O ' ' A' ' 774' ' ' LEU . 2.2 tt0 -84.23 122.01 28.29 Favored 'General case' 0 C--O 1.218 -0.589 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 -179.138 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 17.6 m95 -133.49 143.54 48.85 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.626 0.25 . . . . 0.0 110.344 178.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . 0.486 ' HB ' ' SG ' ' A' ' 766' ' ' CYS . 17.1 m -134.66 156.57 40.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 172.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 783' ' ' HIS . . . . . 0.457 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.1 OUTLIER -176.22 144.34 0.56 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.725 0.298 . . . . 0.0 110.896 178.228 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 4.9 m -105.74 102.77 12.19 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.354 175.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -150.57 155.28 7.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.67 0.271 . . . . 0.0 110.543 178.191 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -86.73 7.41 26.86 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.428 174.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 787' ' ' ALA . . . . . 0.414 ' N ' ' HD3' ' A' ' 788' ' ' PRO . . . 57.8 63.6 4.51 Favored Pre-proline 0 N--CA 1.464 0.251 0 CA-C-N 115.22 -0.9 . . . . 0.0 112.2 179.109 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 788' ' ' PRO . . . . . 0.414 ' HD3' ' N ' ' A' ' 787' ' ' ALA . 21.2 Cg_exo -66.58 -54.84 0.41 Allowed 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.135 1.89 . . . . 0.0 111.725 176.83 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 7.3 p-80 -161.05 -22.12 0.05 Allowed 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 176.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 790' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -72.83 -38.6 67.08 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -175.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 791' ' ' LEU . . . . . 0.761 ' HG ' ' HZ ' ' A' ' 765' ' ' PHE . 1.2 tm? -62.21 -54.62 47.96 Favored Pre-proline 0 CA--C 1.536 0.438 0 N-CA-C 111.65 0.241 . . . . 0.0 111.65 -178.067 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 792' ' ' PRO . . . . . 0.465 ' HG3' ' HE2' ' A' ' 721' ' ' PHE . 11.2 Cg_endo -58.37 -26.6 78.17 Favored 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 121.523 1.482 . . . . 0.0 112.201 176.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -71.79 -40.56 69.15 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.789 176.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -59.62 -47.17 86.66 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.107 0.48 . . . . 0.0 109.784 176.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 795' ' ' LEU . . . . . 0.528 HD13 HG21 ' A' ' 763' ' ' VAL . 0.2 OUTLIER -70.89 -29.7 65.85 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.13 -178.755 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -62.67 -46.51 87.84 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 174.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.3 -33.51 76.0 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.06 177.054 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 798' ' ' ILE . . . . . 0.478 ' HB ' ' HA ' ' A' ' 795' ' ' LEU . 0.3 OUTLIER -62.01 -32.28 53.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.879 178.771 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 799' ' ' TYR . . . . . 0.797 ' HE2' ' HG ' ' A' ' 709' ' ' CYS . 0.6 OUTLIER -103.91 15.54 28.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.155 179.6 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 9.7 mt . . . . . 0 C--O 1.233 0.192 0 CA-C-N 115.878 -0.601 . . . . 0.0 112.127 176.34 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 824' ' ' ASP . . . . . 0.513 ' HB3' ' H ' ' A' ' 825' ' ' MET . 0.9 OUTLIER . . . . . 0 N--CA 1.445 -0.686 0 CA-C-O 121.14 0.495 . . . . 0.0 111.13 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 825' ' ' MET . . . . . 0.513 ' H ' ' HB3' ' A' ' 824' ' ' ASP . 2.7 ttm -151.53 140.86 21.44 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.004 -175.336 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 826' ' ' MET . . . . . 0.73 ' HG3' ' HA ' ' A' ' 869' ' ' ILE . 1.6 ptp -135.05 123.34 23.09 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.155 0.502 . . . . 0.0 110.841 178.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 827' ' ' ILE . . . . . 0.45 HG21 ' HB ' ' A' ' 871' ' ' ILE . 5.5 mm -108.25 140.72 25.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.816 -179.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 828' ' ' LEU . . . . . 0.423 HD12 HG12 ' A' ' 863' ' ' VAL . 16.2 tp -106.55 118.33 36.39 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.139 0.495 . . . . 0.0 110.615 -178.179 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 829' ' ' VAL . . . . . 0.441 ' H ' HG22 ' A' ' 829' ' ' VAL . 0.0 OUTLIER -106.27 109.88 29.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.257 -179.803 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 830' ' ' VAL . . . . . 0.404 ' HA ' ' O ' ' A' ' 854' ' ' ALA . 13.4 t -109.54 100.39 10.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.232 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 831' ' ' ASP . . . . . 0.484 ' HA ' ' O ' ' A' ' 875' ' ' ASP . 7.2 t0 -112.34 149.2 32.79 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 -177.75 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 832' ' ' ASP . . . . . 0.457 ' CG ' ' HD1' ' A' ' 833' ' ' HIS . 0.0 OUTLIER -91.02 -22.13 20.93 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.841 179.76 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 833' ' ' HIS . . . . . 0.457 ' HD1' ' CG ' ' A' ' 832' ' ' ASP . 1.7 m80 -111.93 113.68 52.19 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.553 -176.053 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 834' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' A' ' 833' ' ' HIS . 5.4 Cg_endo -48.22 -46.46 22.65 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 124.106 3.204 . . . . 0.0 114.173 -174.385 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -56.35 -46.6 81.86 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 120.961 0.41 . . . . 0.0 111.395 -178.868 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 836' ' ' ASN . . . . . 0.613 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 3.0 m120 -75.75 -35.13 60.28 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 -178.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 837' ' ' ARG . . . . . 0.439 HH11 ' HB ' ' A' ' 853' ' ' THR . 0.8 OUTLIER -53.09 -46.26 68.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.44 176.996 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 1.7 tmm_? -65.66 -39.95 91.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.448 177.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.71 -53.57 55.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.112 -176.655 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 840' ' ' LEU . . . . . 0.613 ' HG ' ' O ' ' A' ' 836' ' ' ASN . 0.0 OUTLIER -73.64 -33.31 64.46 Favored 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 120.603 -0.439 . . . . 0.0 111.144 -177.281 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -63.75 -45.43 89.89 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.967 0.413 . . . . 0.0 110.866 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -65.99 -38.99 89.91 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.52 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 843' ' ' GLN . . . . . 0.943 ' HG3' HD21 ' A' ' 929' ' ' LEU . 0.0 OUTLIER -70.67 -32.41 69.66 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.985 -178.514 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 844' ' ' LEU . . . . . 0.584 ' HG ' HD23 ' A' ' 936' ' ' LEU . 0.3 OUTLIER -61.2 -37.12 81.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.037 0.446 . . . . 0.0 109.842 173.631 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -64.57 -37.33 94.28 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.303 176.041 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -67.07 -26.69 66.86 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.953 0.406 . . . . 0.0 111.044 178.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.25 -13.17 61.09 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.572 177.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 84.68 30.04 27.86 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.877 -0.677 . . . . 0.0 112.849 176.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -124.61 144.45 50.16 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 20.6 mm-40 -65.92 134.75 53.65 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.903 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.06 133.63 55.73 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.131 -172.744 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.05 126.17 51.76 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 174.17 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 853' ' ' THR . . . . . 0.439 ' HB ' HH11 ' A' ' 837' ' ' ARG . 0.0 OUTLIER -106.66 138.62 42.5 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.926 0.393 . . . . 0.0 111.747 -174.593 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 854' ' ' ALA . . . . . 0.404 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -140.4 145.22 36.79 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.277 175.558 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 855' ' ' ASN . . . . . 0.454 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 0.6 OUTLIER -121.89 72.63 1.04 Allowed 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 176.146 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 856' ' ' ASP . . . . . 0.486 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 35.0 t70 164.25 141.06 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.007 0.923 . . . . 0.0 109.544 178.195 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 857' ' ' GLY . . . . . 0.491 ' HA3' ' HB2' ' A' ' 886' ' ' LEU . . . -67.18 -49.61 51.72 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.972 -0.632 . . . . 0.0 113.228 -177.516 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 858' ' ' VAL . . . . . 0.446 ' HA ' HD11 ' A' ' 861' ' ' LEU . 0.7 OUTLIER -73.73 -31.31 31.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.135 0.493 . . . . 0.0 110.728 -177.021 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 859' ' ' ASP . . . . . 0.486 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 18.9 t0 -58.91 -31.16 68.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.824 177.425 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -62.85 -33.79 75.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.79 177.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 861' ' ' LEU . . . . . 0.446 HD11 ' HA ' ' A' ' 858' ' ' VAL . 0.3 OUTLIER -69.01 -40.77 78.5 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.022 0.439 . . . . 0.0 110.261 178.794 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -59.35 -49.67 76.91 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.634 177.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 863' ' ' VAL . . . . . 0.423 HG12 HD12 ' A' ' 828' ' ' LEU . 0.8 OUTLIER -66.42 -31.66 54.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.778 179.789 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 864' ' ' LEU . . . . . 0.564 HD23 HD13 ' A' ' 869' ' ' ILE . 0.6 OUTLIER -63.38 -41.93 98.81 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.012 0.434 . . . . 0.0 110.52 177.13 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 3.5 m -76.02 -22.68 55.51 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.578 -176.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.46 -44.61 9.51 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.388 -178.595 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -96.11 -133.03 0.2 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.405 -177.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 3.5 m170 -136.69 -76.9 0.42 Allowed 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 178.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 869' ' ' ILE . . . . . 0.73 ' HA ' ' HG3' ' A' ' 826' ' ' MET . 3.0 mt 69.35 134.6 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 O-C-N 123.792 0.682 . . . . 0.0 111.405 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -98.28 -47.95 5.25 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.485 -178.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 871' ' ' ILE . . . . . 0.58 HD12 ' HD2' ' A' ' 939' ' ' TYR . 36.3 mm -121.62 131.51 72.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.298 -179.607 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 872' ' ' VAL . . . . . 0.714 HG22 HD13 ' A' ' 897' ' ' LEU . 17.0 t -111.82 135.38 51.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 110.125 -0.324 . . . . 0.0 110.125 177.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 873' ' ' LEU . . . . . . . . . . . . . 1.2 pp -139.99 141.72 36.35 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.937 0.399 . . . . 0.0 110.382 174.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 874' ' ' SER . . . . . 0.474 ' O ' HG12 ' A' ' 902' ' ' VAL . 0.9 OUTLIER -119.72 102.06 8.34 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.639 -179.024 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 875' ' ' ASP . . . . . 0.579 ' OD1' ' HG2' ' A' ' 925' ' ' LYS . 0.4 OUTLIER -89.1 106.28 18.33 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.896 -179.583 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -119.16 125.7 74.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-O 121.165 0.507 . . . . 0.0 111.654 -173.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 877' ' ' ASN . . . . . 0.417 ' CB ' ' HD2' ' A' ' 925' ' ' LYS . 0.1 OUTLIER -96.47 -35.61 11.08 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 172.418 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.319 -0.749 0 CA-C-N 114.882 -1.054 . . . . 0.0 108.741 172.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.275 0 N-CA-C 112.859 -0.096 . . . . 0.0 112.859 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -131.15 -28.07 1.96 Allowed 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 177.773 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.51 -39.82 67.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.704 -178.538 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 886' ' ' LEU . . . . . 0.587 ' HG ' ' N ' ' A' ' 887' ' ' THR . 0.0 OUTLIER -70.8 -44.19 67.11 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 121.123 -0.231 . . . . 0.0 110.949 -176.852 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 887' ' ' THR . . . . . 0.587 ' N ' ' HG ' ' A' ' 886' ' ' LEU . 0.0 OUTLIER -67.14 -41.78 85.49 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.972 0.415 . . . . 0.0 110.46 -178.964 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 888' ' ' GLN . . . . . 0.456 ' O ' ' HB2' ' A' ' 892' ' ' GLN . 8.6 tp60 -58.18 -41.01 82.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.15 176.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 11.0 mmt-85 -70.99 -35.03 71.93 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.941 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 890' ' ' ILE . . . . . 0.606 HG23 ' N ' ' A' ' 891' ' ' ARG . 0.0 OUTLIER -66.75 -41.5 88.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 C-N-CA 121.175 -0.21 . . . . 0.0 110.914 -179.018 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 891' ' ' ARG . . . . . 0.606 ' N ' HG23 ' A' ' 890' ' ' ILE . 0.0 OUTLIER -75.32 -24.11 57.37 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 120.711 -0.396 . . . . 0.0 110.502 175.843 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 892' ' ' GLN . . . . . 0.456 ' HB2' ' O ' ' A' ' 888' ' ' GLN . 0.0 OUTLIER -65.45 -38.87 91.12 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.796 178.274 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -83.81 -11.47 57.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.664 -179.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 87.04 85.92 1.11 Allowed Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.798 -0.715 . . . . 0.0 111.778 -178.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 895' ' ' LEU . . . . . 0.577 ' HG ' ' O ' ' A' ' 895' ' ' LEU . 0.5 OUTLIER -71.83 111.59 7.22 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.46 0.648 . . . . 0.0 110.827 -177.388 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -88.15 -12.61 43.5 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.011 179.74 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 897' ' ' LEU . . . . . 0.714 HD13 HG22 ' A' ' 872' ' ' VAL . 1.8 pt? -124.34 147.83 56.25 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.121 -177.634 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 898' ' ' PRO . . . . . 0.771 ' HB2' ' HE2' ' A' ' 939' ' ' TYR . 57.2 Cg_endo -71.28 141.19 38.65 Favored 'Trans proline' 0 C--O 1.242 0.701 0 C-N-CA 122.648 2.232 . . . . 0.0 112.748 -178.105 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 899' ' ' VAL . . . . . 0.811 HG22 ' HB3' ' A' ' 919' ' ' MET . 0.2 OUTLIER -127.28 144.74 36.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.409 0.623 . . . . 0.0 110.548 179.783 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 900' ' ' ILE . . . . . . . . . . . . . 2.5 mt -108.61 119.05 57.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.155 177.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -94.74 98.78 2.34 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.858 -0.686 . . . . 0.0 111.542 179.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 902' ' ' VAL . . . . . 0.825 ' HB ' HD12 ' A' ' 923' ' ' LEU . 0.1 OUTLIER -99.56 101.46 12.12 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 CA-C-O 121.717 0.77 . . . . 0.0 109.203 178.769 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 903' ' ' THR . . . . . 0.472 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.1 OUTLIER -105.12 173.73 6.18 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.812 -174.269 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -79.76 103.84 9.94 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.807 -0.357 . . . . 0.0 110.713 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 45.7 t30 18.82 91.78 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.76 0 O-C-N 125.219 1.574 . . . . 0.0 114.787 177.031 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -95.29 8.46 43.05 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.246 -0.434 . . . . 0.0 109.884 172.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 3.1 tp 69.25 -67.89 0.21 Allowed 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.596 -176.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -99.22 67.89 1.61 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.128 0.49 . . . . 0.0 109.814 176.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.42 -27.88 67.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.676 -178.44 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 910' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.84 -40.87 94.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.638 176.359 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 3.9 tttt -70.53 -32.83 70.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.269 -179.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.5 -44.29 94.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.715 174.641 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 913' ' ' ARG . . . . . 0.535 ' HA ' ' HE3' ' A' ' 919' ' ' MET . 1.0 OUTLIER -59.93 -42.54 94.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.905 177.211 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 66.6 m -68.38 -34.73 76.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.282 -179.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.47 -44.69 74.27 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.817 -178.78 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 916' ' ' GLU . . . . . 0.568 ' OE1' ' HB ' ' A' ' 887' ' ' THR . 0.3 OUTLIER -77.14 -50.93 11.9 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.505 -177.701 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 2.1 m 50.24 47.88 23.04 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.568 -174.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 918' ' ' GLY . . . . . 0.448 ' HA3' ' HD2' ' A' ' 891' ' ' ARG . . . -132.67 7.37 5.24 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.166 -1.016 . . . . 0.0 112.965 -179.165 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 919' ' ' MET . . . . . 0.811 ' HB3' HG22 ' A' ' 899' ' ' VAL . 0.0 OUTLIER -121.89 -89.32 0.6 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.734 0.302 . . . . 0.0 110.296 -178.143 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 920' ' ' ASP . . . . . 0.521 ' HB2' ' O ' ' A' ' 919' ' ' MET . 25.5 t70 165.74 -54.79 0.0 OUTLIER 'General case' 0 CA--C 1.516 -0.347 0 O-C-N 124.404 1.065 . . . . 0.0 108.562 176.639 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 921' ' ' SER . . . . . 0.602 ' HG ' ' HH ' ' A' ' 939' ' ' TYR . 20.7 m -129.68 166.61 19.45 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.348 177.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 922' ' ' CYS . . . . . 0.408 ' HB2' ' HB2' ' A' ' 913' ' ' ARG . 0.8 OUTLIER -144.74 147.63 33.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.829 -178.898 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 923' ' ' LEU . . . . . 0.825 HD12 ' HB ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -150.2 -176.82 5.61 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 175.176 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 924' ' ' SER . . . . . 0.472 ' HA ' ' O ' ' A' ' 903' ' ' THR . 1.5 m -108.67 147.49 31.83 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 121.255 -0.178 . . . . 0.0 110.553 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 925' ' ' LYS . . . . . 0.579 ' HG2' ' OD1' ' A' ' 875' ' ' ASP . 0.0 OUTLIER -51.56 -40.79 72.67 Favored Pre-proline 0 CA--C 1.54 0.558 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 -175.577 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 926' ' ' PRO . . . . . 0.549 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 10.9 Cg_endo -57.18 84.86 0.04 OUTLIER 'Trans proline' 0 C--N 1.358 1.035 0 C-N-CA 121.915 1.744 . . . . 0.0 112.1 171.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 927' ' ' VAL . . . . . 0.572 HG13 ' HB ' ' A' ' 931' ' ' VAL . 2.3 t -122.55 129.2 75.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.341 -177.09 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.86 172.12 10.32 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.97 178.379 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 929' ' ' LEU . . . . . 0.943 HD21 ' HG3' ' A' ' 843' ' ' GLN . 1.0 OUTLIER -60.93 -41.9 97.11 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.416 -175.837 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.67 -29.07 68.26 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.989 0.424 . . . . 0.0 110.584 -179.105 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 931' ' ' VAL . . . . . 0.572 ' HB ' HG13 ' A' ' 927' ' ' VAL . 60.2 t -70.55 -51.11 40.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.956 -178.507 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 932' ' ' ILE . . . . . 0.449 HD11 HG21 ' A' ' 932' ' ' ILE . 0.0 OUTLIER -63.45 -37.52 79.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-O 120.842 0.353 . . . . 0.0 110.107 179.075 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 933' ' ' LYS . . . . . 0.407 ' N ' HG23 ' A' ' 932' ' ' ILE . 0.5 OUTLIER -60.36 -45.76 92.35 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.32 175.78 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 934' ' ' GLN . . . . . 0.505 ' O ' ' HB2' ' A' ' 938' ' ' LEU . 47.5 mt-30 -67.54 -32.88 73.97 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.086 -178.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 8.6 m -64.67 -48.03 76.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.801 0.334 . . . . 0.0 110.438 178.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 936' ' ' LEU . . . . . 0.584 HD23 ' HG ' ' A' ' 844' ' ' LEU . 1.4 mp -62.93 -48.23 79.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.569 178.217 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 28.3 m -60.56 -44.83 95.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.548 -178.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 938' ' ' LEU . . . . . 0.505 ' HB2' ' O ' ' A' ' 934' ' ' GLN . 0.1 OUTLIER -58.5 -43.17 88.98 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.253 -177.989 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 939' ' ' TYR . . . . . 0.771 ' HE2' ' HB2' ' A' ' 898' ' ' PRO . 4.5 m-85 -79.17 -35.95 41.12 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.097 -177.37 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 940' ' ' ALA . . . . . 0.405 ' O ' HG21 ' A' ' 943' ' ' VAL . . . -62.3 -44.32 96.79 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.864 0.364 . . . . 0.0 110.717 178.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 941' ' ' GLU . . . . . 0.471 ' O ' ' HE2' ' A' ' 945' ' ' LYS . 4.1 pt-20 -70.41 -33.36 71.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.448 178.515 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 942' ' ' ARG . . . . . 0.439 HH11 ' HD2' ' A' ' 942' ' ' ARG . 0.3 OUTLIER -64.34 -48.19 76.51 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.822 -179.336 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 943' ' ' VAL . . . . . 0.405 HG21 ' O ' ' A' ' 940' ' ' ALA . 28.6 m -71.15 -29.71 37.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.828 -179.665 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.85 -47.15 86.36 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.237 178.679 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 945' ' ' LYS . . . . . 0.471 ' HE2' ' O ' ' A' ' 941' ' ' GLU . 0.1 OUTLIER -77.23 -22.47 52.22 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.901 -0.32 . . . . 0.0 111.124 -177.685 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 69.5 m -76.71 -32.84 58.11 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.809 0.338 . . . . 0.0 110.621 175.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.4 -42.59 18.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.079 -178.733 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 4.7 t70 . . . . . 0 C--N 1.325 -0.475 0 CA-C-O 121.235 0.541 . . . . 0.0 110.312 178.756 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.464 0.253 0 CA-C-O 120.98 0.419 . . . . 0.0 111.976 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 145.24 -11.9 1.82 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.199 -1.001 . . . . 0.0 112.644 -178.244 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 707' ' ' LYS . . . . . 0.474 ' HB2' HD11 ' A' ' 731' ' ' ILE . 11.3 mmtt -67.27 140.03 57.34 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 175.313 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 708' ' ' ARG . . . . . 0.655 ' HG2' HG22 ' A' ' 732' ' ' VAL . 0.8 OUTLIER -105.31 141.89 36.04 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.037 0.446 . . . . 0.0 111.464 -174.759 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 1.5 m -121.94 110.24 15.61 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.275 174.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 710' ' ' TRP . . . . . 0.567 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 70.0 m95 -91.85 134.21 34.97 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 -178.467 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 711' ' ' LEU . . . . . 0.674 HD21 ' HA ' ' A' ' 735' ' ' THR . 2.2 pt? -131.79 137.94 48.35 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 121.355 0.598 . . . . 0.0 111.264 -177.465 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -126.05 37.38 4.35 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.902 -1.044 . . . . 0.0 109.161 175.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 713' ' ' VAL . . . . . 0.809 ' HB ' ' HB3' ' A' ' 719' ' ' CYS . 2.1 t -87.75 116.34 29.69 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.833 177.751 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 714' ' ' ARG . . . . . 0.413 ' NH2' ' HB2' ' A' ' 751' ' ' GLU . 15.4 mtm180 -84.41 -16.2 43.57 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.439 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 54.9 t-20 -70.57 105.71 3.21 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.214 172.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 716' ' ' ALA . . . . . 0.625 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -60.92 -41.92 97.08 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.677 -174.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.69 -41.3 94.87 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.31 0.576 . . . . 0.0 110.376 179.21 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.74 -49.19 26.79 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.347 -177.891 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 719' ' ' CYS . . . . . 0.809 ' HB3' ' HB ' ' A' ' 713' ' ' VAL . 31.8 p -68.42 -40.68 81.11 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.013 -175.487 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 720' ' ' GLN . . . . . 0.571 ' O ' ' HG3' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -66.44 -39.75 89.09 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.46 -178.947 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -63.17 -46.58 86.43 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 121.165 0.507 . . . . 0.0 110.586 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.72 -47.42 78.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.921 -179.408 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 723' ' ' GLU . . . . . 0.571 ' HG3' ' O ' ' A' ' 720' ' ' GLN . 0.3 OUTLIER -60.12 -42.17 94.2 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.151 -176.75 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 724' ' ' THR . . . . . 0.605 ' O ' ' HG3' ' A' ' 728' ' ' ARG . 91.8 m -64.12 -36.87 85.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.881 0.372 . . . . 0.0 110.784 -179.553 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 725' ' ' SER . . . . . 0.426 ' HA ' ' HE ' ' A' ' 728' ' ' ARG . 19.5 m -70.47 -48.02 57.79 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.665 -179.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 726' ' ' LEU . . . . . 0.43 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 16.3 mt -66.35 -38.92 88.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.905 0.383 . . . . 0.0 111.548 -176.888 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 727' ' ' GLN . . . . . 0.433 ' HG2' ' O ' ' A' ' 723' ' ' GLU . 6.8 pt20 -72.58 -7.39 49.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.545 -177.629 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 728' ' ' ARG . . . . . 0.605 ' HG3' ' O ' ' A' ' 724' ' ' THR . 33.4 mtm180 -79.16 -34.63 42.98 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.112 0.482 . . . . 0.0 110.467 178.681 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -86.25 -24.52 25.98 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.658 -176.57 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 730' ' ' GLY . . . . . . . . . . . . . . . 120.36 14.9 5.22 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.525 -0.845 . . . . 0.0 111.855 -177.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 731' ' ' ILE . . . . . 0.474 HD11 ' HB2' ' A' ' 707' ' ' LYS . 9.6 mm -91.49 114.11 28.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 175.603 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 732' ' ' VAL . . . . . 0.655 HG22 ' HG2' ' A' ' 708' ' ' ARG . 0.0 OUTLIER -77.93 100.52 3.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 121.309 0.575 . . . . 0.0 110.963 -176.492 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 733' ' ' VAL . . . . . . . . . . . . . 1.3 p -74.31 133.12 32.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.056 176.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 7.7 m -141.96 132.16 24.84 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.936 0.398 . . . . 0.0 110.399 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 735' ' ' THR . . . . . 0.674 ' HA ' HD21 ' A' ' 711' ' ' LEU . 0.2 OUTLIER -58.22 124.89 20.96 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.754 176.721 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 736' ' ' TYR . . . . . 0.567 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 31.7 t80 -85.39 81.53 8.71 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.058 0.456 . . . . 0.0 110.536 -179.252 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -58.05 -45.76 86.49 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.503 174.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 149.33 41.83 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.547 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.944 178.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.19 -87.52 0.06 Allowed 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 120.396 0.141 . . . . 0.0 111.263 -176.897 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 740' ' ' GLU . . . . . 0.478 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 1.1 mt-10 -149.59 141.38 14.95 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-O 120.546 0.212 . . . . 0.0 111.23 -175.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 741' ' ' PRO . . . . . 0.609 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 5.3 Cg_endo -88.25 123.32 1.61 Allowed 'Trans proline' 0 N--CA 1.455 -0.744 0 C-N-CA 123.424 2.749 . . . . 0.0 112.239 175.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 742' ' ' THR . . . . . 0.533 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.2 OUTLIER -104.27 138.65 19.58 Favored Pre-proline 0 C--N 1.322 -0.622 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.929 179.073 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 743' ' ' PRO . . . . . 0.533 ' HD2' HG22 ' A' ' 742' ' ' THR . 37.0 Cg_endo -67.43 -7.13 18.24 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.882 2.388 . . . . 0.0 112.764 179.595 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -102.87 -8.72 20.5 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.114 0.483 . . . . 0.0 110.455 177.052 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -111.8 158.97 18.75 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.774 -171.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 27.3 m -120.76 148.55 23.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.173 -176.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 747' ' ' LEU . . . . . 0.553 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 1.0 OUTLIER -117.64 112.24 20.24 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.036 177.766 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 748' ' ' ILE . . . . . 0.867 HG22 ' HB ' ' A' ' 763' ' ' VAL . 0.2 OUTLIER -99.37 107.15 20.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.906 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 176.151 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 749' ' ' THR . . . . . 0.555 ' OG1' HG11 ' A' ' 753' ' ' VAL . 12.6 t -107.39 158.33 17.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.289 0.566 . . . . 0.0 112.079 -173.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 750' ' ' ASP . . . . . 0.44 ' HB2' HG13 ' A' ' 713' ' ' VAL . 3.5 t70 -106.22 129.05 54.34 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.027 175.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 751' ' ' GLU . . . . . 0.413 ' HB2' ' NH2' ' A' ' 714' ' ' ARG . 3.8 mm-40 66.94 -175.75 0.19 Allowed 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.514 0.726 . . . . 0.0 111.988 178.337 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 752' ' ' VAL . . . . . 0.731 HG22 ' HB2' ' A' ' 769' ' ' HIS . 55.9 t -69.88 130.43 34.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.743 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 753' ' ' VAL . . . . . 0.555 HG11 ' OG1' ' A' ' 749' ' ' THR . 0.4 OUTLIER -123.01 158.47 27.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.68 -178.543 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.89 -36.34 25.43 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.208 0.527 . . . . 0.0 110.185 178.533 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 755' ' ' LYS . . . . . 0.481 ' HE2' ' HE2' ' A' ' 736' ' ' TYR . 0.0 OUTLIER -113.24 110.38 20.29 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 176.937 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 756' ' ' LYS . . . . . 0.523 ' H ' ' HG2' ' A' ' 756' ' ' LYS . 0.0 OUTLIER -73.2 -57.59 3.91 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.432 -178.815 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 757' ' ' TRP . . . . . 0.651 ' HB2' ' HB ' ' A' ' 762' ' ' VAL . 2.3 t-105 164.31 162.58 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.459 -169.351 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -147.1 53.27 1.08 Allowed 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 174.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 759' ' ' GLY . . . . . 0.431 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -146.53 -133.98 2.54 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.884 -175.621 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.22 -57.69 5.02 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.722 0.296 . . . . 0.0 111.316 -176.531 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -162.61 145.89 11.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.032 0.444 . . . . 0.0 111.298 -178.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 762' ' ' VAL . . . . . 0.651 ' HB ' ' HB2' ' A' ' 757' ' ' TRP . 2.0 p -118.58 123.23 71.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.838 175.472 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 763' ' ' VAL . . . . . 0.867 ' HB ' HG22 ' A' ' 748' ' ' ILE . 48.0 t -103.74 108.99 25.82 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-O 121.058 0.456 . . . . 0.0 109.812 178.457 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 764' ' ' THR . . . . . 0.412 ' HA ' HG21 ' A' ' 749' ' ' THR . 5.5 m -93.14 112.53 24.51 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.156 -178.554 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 765' ' ' PHE . . . . . 0.481 ' CZ ' ' HG ' ' A' ' 791' ' ' LEU . 34.0 m-85 -83.97 125.99 32.59 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 175.071 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -95.28 133.85 38.71 Favored 'General case' 0 C--N 1.314 -0.944 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.106 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.76 -74.3 0.64 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.37 -0.377 . . . . 0.0 109.986 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 1.7 mmt85 -106.86 -35.38 6.96 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 175.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . 0.731 ' HB2' HG22 ' A' ' 752' ' ' VAL . 5.7 m80 -117.77 155.38 30.14 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.382 175.661 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 770' ' ' ILE . . . . . 0.405 ' O ' HG21 ' A' ' 752' ' ' VAL . 52.1 mt -107.8 -55.01 5.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 176.026 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . 70.7 -74.28 0.6 Allowed Glycine 0 C--N 1.33 0.231 0 CA-C-N 115.749 -0.659 . . . . 0.0 112.373 177.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 772' ' ' ILE . . . . . 0.406 ' HA ' ' HD3' ' A' ' 773' ' ' PRO . 14.6 mm -65.24 122.78 81.78 Favored Pre-proline 0 C--N 1.324 -0.53 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 177.419 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 773' ' ' PRO . . . . . 0.47 ' O ' ' HB3' ' A' ' 774' ' ' LEU . 41.6 Cg_exo -56.91 -72.06 0.03 OUTLIER 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.679 2.252 . . . . 0.0 112.672 -176.107 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . 0.598 ' O ' ' HB3' ' A' ' 780' ' ' GLU . 1.1 pt? 169.83 -153.12 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.277 0 N-CA-C 108.65 -0.871 . . . . 0.0 108.65 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 775' ' ' GLU . . . . . 0.557 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 1.5 mp0 -59.47 69.14 0.01 OUTLIER 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.306 0.574 . . . . 0.0 111.869 170.47 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 776' ' ' LYS . . . . . 0.464 ' HG3' ' HB2' ' A' ' 773' ' ' PRO . 0.0 OUTLIER -106.28 -38.38 6.25 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.1 174.863 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -103.0 153.21 38.45 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.398 171.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -61.3 98.4 0.15 Allowed 'Trans proline' 0 CA--C 1.529 0.252 0 C-N-CA 122.494 2.129 . . . . 0.0 112.258 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 116.63 -1.24 20.19 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.265 179.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 780' ' ' GLU . . . . . 0.598 ' HB3' ' O ' ' A' ' 774' ' ' LEU . 0.9 OUTLIER -87.69 122.77 31.78 Favored 'General case' 0 C--O 1.219 -0.519 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 -179.546 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 28.2 m95 -132.82 146.78 52.12 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 177.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . 0.541 HG22 ' CB ' ' A' ' 774' ' ' LEU . 33.6 m -136.34 158.26 37.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 176.375 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 783' ' ' HIS . . . . . 0.452 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.0 OUTLIER -172.86 120.27 0.37 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.746 175.044 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.63 101.52 14.2 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 172.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 4.9 p -175.42 158.01 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.191 -176.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -86.85 9.66 18.48 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.038 178.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 58.33 71.87 0.95 Allowed Pre-proline 0 N--CA 1.468 0.427 0 CA-C-N 115.647 -0.706 . . . . 0.0 112.262 177.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 788' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -66.27 -61.8 0.08 OUTLIER 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.35 2.033 . . . . 0.0 111.589 178.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 789' ' ' HIS . . . . . 0.402 ' O ' ' HB3' ' A' ' 793' ' ' ALA . 0.1 OUTLIER -141.25 -31.68 0.57 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.937 0.399 . . . . 0.0 111.153 176.105 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 790' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -61.8 -44.49 96.77 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.802 -0.636 . . . . 0.0 112.659 -170.322 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 791' ' ' LEU . . . . . 0.481 ' HG ' ' CZ ' ' A' ' 765' ' ' PHE . 0.6 OUTLIER -68.93 -53.47 14.47 Favored Pre-proline 0 C--N 1.326 -0.437 0 C-N-CA 120.601 -0.44 . . . . 0.0 111.67 -176.87 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 792' ' ' PRO . . . . . 0.424 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 9.6 Cg_endo -57.03 -32.47 93.23 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 121.554 1.503 . . . . 0.0 112.048 175.736 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 793' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' A' ' 789' ' ' HIS . . . -69.58 -40.99 76.4 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.784 0.326 . . . . 0.0 110.85 177.072 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 794' ' ' LEU . . . . . 0.428 ' HA ' HD23 ' A' ' 794' ' ' LEU . 1.4 tm? -59.63 -44.76 93.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.152 0.501 . . . . 0.0 109.751 177.042 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 795' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.32 -48.56 77.53 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.904 -179.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -61.99 -41.61 98.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.352 -179.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.17 -33.92 76.52 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.88 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -69.31 -32.97 55.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.695 179.57 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -96.29 3.16 53.22 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.4 -179.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 1.2 mp . . . . . 0 N--CA 1.471 0.579 0 C-N-CA 123.611 0.764 . . . . 0.0 112.482 175.36 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 8.3 t70 . . . . . 0 CA--C 1.521 -0.171 0 CA-C-O 120.928 0.394 . . . . 0.0 110.806 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 825' ' ' MET . . . . . 0.558 ' HE3' HG12 ' A' ' 871' ' ' ILE . 0.0 OUTLIER -100.19 109.1 21.35 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.747 178.198 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 826' ' ' MET . . . . . 0.571 ' HG3' ' HA ' ' A' ' 869' ' ' ILE . 0.0 OUTLIER -115.37 129.17 56.51 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.113 0.482 . . . . 0.0 110.952 -176.071 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 827' ' ' ILE . . . . . 0.691 HD12 ' HB ' ' A' ' 871' ' ' ILE . 2.9 mm -118.02 127.29 75.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.58 -0.737 . . . . 0.0 109.52 179.371 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 828' ' ' LEU . . . . . 0.555 HD11 HG13 ' A' ' 863' ' ' VAL . 7.7 tp -104.53 130.19 52.5 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.523 0.202 . . . . 0.0 110.748 -177.672 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 829' ' ' VAL . . . . . 0.433 ' H ' HG12 ' A' ' 829' ' ' VAL . 0.3 OUTLIER -112.92 121.78 65.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.98 177.452 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 830' ' ' VAL . . . . . 0.458 HG11 ' HB3' ' A' ' 854' ' ' ALA . 0.2 OUTLIER -115.74 86.85 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.112 178.552 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 831' ' ' ASP . . . . . 0.866 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 55.0 t0 -108.94 134.02 52.16 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.434 -176.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -73.99 -13.72 60.91 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.866 178.547 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 1.1 m80 -109.24 92.65 11.66 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.179 177.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 834' ' ' PRO . . . . . 0.568 ' HA ' ' HD3' ' A' ' 837' ' ' ARG . 2.5 Cg_endo -46.33 -37.66 19.36 Favored 'Trans proline' 0 CA--C 1.534 0.521 0 C-N-CA 123.733 2.955 . . . . 0.0 114.167 -175.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 835' ' ' ILE . . . . . 0.405 HG13 ' H ' ' A' ' 836' ' ' ASN . 1.1 pp -65.3 -42.7 94.44 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 CA-C-O 120.921 0.391 . . . . 0.0 111.74 -178.168 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 836' ' ' ASN . . . . . 0.607 ' HB3' ' OD2' ' A' ' 831' ' ' ASP . 0.3 OUTLIER -69.62 -43.87 71.81 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.506 -0.554 . . . . 0.0 109.506 179.856 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 837' ' ' ARG . . . . . 0.866 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 1.1 ttt-85 -55.64 -40.6 72.41 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.872 -1.058 . . . . 0.0 111.032 177.077 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.75 -39.85 94.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.586 178.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.48 -49.16 67.53 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.211 -177.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 840' ' ' LEU . . . . . 0.547 HD23 ' HA ' ' A' ' 837' ' ' ARG . 2.3 pp -73.95 -27.68 61.13 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.933 -0.307 . . . . 0.0 111.173 -177.138 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -66.15 -32.69 74.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.987 0.422 . . . . 0.0 110.061 174.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -63.62 -45.73 88.95 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.928 176.119 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 843' ' ' GLN . . . . . 0.832 ' HG2' HD22 ' A' ' 929' ' ' LEU . 3.1 mt-30 -60.25 -42.21 94.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.283 175.564 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 844' ' ' LEU . . . . . 0.65 HD22 ' HB ' ' A' ' 827' ' ' ILE . 1.2 mp -58.88 -44.61 91.18 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.004 179.65 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -63.72 -41.43 98.97 Favored Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.905 -0.588 . . . . 0.0 112.326 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 68.8 m -73.19 -13.74 61.22 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.687 0.279 . . . . 0.0 111.331 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 847' ' ' LEU . . . . . 0.607 HD23 ' HA ' ' A' ' 933' ' ' LYS . 0.1 OUTLIER -83.62 -4.93 59.0 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.872 0.368 . . . . 0.0 110.691 176.828 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 87.86 17.06 58.72 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.943 -0.646 . . . . 0.0 112.884 177.091 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -112.11 144.06 42.11 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.726 0.298 . . . . 0.0 110.475 -178.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -75.69 108.25 8.4 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.108 0.48 . . . . 0.0 109.726 -179.723 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 851' ' ' CYS . . . . . 0.472 ' HB3' HD21 ' A' ' 844' ' ' LEU . 0.0 OUTLIER -87.61 122.03 30.8 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.55 -174.942 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 7.0 mptt -107.73 120.58 42.63 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 174.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -99.77 137.79 37.76 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 120.904 0.383 . . . . 0.0 111.852 -173.42 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 854' ' ' ALA . . . . . 0.458 ' HB3' HG11 ' A' ' 830' ' ' VAL . . . -150.41 157.97 43.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.056 176.294 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -149.19 75.56 1.29 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.708 179.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 856' ' ' ASP . . . . . . . . . . . . . 24.4 t70 175.16 136.95 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.828 179.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -65.1 -44.4 94.23 Favored Glycine 0 CA--C 1.519 0.309 0 C-N-CA 120.985 -0.626 . . . . 0.0 113.307 -179.001 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 37.7 t -73.91 -44.98 50.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.029 0.442 . . . . 0.0 110.597 -177.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -66.36 -19.72 65.88 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.154 -176.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -61.72 -39.56 91.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.905 0.383 . . . . 0.0 110.403 174.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 861' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.52 -34.07 65.07 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.226 178.006 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 19.9 t30 -63.28 -41.99 99.06 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.247 176.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 863' ' ' VAL . . . . . 0.555 HG13 HD11 ' A' ' 828' ' ' LEU . 0.4 OUTLIER -70.92 -31.48 45.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.374 177.6 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 864' ' ' LEU . . . . . 0.749 HD21 HD11 ' A' ' 897' ' ' LEU . 0.9 OUTLIER -58.89 -36.0 73.93 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.776 176.151 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -83.58 -38.27 21.87 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.847 179.828 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.69 -52.73 63.88 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.078 0.466 . . . . 0.0 110.645 179.274 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 867' ' ' ASN . . . . . 0.471 ' HB3' ' H ' ' A' ' 868' ' ' HIS . 0.1 OUTLIER -106.19 -127.35 0.25 Allowed 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.798 -0.816 . . . . 0.0 108.798 176.292 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 868' ' ' HIS . . . . . 0.471 ' H ' ' HB3' ' A' ' 867' ' ' ASN . 0.2 OUTLIER -165.19 -56.17 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 110.07 -0.345 . . . . 0.0 110.07 174.371 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 869' ' ' ILE . . . . . 0.571 ' HA ' ' HG3' ' A' ' 826' ' ' MET . 2.4 mp 74.24 140.55 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 O-C-N 123.758 0.661 . . . . 0.0 111.562 174.73 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 870' ' ' ASP . . . . . 0.447 ' N ' HG22 ' A' ' 869' ' ' ILE . 8.7 m-20 -87.43 -57.99 2.75 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.417 -179.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 871' ' ' ILE . . . . . 0.691 ' HB ' HD12 ' A' ' 827' ' ' ILE . 41.4 mm -111.82 126.99 69.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.323 -179.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 872' ' ' VAL . . . . . 0.635 ' HB ' ' HB ' ' A' ' 899' ' ' VAL . 0.1 OUTLIER -105.11 137.02 36.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.788 -178.689 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 873' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -125.0 124.76 42.68 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 173.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 874' ' ' SER . . . . . 0.494 ' HB2' ' HE2' ' A' ' 919' ' ' MET . 1.0 OUTLIER -121.89 101.79 7.78 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 120.989 0.423 . . . . 0.0 109.993 178.95 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 875' ' ' ASP . . . . . 0.891 ' HB3' HG21 ' A' ' 902' ' ' VAL . 0.5 OUTLIER -107.48 115.67 30.56 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 122.013 0.911 . . . . 0.0 110.907 -178.673 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 3.1 p -137.33 128.87 41.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 114.951 -1.022 . . . . 0.0 110.213 -176.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 877' ' ' ASN . . . . . 0.576 ' ND2' ' HB1' ' A' ' 904' ' ' ALA . 1.8 t30 -155.96 64.28 0.58 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.43 0.633 . . . . 0.0 110.393 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 6.8 mmt . . . . . 0 C--N 1.32 -0.699 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 176.401 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.34 0 N-CA-C 112.406 -0.278 . . . . 0.0 112.406 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 884' ' ' TYR . . . . . 0.433 ' O ' ' HB2' ' A' ' 888' ' ' GLN . 2.7 t80 -138.5 -50.91 0.56 Allowed 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 177.641 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -66.05 -46.54 77.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.64 179.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 886' ' ' LEU . . . . . 0.511 ' HG ' ' N ' ' A' ' 887' ' ' THR . 0.0 OUTLIER -62.97 -45.94 90.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.67 -177.974 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 887' ' ' THR . . . . . 0.511 ' N ' ' HG ' ' A' ' 886' ' ' LEU . 0.0 OUTLIER -65.39 -42.37 92.72 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.075 -179.469 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 888' ' ' GLN . . . . . 0.433 ' HB2' ' O ' ' A' ' 884' ' ' TYR . 0.3 OUTLIER -64.69 -47.3 78.87 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.889 -178.712 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 889' ' ' ARG . . . . . 0.517 ' HD3' ' OE1' ' A' ' 892' ' ' GLN . 13.1 mmt180 -66.54 -32.41 73.75 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.532 -0.303 . . . . 0.0 111.074 -177.537 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 890' ' ' ILE . . . . . . . . . . . . . 5.3 mt -60.55 -51.17 76.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.964 0.412 . . . . 0.0 110.718 178.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 891' ' ' ARG . . . . . 0.599 ' HB3' ' HA2' ' A' ' 918' ' ' GLY . 0.1 OUTLIER -74.67 -31.16 61.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.859 -178.997 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 892' ' ' GLN . . . . . 0.517 ' OE1' ' HD3' ' A' ' 889' ' ' ARG . 7.5 mt-30 -65.61 -41.99 92.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.589 179.313 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 893' ' ' LEU . . . . . 0.477 ' HA ' HD22 ' A' ' 893' ' ' LEU . 0.3 OUTLIER -67.14 -29.21 68.86 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.009 177.218 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 92.7 64.03 1.11 Allowed Glycine 0 N--CA 1.443 -0.842 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.736 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 895' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.26 111.09 3.79 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 178.173 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.66 0.58 56.28 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.14 -176.167 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 897' ' ' LEU . . . . . 0.749 HD11 HD21 ' A' ' 864' ' ' LEU . 0.0 OUTLIER -107.95 135.78 19.82 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.436 176.806 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -67.96 124.78 12.23 Favored 'Trans proline' 0 C--O 1.235 0.338 0 C-N-CA 122.653 2.235 . . . . 0.0 112.32 -177.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 899' ' ' VAL . . . . . 0.867 HG11 ' HA ' ' A' ' 919' ' ' MET . 0.2 OUTLIER -113.62 131.8 64.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 121.573 0.702 . . . . 0.0 110.526 179.783 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 900' ' ' ILE . . . . . 1.03 HG21 ' HG ' ' A' ' 923' ' ' LEU . 0.4 OUTLIER -101.09 117.85 46.95 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.161 178.873 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -91.68 117.06 5.13 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.809 -0.71 . . . . 0.0 111.496 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 902' ' ' VAL . . . . . 0.891 HG21 ' HB3' ' A' ' 875' ' ' ASP . 0.5 OUTLIER -105.66 134.4 47.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.717 0 CA-C-O 121.425 0.631 . . . . 0.0 110.699 -175.921 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -139.73 159.32 42.44 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.344 -175.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 904' ' ' ALA . . . . . 0.581 ' HB3' ' HB2' ' A' ' 925' ' ' LYS . . . -109.95 114.33 27.79 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 122.35 -0.219 . . . . 0.0 110.485 179.157 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 61.02 54.66 3.31 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.667 -178.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -104.33 93.28 4.73 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.36 177.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.37 125.66 21.76 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.598 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . 59.59 48.08 9.97 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.143 -178.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.22 -30.03 70.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.153 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 910' ' ' GLU . . . . . 0.484 ' HA ' ' SG ' ' A' ' 922' ' ' CYS . 0.0 OUTLIER -65.01 -43.99 90.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.014 175.646 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -63.33 -43.25 98.28 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.341 177.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -61.46 -42.38 98.69 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.977 179.17 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.97 -41.52 91.07 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.145 -179.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 69.4 m -69.5 -31.67 70.05 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.862 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.65 -46.25 89.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.94 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 916' ' ' GLU . . . . . 0.517 ' HG2' ' H ' ' A' ' 918' ' ' GLY . 0.0 OUTLIER -77.71 -32.29 52.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.557 178.615 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 917' ' ' SER . . . . . 0.488 ' N ' ' HG2' ' A' ' 916' ' ' GLU . 0.1 OUTLIER 47.03 46.82 16.06 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.383 -178.664 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 918' ' ' GLY . . . . . 0.599 ' HA2' ' HB3' ' A' ' 891' ' ' ARG . . . -122.56 -32.2 0.98 Allowed Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.605 -178.361 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 919' ' ' MET . . . . . 0.867 ' HA ' HG11 ' A' ' 899' ' ' VAL . 3.3 mtt -83.16 -86.87 0.1 Allowed 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 121.206 -0.198 . . . . 0.0 110.5 179.819 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 920' ' ' ASP . . . . . 0.541 ' HB2' ' O ' ' A' ' 919' ' ' MET . 43.8 t0 161.18 -67.72 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.616 0 O-C-N 124.183 0.927 . . . . 0.0 109.276 177.295 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 921' ' ' SER . . . . . 0.919 ' HG ' ' HH ' ' A' ' 939' ' ' TYR . 66.3 m -127.06 -177.87 4.21 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.502 -178.578 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 922' ' ' CYS . . . . . 0.484 ' SG ' ' HA ' ' A' ' 910' ' ' GLU . 0.5 OUTLIER -139.59 145.44 38.58 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.897 0.379 . . . . 0.0 111.094 -177.021 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 923' ' ' LEU . . . . . 1.03 ' HG ' HG21 ' A' ' 900' ' ' ILE . 58.4 mt -130.04 166.73 19.53 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.041 179.346 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 924' ' ' SER . . . . . 0.468 ' O ' HG22 ' A' ' 927' ' ' VAL . 0.7 OUTLIER -91.52 144.75 25.23 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.016 173.971 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 925' ' ' LYS . . . . . 0.673 ' HE2' ' HB2' ' A' ' 875' ' ' ASP . 2.7 tmtt? -58.72 -46.71 99.55 Favored Pre-proline 0 N--CA 1.467 0.38 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 926' ' ' PRO . . . . . 0.483 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 46.7 Cg_endo -69.69 55.38 1.24 Allowed 'Trans proline' 0 C--N 1.355 0.908 0 C-N-CA 122.055 1.837 . . . . 0.0 112.592 174.296 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 927' ' ' VAL . . . . . 0.713 HG21 HG12 ' A' ' 931' ' ' VAL . 0.9 OUTLIER -67.97 129.19 32.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.789 176.786 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.57 167.89 10.86 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.824 179.841 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 929' ' ' LEU . . . . . 0.832 HD22 ' HG2' ' A' ' 843' ' ' GLN . 0.0 OUTLIER -54.9 -45.38 74.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.872 0.367 . . . . 0.0 110.764 179.201 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -64.06 -40.22 95.8 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.912 0.387 . . . . 0.0 110.721 -178.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 931' ' ' VAL . . . . . 0.713 HG12 HG21 ' A' ' 927' ' ' VAL . 13.6 t -65.27 -49.98 75.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.802 -178.743 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 932' ' ' ILE . . . . . 0.58 ' O ' ' HB2' ' A' ' 936' ' ' LEU . 2.9 tp -66.23 -31.4 53.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.812 0.339 . . . . 0.0 110.659 -179.123 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 933' ' ' LYS . . . . . 0.607 ' HA ' HD23 ' A' ' 847' ' ' LEU . 0.3 OUTLIER -66.21 -49.17 68.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.983 178.936 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 934' ' ' GLN . . . . . 0.474 ' HG3' ' N ' ' A' ' 935' ' ' THR . 0.1 OUTLIER -75.22 -42.31 55.75 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.648 -174.375 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 935' ' ' THR . . . . . 0.474 ' N ' ' HG3' ' A' ' 934' ' ' GLN . 3.3 m -70.14 -42.2 72.89 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.531 0.197 . . . . 0.0 111.531 -175.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 936' ' ' LEU . . . . . 0.58 ' HB2' ' O ' ' A' ' 932' ' ' ILE . 0.7 OUTLIER -67.17 -44.54 79.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.695 0.283 . . . . 0.0 110.788 -179.985 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 80.4 m -68.17 -38.66 82.3 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.226 -178.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 938' ' ' LEU . . . . . 0.499 ' O ' ' HB2' ' A' ' 942' ' ' ARG . 0.0 OUTLIER -63.52 -42.18 98.46 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.907 0.384 . . . . 0.0 110.423 178.078 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 939' ' ' TYR . . . . . 0.919 ' HH ' ' HG ' ' A' ' 921' ' ' SER . 0.4 OUTLIER -69.28 -40.91 77.48 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.91 179.311 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -59.15 -47.83 83.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.588 -178.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 941' ' ' GLU . . . . . 0.434 ' HG3' ' N ' ' A' ' 942' ' ' ARG . 3.8 pt-20 -71.53 -32.96 68.74 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.759 0.314 . . . . 0.0 110.598 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 942' ' ' ARG . . . . . 0.499 ' HB2' ' O ' ' A' ' 938' ' ' LEU . 2.3 ttp180 -65.23 -48.26 73.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.315 -178.016 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 18.1 m -70.92 -36.67 64.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 120.962 0.411 . . . . 0.0 111.367 -178.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.3 -38.68 63.27 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.494 -176.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 8.5 pttp -70.76 -35.39 72.6 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.657 0.265 . . . . 0.0 110.669 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 19.8 m -73.03 -23.26 60.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.13 0.491 . . . . 0.0 110.423 177.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.22 -21.57 33.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.371 176.647 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 32.3 t0 . . . . . 0 N--CA 1.464 0.274 0 O-C-N 123.874 0.733 . . . . 0.0 110.826 179.482 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.452 -0.351 0 CA-C-O 120.808 0.337 . . . . 0.0 111.547 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 88.8 3.31 77.26 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.832 -0.699 . . . . 0.0 113.402 171.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.87 137.83 57.46 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 178.326 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 708' ' ' ARG . . . . . . . . . . . . . 3.8 mtt85 -103.02 156.29 17.78 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.215 0.531 . . . . 0.0 111.615 -177.354 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -138.74 128.78 25.34 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.02 -0.991 . . . . 0.0 108.741 174.167 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 710' ' ' TRP . . . . . 0.822 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 96.5 m95 -92.26 129.31 38.24 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.408 0.623 . . . . 0.0 110.468 -176.263 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 711' ' ' LEU . . . . . 0.616 HD21 ' HB2' ' A' ' 719' ' ' CYS . 0.9 OUTLIER -118.1 125.95 51.3 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.668 -172.657 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 712' ' ' ALA . . . . . 0.514 ' HB3' HG23 ' A' ' 749' ' ' THR . . . -126.15 52.7 1.67 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.311 0.577 . . . . 0.0 110.045 177.681 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 713' ' ' VAL . . . . . 0.691 ' HA ' ' HB3' ' A' ' 750' ' ' ASP . 87.5 t -111.95 120.96 63.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.917 179.434 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 714' ' ' ARG . . . . . 0.459 ' NH2' ' HB3' ' A' ' 751' ' ' GLU . 1.9 mtm180 -81.34 -19.57 42.52 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.081 0.467 . . . . 0.0 110.461 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -75.62 100.17 4.54 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.853 176.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 716' ' ' ALA . . . . . 0.6 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -61.68 -35.29 77.57 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.714 -173.936 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -65.07 -46.79 79.74 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.008 0.433 . . . . 0.0 110.44 177.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 718' ' ' LEU . . . . . 0.539 ' HG ' ' HB2' ' A' ' 787' ' ' ALA . 2.3 tt -69.27 -45.17 70.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.762 -179.504 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 719' ' ' CYS . . . . . 0.616 ' HB2' HD21 ' A' ' 711' ' ' LEU . 8.3 p -66.82 -40.68 88.12 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.941 -177.325 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 720' ' ' GLN . . . . . 0.439 ' HB2' ' O ' ' A' ' 716' ' ' ALA . 0.1 OUTLIER -59.95 -41.33 91.63 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-O 120.586 0.232 . . . . 0.0 110.811 177.925 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -56.71 -52.82 63.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.899 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 722' ' ' LEU . . . . . 0.508 HD11 HG23 ' A' ' 748' ' ' ILE . 3.2 mt -67.08 -47.46 71.17 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.094 -178.44 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 723' ' ' GLU . . . . . 0.43 ' HA ' ' CG2' ' A' ' 733' ' ' VAL . 0.3 OUTLIER -61.42 -39.29 90.25 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.278 -174.386 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 724' ' ' THR . . . . . 0.547 ' HA ' ' CG ' ' A' ' 727' ' ' GLN . 88.3 m -73.01 -34.2 66.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.693 0.282 . . . . 0.0 111.155 -178.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 50.4 m -61.98 -36.15 80.62 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.761 0.315 . . . . 0.0 110.933 177.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 726' ' ' LEU . . . . . 0.526 HD11 HG22 ' A' ' 733' ' ' VAL . 1.1 mt -78.42 -41.36 33.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.271 -178.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 727' ' ' GLN . . . . . 0.547 ' CG ' ' HA ' ' A' ' 724' ' ' THR . 1.7 pt20 -74.2 -4.82 38.23 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.973 0.416 . . . . 0.0 111.111 -179.287 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.4 -22.26 65.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.171 175.102 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 729' ' ' SER . . . . . 0.52 ' HB2' ' H ' ' A' ' 730' ' ' GLY . 0.1 OUTLIER -104.38 -107.98 0.28 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.227 177.358 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 730' ' ' GLY . . . . . 0.52 ' H ' ' HB2' ' A' ' 729' ' ' SER . . . -138.93 25.55 2.79 Favored Glycine 0 CA--C 1.51 -0.239 0 N-CA-C 110.922 -0.871 . . . . 0.0 110.922 179.134 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 731' ' ' ILE . . . . . 0.431 ' O ' ' HA ' ' A' ' 727' ' ' GLN . 1.0 OUTLIER -107.47 146.68 13.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 -178.067 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 732' ' ' VAL . . . . . . . . . . . . . 2.1 p -123.36 131.57 72.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.043 0.449 . . . . 0.0 110.981 -176.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 733' ' ' VAL . . . . . 0.526 HG22 HD11 ' A' ' 726' ' ' LEU . 3.7 t -101.44 147.56 8.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 177.768 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -149.01 141.61 24.41 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.816 0.341 . . . . 0.0 111.057 -173.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -59.48 118.21 5.77 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.829 178.325 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 736' ' ' TYR . . . . . 0.822 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 36.5 t80 -85.31 91.01 8.06 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.189 0.519 . . . . 0.0 110.833 -179.494 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 737' ' ' GLU . . . . . 0.497 ' HB2' ' H ' ' A' ' 738' ' ' GLY . 0.0 OUTLIER -93.46 -128.66 0.12 Allowed 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.312 172.061 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 738' ' ' GLY . . . . . 0.497 ' H ' ' HB2' ' A' ' 737' ' ' GLU . . . -80.93 59.33 4.75 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.615 -0.803 . . . . 0.0 112.398 178.155 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 739' ' ' GLN . . . . . 0.483 ' HG2' ' CH2' ' A' ' 710' ' ' TRP . 0.9 OUTLIER -107.37 176.24 5.22 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 -179.049 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 740' ' ' GLU . . . . . 0.419 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 1.1 mt-10 -87.0 141.02 32.91 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.788 -177.918 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 741' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 740' ' ' GLU . 5.4 Cg_endo -87.69 121.39 1.55 Allowed 'Trans proline' 0 N--CA 1.453 -0.888 0 C-N-CA 123.023 2.482 . . . . 0.0 111.585 175.031 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 742' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.16 136.24 20.5 Favored Pre-proline 0 C--N 1.32 -0.708 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.444 -174.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 743' ' ' PRO . . . . . 0.752 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 31.8 Cg_endo -65.89 -9.62 23.79 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 123.045 2.497 . . . . 0.0 112.644 177.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -101.84 -1.1 32.97 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.657 175.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 37.2 m-20 -110.79 150.85 28.52 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.894 0.378 . . . . 0.0 110.911 -174.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 2.4 p -117.23 136.75 53.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.449 -178.057 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 747' ' ' LEU . . . . . 0.474 HD21 ' N ' ' A' ' 748' ' ' ILE . 0.4 OUTLIER -100.45 136.8 39.76 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.015 -0.538 . . . . 0.0 109.984 177.707 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 748' ' ' ILE . . . . . 0.508 HG23 HD11 ' A' ' 722' ' ' LEU . 18.0 mt -120.12 107.69 21.52 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 171.22 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 749' ' ' THR . . . . . 0.514 HG23 ' HB3' ' A' ' 712' ' ' ALA . 0.0 OUTLIER -106.05 164.79 11.69 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.813 -0.631 . . . . 0.0 112.159 -170.536 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 750' ' ' ASP . . . . . 0.691 ' HB3' ' HA ' ' A' ' 713' ' ' VAL . 0.0 OUTLIER -129.01 129.34 45.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.936 173.751 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 751' ' ' GLU . . . . . 0.97 ' HG2' ' H ' ' A' ' 752' ' ' VAL . 20.7 tt0 65.3 -178.44 0.18 Allowed 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.682 0.753 . . . . 0.0 111.697 -179.741 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 752' ' ' VAL . . . . . 0.97 ' H ' ' HG2' ' A' ' 751' ' ' GLU . 4.5 p -61.66 132.55 27.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 114.917 -1.038 . . . . 0.0 111.294 178.176 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 8.1 p -129.69 153.77 39.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.168 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -96.54 40.95 1.12 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.758 0.313 . . . . 0.0 111.559 -177.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 755' ' ' LYS . . . . . 0.413 ' O ' HD11 ' A' ' 772' ' ' ILE . 0.0 OUTLIER -148.08 154.29 40.02 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 177.722 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 756' ' ' LYS . . . . . 0.417 ' O ' ' HB3' ' A' ' 757' ' ' TRP . 3.7 tptp -102.24 -37.6 8.03 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 121.316 -0.154 . . . . 0.0 111.271 -177.182 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 757' ' ' TRP . . . . . 0.513 ' CD1' ' HB ' ' A' ' 762' ' ' VAL . 63.5 t-105 72.1 105.34 0.07 Allowed 'General case' 0 N--CA 1.468 0.432 0 O-C-N 123.88 0.737 . . . . 0.0 111.312 179.273 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 4.9 mm100 -100.27 84.4 2.81 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.061 177.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 759' ' ' GLY . . . . . 0.752 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -144.71 -149.08 4.97 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.574 -0.822 . . . . 0.0 113.134 -177.534 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.97 -53.74 45.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.238 0.542 . . . . 0.0 109.872 -179.566 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -164.04 156.3 17.1 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.068 178.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 762' ' ' VAL . . . . . 0.513 ' HB ' ' CD1' ' A' ' 757' ' ' TRP . 2.4 p -134.39 113.71 17.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 175.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -111.67 105.87 19.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.22 -177.65 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 764' ' ' THR . . . . . 0.414 ' HB ' HG11 ' A' ' 782' ' ' VAL . 68.1 m -99.23 120.48 39.61 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.546 -177.218 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 765' ' ' PHE . . . . . 0.615 ' HE1' HG23 ' A' ' 785' ' ' VAL . 8.8 m-85 -76.64 130.34 37.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.138 175.424 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 766' ' ' CYS . . . . . 0.527 ' O ' ' HA ' ' A' ' 784' ' ' SER . 3.2 m -105.25 131.45 52.69 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-O 120.968 0.413 . . . . 0.0 109.964 176.201 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.6 22.54 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 178.687 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 768' ' ' ARG . . . . . 0.494 ' HB3' ' H ' ' A' ' 769' ' ' HIS . 0.0 OUTLIER -157.66 -104.24 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.8 -1.091 . . . . 0.0 108.424 -177.088 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . 0.494 ' H ' ' HB3' ' A' ' 768' ' ' ARG . 0.2 OUTLIER -111.13 147.77 34.15 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 109.921 -0.399 . . . . 0.0 109.921 171.409 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 770' ' ' ILE . . . . . 0.463 HG23 ' N ' ' A' ' 771' ' ' GLY . 4.6 mt -106.81 154.05 7.86 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.802 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.867 -179.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 771' ' ' GLY . . . . . 0.697 ' HA3' HG23 ' A' ' 752' ' ' VAL . . . -151.09 -39.65 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.871 -0.68 . . . . 0.0 111.765 -179.451 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 772' ' ' ILE . . . . . 0.443 ' HA ' ' HD3' ' A' ' 773' ' ' PRO . 32.9 mm -88.42 131.26 42.76 Favored Pre-proline 0 C--N 1.324 -0.503 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 176.608 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 773' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 772' ' ' ILE . 12.1 Cg_exo -70.64 172.98 12.45 Favored 'Trans proline' 0 N--CA 1.463 -0.316 0 C-N-CA 122.759 2.306 . . . . 0.0 111.936 178.43 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . 0.544 ' HB3' HG23 ' A' ' 782' ' ' VAL . 0.7 OUTLIER -90.16 -152.57 0.26 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.734 -179.045 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 775' ' ' GLU . . . . . 0.528 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 1.2 mp0 -62.21 72.42 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.61 -21.47 30.33 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 168.177 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 777' ' ' ALA . . . . . 0.453 ' HB3' ' HG3' ' A' ' 780' ' ' GLU . . . -143.1 155.35 62.02 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 114.321 -1.309 . . . . 0.0 109.102 179.623 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -65.22 78.08 0.23 Allowed 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.891 2.394 . . . . 0.0 111.731 175.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 163.59 -28.31 0.23 Allowed Glycine 0 N--CA 1.447 -0.604 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.54 -178.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 780' ' ' GLU . . . . . 0.528 ' O ' ' HG3' ' A' ' 775' ' ' GLU . 3.5 mt-10 -89.04 121.95 31.89 Favored 'General case' 0 C--O 1.222 -0.39 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 179.385 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 781' ' ' TRP . . . . . 0.505 ' CZ3' HD13 ' A' ' 794' ' ' LEU . 34.4 m95 -139.38 139.0 37.06 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.929 0.395 . . . . 0.0 110.647 -178.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . 0.544 HG23 ' HB3' ' A' ' 774' ' ' LEU . 28.5 m -138.37 153.52 26.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 169.334 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 783' ' ' HIS . . . . . . . . . . . . . 4.9 t-160 -155.88 120.7 4.71 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.765 0.317 . . . . 0.0 110.454 176.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 784' ' ' SER . . . . . 0.527 ' HA ' ' O ' ' A' ' 766' ' ' CYS . 0.4 OUTLIER -84.73 100.86 11.77 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.059 178.268 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 785' ' ' VAL . . . . . 0.615 HG23 ' HE1' ' A' ' 765' ' ' PHE . 0.0 OUTLIER -162.01 -178.51 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.53 178.548 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -113.8 31.87 6.23 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.79 0.329 . . . . 0.0 110.572 178.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 787' ' ' ALA . . . . . 0.539 ' HB2' ' HG ' ' A' ' 718' ' ' LEU . . . 59.46 73.19 0.7 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.009 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 788' ' ' PRO . . . . . 0.66 ' HD2' ' OE1' ' A' ' 790' ' ' GLU . 12.0 Cg_exo -71.8 -67.91 0.02 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.711 2.274 . . . . 0.0 110.947 173.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 1.4 p-80 176.45 28.48 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 122.784 0.434 . . . . 0.0 110.816 175.246 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 790' ' ' GLU . . . . . 0.66 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -101.25 -43.83 5.85 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.02 0.438 . . . . 0.0 110.265 -177.923 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 791' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.66 -47.47 56.21 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 115.822 -0.627 . . . . 0.0 111.788 179.07 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 792' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_exo -57.25 -33.65 96.4 Favored 'Trans proline' 0 C--N 1.359 1.102 0 C-N-CA 121.701 1.6 . . . . 0.0 111.58 175.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -68.61 -41.76 79.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.584 177.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 794' ' ' LEU . . . . . 0.505 HD13 ' CZ3' ' A' ' 781' ' ' TRP . 0.3 OUTLIER -69.57 -28.43 65.96 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.878 178.431 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 795' ' ' LEU . . . . . 0.441 ' HA ' HD21 ' A' ' 795' ' ' LEU . 0.2 OUTLIER -63.88 -40.5 96.69 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.959 -0.386 . . . . 0.0 109.959 177.521 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -68.71 -34.61 75.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.025 0.44 . . . . 0.0 110.764 176.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.9 -49.05 64.15 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.666 179.681 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -66.09 -31.17 52.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.595 177.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -62.16 -34.4 76.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.024 177.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 4.6 mt . . . . . 0 C--O 1.234 0.255 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.409 -178.253 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 2.0 t0 . . . . . 0 N--CA 1.454 -0.274 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 2.6 mtt -76.41 120.45 21.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.237 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 826' ' ' MET . . . . . . . . . . . . . 37.0 ttm -94.02 121.36 35.42 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.288 0.566 . . . . 0.0 111.579 -177.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 827' ' ' ILE . . . . . 0.46 HG22 HD12 ' A' ' 827' ' ' ILE . 13.6 mm -112.91 130.74 66.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 114.966 -1.015 . . . . 0.0 109.087 175.292 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 828' ' ' LEU . . . . . 0.57 HD22 HG22 ' A' ' 872' ' ' VAL . 34.6 tp -95.21 114.41 26.2 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.196 0.522 . . . . 0.0 110.024 -179.717 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 829' ' ' VAL . . . . . 0.857 ' HB ' ' HD2' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -103.09 107.31 21.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.033 -178.94 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 830' ' ' VAL . . . . . 0.6 HG22 ' HB2' ' A' ' 854' ' ' ALA . 8.9 t -109.2 130.85 61.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.197 179.59 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 831' ' ' ASP . . . . . 0.747 ' HB2' ' NE ' ' A' ' 837' ' ' ARG . 8.6 t0 -135.97 146.01 46.79 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 175.036 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.49 -17.9 62.32 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.234 0.54 . . . . 0.0 109.802 173.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 7.6 m80 -108.25 103.43 50.51 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.393 175.247 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_exo -57.34 -48.85 15.73 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 123.123 2.548 . . . . 0.0 113.984 -173.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 835' ' ' ILE . . . . . 0.417 HD11 ' HA ' ' A' ' 835' ' ' ILE . 0.3 OUTLIER -63.94 -35.62 74.0 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-O 120.957 0.408 . . . . 0.0 110.185 -178.164 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 836' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -62.46 -49.02 77.09 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.62 177.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 837' ' ' ARG . . . . . 0.857 ' HD2' ' HB ' ' A' ' 829' ' ' VAL . 0.0 OUTLIER -60.27 -47.0 87.87 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.633 -178.915 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.79 -31.11 72.18 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 123.112 0.258 . . . . 0.0 111.144 -176.256 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 839' ' ' LEU . . . . . 0.435 ' HA ' HD23 ' A' ' 839' ' ' LEU . 0.2 OUTLIER -76.82 -47.43 21.48 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.388 -176.19 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 840' ' ' LEU . . . . . . . . . . . . . 2.6 pp -73.36 -26.1 60.87 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.537 178.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -67.61 -29.7 69.1 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 173.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -64.57 -43.34 94.2 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 174.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 843' ' ' GLN . . . . . 0.522 ' HB3' HD21 ' A' ' 929' ' ' LEU . 8.1 mm-40 -61.24 -41.23 96.53 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.413 175.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 844' ' ' LEU . . . . . 0.606 HD12 HD11 ' A' ' 932' ' ' ILE . 0.1 OUTLIER -58.88 -35.14 72.52 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.373 175.397 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -71.27 -35.22 63.83 Favored Glycine 0 N--CA 1.449 -0.468 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.053 177.072 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.62 -16.73 63.44 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 120.958 0.408 . . . . 0.0 110.431 176.715 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 847' ' ' LEU . . . . . 0.432 HD23 ' HG3' ' A' ' 933' ' ' LYS . 24.3 mt -80.19 -12.42 59.64 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.588 176.03 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 92.4 19.8 37.28 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 121.018 -0.61 . . . . 0.0 112.784 178.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 31.1 m-85 -110.82 163.28 13.95 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.632 0.253 . . . . 0.0 110.611 -179.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.81 108.06 20.66 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.255 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -98.77 135.74 39.81 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.669 -178.08 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.71 128.06 55.6 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 173.537 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.66 131.86 40.0 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.291 0.567 . . . . 0.0 112.19 -173.237 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 854' ' ' ALA . . . . . 0.6 ' HB2' HG22 ' A' ' 830' ' ' VAL . . . -140.01 156.95 46.38 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.631 175.379 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 855' ' ' ASN . . . . . 0.593 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 0.1 OUTLIER -146.04 71.77 1.27 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.229 0.537 . . . . 0.0 111.667 -179.149 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 856' ' ' ASP . . . . . 0.593 ' HB2' ' O ' ' A' ' 855' ' ' ASN . 3.9 t70 162.96 174.52 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.209 1.004 . . . . 0.0 108.769 175.191 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 857' ' ' GLY . . . . . 0.467 ' CA ' HD13 ' A' ' 886' ' ' LEU . . . -83.93 -39.19 9.58 Favored Glycine 0 N--CA 1.446 -0.684 0 N-CA-C 110.878 -0.889 . . . . 0.0 110.878 175.787 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 858' ' ' VAL . . . . . 0.418 ' O ' ' HB2' ' A' ' 862' ' ' ASN . 6.7 m -73.41 -31.56 33.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.811 0.338 . . . . 0.0 110.297 177.488 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -65.59 -48.72 71.37 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.521 178.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -62.66 -42.42 99.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.411 -179.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 861' ' ' LEU . . . . . 0.413 HD12 ' HA ' ' A' ' 890' ' ' ILE . 56.3 tp -69.26 -38.19 78.29 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.877 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 862' ' ' ASN . . . . . 0.418 ' HB2' ' O ' ' A' ' 858' ' ' VAL . 33.7 t30 -57.83 -54.93 41.35 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.9 -179.29 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 863' ' ' VAL . . . . . 0.429 HG11 ' N ' ' A' ' 864' ' ' LEU . 8.1 p -63.09 -31.49 52.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.646 179.515 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 864' ' ' LEU . . . . . 0.571 HD21 HD21 ' A' ' 897' ' ' LEU . 0.6 OUTLIER -64.39 -36.69 84.96 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.02 178.673 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -76.3 -24.73 54.38 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.263 0.554 . . . . 0.0 110.255 179.627 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.44 -53.21 8.44 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.015 179.413 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -135.31 144.57 46.81 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.207 -175.786 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -70.4 138.24 51.13 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.184 0.516 . . . . 0.0 111.792 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 869' ' ' ILE . . . . . 0.468 HD11 HD23 ' A' ' 864' ' ' LEU . 5.6 mt -131.69 139.42 50.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 175.514 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -77.06 -59.39 2.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.863 0.363 . . . . 0.0 111.197 -173.936 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 871' ' ' ILE . . . . . . . . . . . . . 1.1 mp -117.95 130.46 72.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 CA-C-O 120.908 0.385 . . . . 0.0 110.141 -179.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 872' ' ' VAL . . . . . 0.57 HG22 HD22 ' A' ' 828' ' ' LEU . 53.8 t -123.42 125.11 71.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.21 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 873' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -118.74 131.63 56.13 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.9 0.381 . . . . 0.0 110.268 178.391 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -109.8 101.2 10.09 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.699 -178.125 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 875' ' ' ASP . . . . . 0.543 ' OD1' HG22 ' A' ' 902' ' ' VAL . 0.3 OUTLIER -90.48 118.15 29.73 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.466 -179.368 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -131.58 117.04 33.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-O 120.883 0.373 . . . . 0.0 111.229 179.13 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -62.61 -61.03 2.71 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 172.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.319 -0.749 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 168.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 0.204 0 CA-C-O 120.126 -0.264 . . . . 0.0 113.717 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 884' ' ' TYR . . . . . 0.775 ' HH ' HE21 ' A' ' 888' ' ' GLN . 0.0 OUTLIER -59.27 -28.89 67.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.5 0.667 . . . . 0.0 109.562 176.68 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 885' ' ' ARG . . . . . 0.47 ' HD2' ' N ' ' A' ' 886' ' ' LEU . 0.0 OUTLIER -61.02 -31.68 71.3 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.144 -0.934 . . . . 0.0 110.728 -179.275 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 886' ' ' LEU . . . . . 0.47 ' N ' ' HD2' ' A' ' 885' ' ' ARG . 0.0 OUTLIER -67.7 -47.63 68.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.748 0.308 . . . . 0.0 110.299 -178.768 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 887' ' ' THR . . . . . 0.417 ' N ' ' HG ' ' A' ' 886' ' ' LEU . 0.0 OUTLIER -69.53 -38.46 77.52 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.311 0.577 . . . . 0.0 110.655 -178.704 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 888' ' ' GLN . . . . . 0.775 HE21 ' HH ' ' A' ' 884' ' ' TYR . 5.5 tp-100 -62.83 -51.29 67.6 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.745 177.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 889' ' ' ARG . . . . . 0.457 ' HB2' ' O ' ' A' ' 885' ' ' ARG . 0.0 OUTLIER -62.48 -42.78 99.72 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.988 -174.432 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 890' ' ' ILE . . . . . 0.413 ' HA ' HD12 ' A' ' 861' ' ' LEU . 1.4 tt -67.96 -41.27 84.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 120.857 -0.337 . . . . 0.0 111.411 -176.298 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 891' ' ' ARG . . . . . 0.43 ' HA ' HD21 ' A' ' 895' ' ' LEU . 0.1 OUTLIER -75.31 -27.03 59.14 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.675 0.274 . . . . 0.0 111.26 179.717 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 30.4 tp60 -77.63 -37.16 50.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.046 -179.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 893' ' ' LEU . . . . . 0.408 ' HB2' HD21 ' A' ' 861' ' ' LEU . 0.5 OUTLIER -73.97 -32.35 63.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.751 179.764 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 121.91 83.11 0.67 Allowed Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.877 176.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 895' ' ' LEU . . . . . 0.54 HD13 HG21 ' A' ' 899' ' ' VAL . 0.2 OUTLIER -89.09 135.99 33.26 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 110.236 -0.283 . . . . 0.0 110.236 178.035 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -131.48 26.5 4.76 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.919 0.39 . . . . 0.0 111.532 -177.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 897' ' ' LEU . . . . . 0.571 HD21 HD21 ' A' ' 864' ' ' LEU . 0.0 OUTLIER -145.56 154.65 52.8 Favored Pre-proline 0 C--N 1.323 -0.56 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.311 -175.784 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -63.67 110.6 1.3 Allowed 'Trans proline' 0 C--O 1.236 0.41 0 C-N-CA 122.72 2.28 . . . . 0.0 112.16 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 899' ' ' VAL . . . . . 0.54 HG21 HD13 ' A' ' 895' ' ' LEU . 26.7 t -100.95 112.94 35.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.44 0.638 . . . . 0.0 110.643 177.783 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 900' ' ' ILE . . . . . 0.678 HG21 ' HB2' ' A' ' 921' ' ' SER . 2.0 mt -90.45 106.63 17.55 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.812 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.303 179.512 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 901' ' ' GLY . . . . . 0.58 ' O ' ' HA ' ' A' ' 922' ' ' CYS . . . -85.91 119.09 5.01 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 120.755 -0.736 . . . . 0.0 111.511 178.679 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 902' ' ' VAL . . . . . 0.543 HG22 ' OD1' ' A' ' 875' ' ' ASP . 0.1 OUTLIER -124.12 119.5 56.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-O 121.084 0.468 . . . . 0.0 110.251 -178.203 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 903' ' ' THR . . . . . 0.43 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.0 OUTLIER -120.02 160.05 23.56 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.981 -176.193 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 904' ' ' ALA . . . . . 0.588 ' HA ' ' HB2' ' A' ' 925' ' ' LYS . . . -72.48 139.41 47.63 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 173.13 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -64.68 105.36 0.97 Allowed 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.091 0.472 . . . . 0.0 110.451 -177.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -117.99 -42.93 2.78 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.509 -0.769 . . . . 0.0 111.195 -174.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -158.76 -73.97 0.08 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.363 -176.136 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -161.58 55.22 0.27 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.308 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 909' ' ' GLU . . . . . 0.404 ' HG3' ' H ' ' A' ' 909' ' ' GLU . 0.0 OUTLIER -65.88 -29.84 70.34 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.456 -177.232 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 910' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.67 -37.49 76.13 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.537 174.924 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -67.77 -41.57 83.06 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.303 178.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -62.28 -37.14 84.35 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.405 177.414 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.17 -37.37 85.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.508 177.288 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 76.9 m -65.97 -33.54 76.05 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.321 176.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.97 -39.69 75.82 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.637 176.451 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -66.22 -52.02 51.93 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.138 -178.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 46.6 48.18 14.34 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -133.0 -33.41 0.37 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.937 176.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 919' ' ' MET . . . . . 0.534 ' O ' ' HB2' ' A' ' 920' ' ' ASP . 12.8 mtt -65.76 -80.96 0.03 OUTLIER 'General case' 0 C--O 1.236 0.394 0 CA-C-O 120.654 0.264 . . . . 0.0 111.386 179.254 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 920' ' ' ASP . . . . . 0.534 ' HB2' ' O ' ' A' ' 919' ' ' MET . 12.4 t70 168.54 -85.53 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.788 177.067 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 921' ' ' SER . . . . . 0.678 ' HB2' HG21 ' A' ' 900' ' ' ILE . 0.0 OUTLIER -109.33 175.79 5.32 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.151 -173.562 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 922' ' ' CYS . . . . . 0.58 ' HA ' ' O ' ' A' ' 901' ' ' GLY . 0.0 OUTLIER -146.43 137.54 24.34 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 120.753 0.311 . . . . 0.0 111.501 -179.925 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 923' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -143.0 -175.81 4.66 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.846 175.387 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 924' ' ' SER . . . . . 0.578 ' HB3' ' HD2' ' A' ' 926' ' ' PRO . 0.5 OUTLIER -114.35 150.53 34.43 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.744 0.307 . . . . 0.0 110.776 -179.644 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 925' ' ' LYS . . . . . 0.588 ' HB2' ' HA ' ' A' ' 904' ' ' ALA . 0.0 OUTLIER -50.56 -40.29 59.5 Favored Pre-proline 0 CA--C 1.54 0.579 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 -175.515 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 926' ' ' PRO . . . . . 0.578 ' HD2' ' HB3' ' A' ' 924' ' ' SER . 40.8 Cg_exo -61.08 72.33 0.08 OUTLIER 'Trans proline' 0 C--N 1.361 1.187 0 C-N-CA 121.892 1.728 . . . . 0.0 113.286 174.503 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 927' ' ' VAL . . . . . 0.681 HG12 HG12 ' A' ' 931' ' ' VAL . 3.8 t -107.44 124.75 63.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.92 177.08 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 928' ' ' THR . . . . . 0.537 ' OG1' ' HB ' ' A' ' 931' ' ' VAL . 3.0 p -88.89 171.0 10.23 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.162 -179.345 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 929' ' ' LEU . . . . . 0.522 HD21 ' HB3' ' A' ' 843' ' ' GLN . 1.3 tm? -63.47 -46.33 86.68 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.864 0.364 . . . . 0.0 110.087 176.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -63.76 -42.15 97.86 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.832 0.348 . . . . 0.0 110.858 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 931' ' ' VAL . . . . . 0.681 HG12 HG12 ' A' ' 927' ' ' VAL . 0.8 OUTLIER -68.37 -32.41 55.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.656 179.618 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 932' ' ' ILE . . . . . 0.629 ' O ' ' HB2' ' A' ' 936' ' ' LEU . 0.4 OUTLIER -64.68 -40.06 87.77 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.255 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 175.565 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 933' ' ' LYS . . . . . 0.432 ' HG3' HD23 ' A' ' 847' ' ' LEU . 5.2 ttmt -66.17 -45.95 79.09 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.545 178.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -61.5 -53.81 51.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.24 -179.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 3.6 m -65.07 -39.35 93.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.189 -177.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 936' ' ' LEU . . . . . 0.629 ' HB2' ' O ' ' A' ' 932' ' ' ILE . 4.9 tp -60.85 -48.15 83.14 Favored 'General case' 0 C--O 1.223 -0.308 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.316 177.368 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 93.2 m -62.93 -41.58 99.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.169 -179.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.66 -46.89 87.67 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.105 0.478 . . . . 0.0 111.456 -179.362 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -78.51 -32.84 48.31 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.218 -177.443 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 940' ' ' ALA . . . . . 0.478 ' O ' ' HB2' ' A' ' 944' ' ' ARG . . . -66.94 -41.41 87.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.945 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 941' ' ' GLU . . . . . 0.576 ' HG3' ' N ' ' A' ' 942' ' ' ARG . 0.2 OUTLIER -66.94 -35.78 80.74 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.84 -0.429 . . . . 0.0 109.84 176.795 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 942' ' ' ARG . . . . . 0.576 ' N ' ' HG3' ' A' ' 941' ' ' GLU . 0.0 OUTLIER -60.23 -48.43 81.78 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.855 -179.764 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 13.7 m -76.11 -30.21 20.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.021 -179.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 944' ' ' ARG . . . . . 0.478 ' HB2' ' O ' ' A' ' 940' ' ' ALA . 0.0 OUTLIER -65.47 -41.26 93.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.178 179.67 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 945' ' ' LYS . . . . . 0.451 ' HG2' ' O ' ' A' ' 942' ' ' ARG . 4.4 pttt -71.9 -31.31 66.27 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.706 179.615 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 15.0 m -68.96 -35.51 76.84 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 120.879 0.371 . . . . 0.0 110.952 174.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 3.1 ttm180 -77.52 -19.89 55.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.531 178.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 15.3 t0 . . . . . 0 C--N 1.33 -0.244 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.129 177.847 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 705' ' ' SER . . . . . 0.405 ' HA ' ' O ' ' A' ' 730' ' ' GLY . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.267 0 CA-C-O 121.216 0.531 . . . . 0.0 110.854 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . -157.31 -0.66 0.1 OUTLIER Glycine 0 N--CA 1.445 -0.702 0 C-N-CA 120.295 -0.955 . . . . 0.0 113.428 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 707' ' ' LYS . . . . . 0.487 ' HG2' ' N ' ' A' ' 708' ' ' ARG . 0.0 OUTLIER -131.88 154.75 48.89 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 117.487 0.644 . . . . 0.0 110.039 179.699 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 708' ' ' ARG . . . . . 0.487 ' N ' ' HG2' ' A' ' 707' ' ' LYS . 0.0 OUTLIER -108.92 154.87 21.54 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.687 -175.18 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 709' ' ' CYS . . . . . 0.429 ' O ' ' HA ' ' A' ' 733' ' ' VAL . 74.6 m -142.73 143.93 32.45 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.773 175.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 710' ' ' TRP . . . . . 0.538 ' CZ3' ' HG3' ' A' ' 739' ' ' GLN . 86.0 m95 -111.36 143.79 41.6 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 120.939 0.4 . . . . 0.0 110.577 -179.868 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 711' ' ' LEU . . . . . 0.429 ' CD1' ' HB2' ' A' ' 719' ' ' CYS . 0.3 OUTLIER -133.51 132.86 41.47 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.46 0.648 . . . . 0.0 110.806 179.178 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -127.24 60.22 1.4 Allowed 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.326 176.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 713' ' ' VAL . . . . . 0.659 HG13 ' HB3' ' A' ' 750' ' ' ASP . 28.8 t -108.47 120.8 60.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.745 179.588 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 4.0 mtm180 -79.7 -27.47 40.72 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.06 -177.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -72.43 111.8 7.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.907 175.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 716' ' ' ALA . . . . . 0.527 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -66.42 -35.37 80.13 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.55 -174.197 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.78 -45.1 87.74 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.063 0.459 . . . . 0.0 110.631 178.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.03 -45.1 64.51 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.868 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 719' ' ' CYS . . . . . 0.527 ' SG ' ' HA ' ' A' ' 716' ' ' ALA . 2.4 p -65.5 -43.61 89.6 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.821 -177.011 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 720' ' ' GLN . . . . . 0.608 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 19.0 tp60 -63.3 -39.74 95.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.942 -179.589 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -55.91 -54.85 39.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.895 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 6.7 mt -68.17 -48.35 65.53 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.19 -178.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 723' ' ' GLU . . . . . 0.608 ' HG2' ' HA ' ' A' ' 720' ' ' GLN . 0.2 OUTLIER -64.07 -38.13 89.96 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.675 -173.439 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 724' ' ' THR . . . . . 0.546 ' N ' ' HG3' ' A' ' 723' ' ' GLU . 4.1 m -71.77 -40.27 69.38 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 120.601 0.239 . . . . 0.0 110.728 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 20.1 m -62.06 -38.57 89.27 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.465 178.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 726' ' ' LEU . . . . . 0.412 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 49.5 mt -67.55 -48.95 65.47 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.454 177.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 727' ' ' GLN . . . . . 0.574 HE21 HG12 ' A' ' 733' ' ' VAL . 24.0 mt-30 -59.65 -27.28 66.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.233 -179.298 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.42 -24.57 67.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.542 -179.321 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 72.1 m -103.19 7.09 38.63 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.946 0.403 . . . . 0.0 111.23 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 730' ' ' GLY . . . . . 0.405 ' O ' ' HA ' ' A' ' 705' ' ' SER . . . 92.26 1.46 69.37 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.774 177.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 731' ' ' ILE . . . . . 0.412 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 11.9 mm -66.91 127.21 28.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 120.647 0.261 . . . . 0.0 110.33 177.856 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 732' ' ' VAL . . . . . 0.466 ' O ' ' HG2' ' A' ' 708' ' ' ARG . 0.7 OUTLIER -88.73 104.59 14.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.461 0.648 . . . . 0.0 109.856 179.888 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 733' ' ' VAL . . . . . 0.574 HG12 HE21 ' A' ' 727' ' ' GLN . 1.6 p -99.53 141.7 16.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.385 -179.714 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 734' ' ' THR . . . . . 0.439 ' HB ' ' CZ3' ' A' ' 710' ' ' TRP . 0.2 OUTLIER -136.93 138.49 40.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.493 178.974 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.6 136.18 52.63 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.418 176.137 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -78.49 79.98 4.9 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.224 -176.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -70.18 -79.36 0.06 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.768 177.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -151.77 61.0 0.4 Allowed Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 121.149 -0.548 . . . . 0.0 111.828 179.216 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 739' ' ' GLN . . . . . 0.538 ' HG3' ' CZ3' ' A' ' 710' ' ' TRP . 1.1 mm-40 -114.45 176.24 5.13 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.824 0.345 . . . . 0.0 110.557 -177.413 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 740' ' ' GLU . . . . . 0.461 ' HG3' ' HD2' ' A' ' 741' ' ' PRO . 0.8 OUTLIER -93.42 141.13 23.52 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.866 -179.683 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 741' ' ' PRO . . . . . 0.605 ' HA ' ' CZ3' ' A' ' 757' ' ' TRP . 15.7 Cg_endo -58.45 132.38 48.2 Favored 'Trans proline' 0 C--O 1.234 0.291 0 C-N-CA 123.014 2.476 . . . . 0.0 112.219 176.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 742' ' ' THR . . . . . 0.556 ' HB ' ' HB2' ' A' ' 745' ' ' ASP . 0.2 OUTLIER -105.92 131.8 21.43 Favored Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.611 179.631 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 743' ' ' PRO . . . . . 0.424 ' HD2' HG22 ' A' ' 742' ' ' THR . 36.6 Cg_endo -66.12 -17.99 55.72 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 123.363 2.709 . . . . 0.0 113.391 -175.782 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -105.41 4.15 30.42 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.691 0.281 . . . . 0.0 110.531 178.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 745' ' ' ASP . . . . . 0.556 ' HB2' ' HB ' ' A' ' 742' ' ' THR . 14.0 m-20 -115.37 156.86 24.77 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.158 -174.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 746' ' ' VAL . . . . . 0.425 HG11 ' HB1' ' A' ' 761' ' ' ALA . 29.4 m -119.97 148.11 23.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.922 -177.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 747' ' ' LEU . . . . . 0.548 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 0.0 OUTLIER -112.76 118.48 35.09 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.627 -0.261 . . . . 0.0 110.367 178.062 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 4.3 mt -104.47 107.24 21.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 173.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 749' ' ' THR . . . . . 0.408 ' OG1' HG22 ' A' ' 753' ' ' VAL . 1.5 t -117.42 163.8 15.83 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.59 0.233 . . . . 0.0 110.851 -175.858 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 750' ' ' ASP . . . . . 0.659 ' HB3' HG13 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -121.02 130.21 53.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.172 0.51 . . . . 0.0 110.902 -179.797 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 67.06 177.93 0.23 Allowed 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 114.656 -1.156 . . . . 0.0 111.297 -175.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 752' ' ' VAL . . . . . . . . . . . . . 69.9 t -80.68 91.82 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.411 0.624 . . . . 0.0 110.939 -176.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 753' ' ' VAL . . . . . 0.408 HG22 ' OG1' ' A' ' 749' ' ' THR . 2.0 t -86.9 -6.62 10.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.421 176.081 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 3.6 m 59.26 39.81 22.15 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.635 179.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.83 133.91 44.6 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.257 -0.428 . . . . 0.0 109.988 176.782 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 756' ' ' LYS . . . . . 0.501 ' HA ' ' HD2' ' A' ' 756' ' ' LYS . 4.9 mmmt -100.8 81.4 2.28 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.138 0.494 . . . . 0.0 110.326 -179.682 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 757' ' ' TRP . . . . . 0.605 ' CZ3' ' HA ' ' A' ' 741' ' ' PRO . 65.7 t-105 -75.96 95.5 3.58 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.378 178.628 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -94.6 59.83 2.51 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.336 0.588 . . . . 0.0 110.025 175.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 759' ' ' GLY . . . . . . . . . . . . . . . -108.07 -127.01 5.55 Favored Glycine 0 N--CA 1.446 -0.647 0 N-CA-C 111.187 -0.765 . . . . 0.0 111.187 176.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 32.0 ttt85 -77.47 -58.83 3.06 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.15 0.5 . . . . 0.0 109.83 175.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 761' ' ' ALA . . . . . 0.425 ' HB1' HG11 ' A' ' 746' ' ' VAL . . . -156.64 152.95 27.78 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.525 -0.762 . . . . 0.0 109.749 179.141 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 762' ' ' VAL . . . . . 0.472 ' HB ' ' HB3' ' A' ' 757' ' ' TRP . 2.1 p -131.82 123.41 51.6 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-O 121.171 0.51 . . . . 0.0 110.421 178.359 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 763' ' ' VAL . . . . . 0.452 HG21 HD23 ' A' ' 795' ' ' LEU . 84.3 t -105.92 115.15 47.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.091 178.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 764' ' ' THR . . . . . 0.476 ' O ' ' HA ' ' A' ' 782' ' ' VAL . 9.2 m -106.99 110.87 23.12 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.175 -178.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 765' ' ' PHE . . . . . 0.447 ' HB2' ' HA ' ' A' ' 750' ' ' ASP . 40.5 m-85 -70.73 152.72 43.51 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 171.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 766' ' ' CYS . . . . . 0.46 ' SG ' ' HB ' ' A' ' 782' ' ' VAL . 0.0 OUTLIER -157.5 133.56 9.49 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 178.32 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 767' ' ' ARG . . . . . 0.408 ' HB2' ' HE ' ' A' ' 767' ' ' ARG . 0.0 OUTLIER -126.1 -8.97 6.51 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.775 177.105 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 768' ' ' ARG . . . . . 0.522 ' HA ' ' HD2' ' A' ' 768' ' ' ARG . 2.3 mmm-85 -122.45 -72.89 0.66 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.013 0.435 . . . . 0.0 110.983 179.441 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -103.29 129.94 50.42 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.222 -0.658 . . . . 0.0 109.222 -178.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -114.65 12.51 8.02 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 CA-C-O 121.645 0.736 . . . . 0.0 111.328 -173.241 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -76.15 41.83 1.58 Allowed Glycine 0 CA--C 1.521 0.411 0 CA-C-N 115.542 -0.753 . . . . 0.0 113.291 -177.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 772' ' ' ILE . . . . . 0.59 HD12 ' HD2' ' A' ' 773' ' ' PRO . 1.1 mm -105.84 145.01 30.04 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 174.514 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 773' ' ' PRO . . . . . 0.59 ' HD2' HD12 ' A' ' 772' ' ' ILE . 54.3 Cg_exo -51.11 107.77 0.19 Allowed 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.165 1.91 . . . . 0.0 111.817 173.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . 0.791 ' HB3' HG12 ' A' ' 782' ' ' VAL . 0.5 OUTLIER -101.99 -155.37 0.52 Allowed 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.255 179.618 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 775' ' ' GLU . . . . . 0.425 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 1.8 mp0 -66.35 10.0 0.14 Allowed 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -179.085 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 776' ' ' LYS . . . . . 0.59 ' HG2' ' HG ' ' A' ' 774' ' ' LEU . 8.9 ptpt -71.03 -18.32 62.58 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 166.272 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -121.06 136.23 25.49 Favored Pre-proline 0 N--CA 1.451 -0.421 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.325 174.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -65.28 111.82 1.91 Allowed 'Trans proline' 0 CA--C 1.529 0.24 0 C-N-CA 122.587 2.191 . . . . 0.0 112.59 -177.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 110.14 -8.66 31.21 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.907 -0.663 . . . . 0.0 112.024 179.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 780' ' ' GLU . . . . . 0.485 ' HG2' ' HB2' ' A' ' 773' ' ' PRO . 0.1 OUTLIER -107.59 134.76 50.12 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 179.954 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 30.4 m95 -135.79 148.73 48.87 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.245 -0.28 . . . . 0.0 110.245 -178.086 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . 0.791 HG12 ' HB3' ' A' ' 774' ' ' LEU . 19.3 m -132.1 165.23 32.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 168.215 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 783' ' ' HIS . . . . . 0.403 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.2 OUTLIER -171.29 134.16 0.88 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.973 0.416 . . . . 0.0 111.502 177.038 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 784' ' ' SER . . . . . 0.445 ' O ' HG13 ' A' ' 785' ' ' VAL . 0.0 OUTLIER -98.81 99.25 10.31 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.515 178.208 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 785' ' ' VAL . . . . . 0.445 HG13 ' O ' ' A' ' 784' ' ' SER . 0.0 OUTLIER -171.39 -179.3 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 C-N-CA 122.796 0.438 . . . . 0.0 110.17 178.816 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -107.95 22.24 16.23 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.696 -0.683 . . . . 0.0 109.92 171.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 787' ' ' ALA . . . . . 0.415 ' HB2' ' HZ ' ' A' ' 765' ' ' PHE . . . 58.98 63.11 3.9 Favored Pre-proline 0 N--CA 1.468 0.43 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.973 -178.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 788' ' ' PRO . . . . . 0.439 ' HD2' ' OE1' ' A' ' 790' ' ' GLU . 24.3 Cg_exo -63.71 -53.46 1.32 Allowed 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.569 2.179 . . . . 0.0 112.844 -178.151 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 8.2 p-80 -172.13 25.71 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 790' ' ' GLU . . . . . 0.439 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -121.9 -46.81 2.2 Favored 'General case' 0 C--N 1.323 -0.578 0 O-C-N 122.034 -0.416 . . . . 0.0 111.091 -179.963 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 791' ' ' LEU . . . . . 0.513 ' HA ' HD22 ' A' ' 791' ' ' LEU . 0.5 OUTLIER -57.85 -54.61 53.59 Favored Pre-proline 0 CA--C 1.537 0.48 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -178.826 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 792' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -60.59 -26.74 83.51 Favored 'Trans proline' 0 C--N 1.355 0.915 0 C-N-CA 121.432 1.421 . . . . 0.0 112.019 178.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -70.43 -43.54 69.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.955 0.407 . . . . 0.0 110.264 177.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 794' ' ' LEU . . . . . 0.525 ' O ' ' HB ' ' A' ' 798' ' ' ILE . 0.1 OUTLIER -61.91 -37.82 86.08 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.332 177.537 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 795' ' ' LEU . . . . . 0.452 HD23 HG21 ' A' ' 763' ' ' VAL . 1.3 mm? -63.04 -49.9 72.78 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.156 0.503 . . . . 0.0 110.816 179.477 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -59.99 -48.33 82.16 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.185 -179.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 797' ' ' ARG . . . . . 0.424 ' HG2' ' HA ' ' A' ' 794' ' ' LEU . 0.3 OUTLIER -71.99 -20.83 61.66 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.667 -178.288 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 798' ' ' ILE . . . . . 0.525 ' HB ' ' O ' ' A' ' 794' ' ' LEU . 0.1 OUTLIER -72.01 -31.19 39.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.959 0.409 . . . . 0.0 110.247 178.442 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -85.37 -56.22 3.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.216 175.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 800' ' ' LEU . . . . . 0.429 HD21 ' HA ' ' A' ' 800' ' ' LEU . 4.8 mt . . . . . 0 N--CA 1.467 0.391 0 O-C-N 123.934 0.771 . . . . 0.0 112.562 178.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 824' ' ' ASP . . . . . 0.41 ' HB3' ' HE1' ' A' ' 849' ' ' TYR . 25.1 t70 . . . . . 0 CA--C 1.517 -0.315 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -106.78 124.57 49.8 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.457 173.092 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 826' ' ' MET . . . . . . . . . . . . . 2.9 ttt -96.64 113.26 24.81 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.456 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 827' ' ' ILE . . . . . 0.488 HG13 HD11 ' A' ' 936' ' ' LEU . 9.4 mm -113.13 134.46 55.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.281 -179.548 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 828' ' ' LEU . . . . . 0.776 HD21 HG12 ' A' ' 869' ' ' ILE . 0.3 OUTLIER -101.06 120.42 40.18 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.897 178.215 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 829' ' ' VAL . . . . . 0.457 HG22 ' O ' ' A' ' 852' ' ' LYS . 0.0 OUTLIER -102.85 95.78 4.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.209 0.528 . . . . 0.0 110.088 178.828 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 830' ' ' VAL . . . . . 0.578 HG12 ' HB2' ' A' ' 854' ' ' ALA . 1.7 t -113.16 109.13 27.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.346 -177.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 831' ' ' ASP . . . . . 0.715 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 18.8 t70 -124.88 159.46 31.07 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 110.22 -0.289 . . . . 0.0 110.22 179.073 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 832' ' ' ASP . . . . . 0.682 ' HB3' ' HB3' ' A' ' 877' ' ' ASN . 35.0 t70 -75.0 -27.55 60.19 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.954 -176.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 6.6 m170 -120.47 111.32 34.96 Favored Pre-proline 0 C--N 1.326 -0.421 0 O-C-N 122.322 -0.236 . . . . 0.0 111.053 -174.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 834' ' ' PRO . . . . . 0.444 ' HA ' ' HD2' ' A' ' 837' ' ' ARG . 87.6 Cg_exo -43.59 -36.89 7.59 Favored 'Trans proline' 0 CA--C 1.532 0.407 0 C-N-CA 123.643 2.895 . . . . 0.0 114.369 -176.052 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 835' ' ' ILE . . . . . 0.502 ' O ' ' HG3' ' A' ' 838' ' ' ARG . 1.1 pp -66.13 -44.46 91.72 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 CA-C-O 120.888 0.375 . . . . 0.0 111.214 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 836' ' ' ASN . . . . . 0.471 HD21 ' CG ' ' A' ' 831' ' ' ASP . 42.5 t30 -72.14 -41.87 66.65 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 177.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 837' ' ' ARG . . . . . 0.715 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 0.1 OUTLIER -53.8 -46.07 70.97 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.733 -1.121 . . . . 0.0 111.437 179.044 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 838' ' ' ARG . . . . . 0.502 ' HG3' ' O ' ' A' ' 835' ' ' ILE . 0.0 OUTLIER -72.76 -29.05 63.0 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 121.0 -0.28 . . . . 0.0 110.88 179.265 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.34 -47.11 83.53 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.645 -0.252 . . . . 0.0 111.371 -178.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 840' ' ' LEU . . . . . 0.474 ' H ' ' HG ' ' A' ' 840' ' ' LEU . 0.0 OUTLIER -71.35 -32.72 68.86 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.952 0.406 . . . . 0.0 110.254 178.188 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -63.64 -33.98 76.83 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.327 0.584 . . . . 0.0 110.39 177.047 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -65.53 -44.63 86.33 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.396 177.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 843' ' ' GLN . . . . . 0.47 ' HG3' HD22 ' A' ' 929' ' ' LEU . 1.2 mp0 -64.75 -41.69 95.73 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.542 179.012 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 844' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.66 -31.82 72.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.419 175.587 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -61.8 -43.12 99.65 Favored Glycine 0 N--CA 1.451 -0.329 0 CA-C-N 115.771 -0.649 . . . . 0.0 112.301 176.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -31.48 72.7 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.849 0.356 . . . . 0.0 110.626 176.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 14.8 mt -66.77 -32.65 74.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.63 177.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 87.65 27.55 26.67 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.639 177.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 849' ' ' TYR . . . . . 0.462 ' HD1' ' HA ' ' A' ' 849' ' ' TYR . 0.1 OUTLIER -114.45 167.11 11.0 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 122.804 -0.233 . . . . 0.0 110.674 -179.261 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -71.01 118.64 14.05 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.481 -175.852 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -123.54 107.82 11.96 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.456 179.287 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 852' ' ' LYS . . . . . 0.457 ' O ' HG22 ' A' ' 829' ' ' VAL . 0.0 OUTLIER -96.58 119.4 35.0 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 177.048 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.13 110.19 21.22 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.074 0.464 . . . . 0.0 111.709 -171.201 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 854' ' ' ALA . . . . . 0.578 ' HB2' HG12 ' A' ' 830' ' ' VAL . . . -121.78 155.93 34.26 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.897 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -137.23 79.07 1.73 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.341 -177.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 856' ' ' ASP . . . . . 0.483 ' CG ' ' H ' ' A' ' 857' ' ' GLY . 7.5 t70 -175.61 -166.92 0.22 Allowed 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.1 177.074 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 857' ' ' GLY . . . . . 0.483 ' H ' ' CG ' ' A' ' 856' ' ' ASP . . . -124.14 -53.61 0.19 Allowed Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 121.226 -0.511 . . . . 0.0 111.907 178.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -71.7 -31.02 40.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.899 0.381 . . . . 0.0 110.757 -177.346 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.76 -19.91 65.16 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.973 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 860' ' ' ALA . . . . . 0.461 ' O ' ' HG ' ' A' ' 864' ' ' LEU . . . -64.73 -51.06 64.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.753 0.311 . . . . 0.0 110.203 176.077 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 861' ' ' LEU . . . . . 0.916 HD23 HG13 ' A' ' 890' ' ' ILE . 1.4 tm? -58.87 -39.78 82.4 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.375 0.607 . . . . 0.0 109.636 175.275 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 28.7 t30 -55.02 -42.31 72.45 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.027 177.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 863' ' ' VAL . . . . . 0.478 HG13 ' HG ' ' A' ' 828' ' ' LEU . 0.4 OUTLIER -71.16 -32.34 47.36 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.71 -177.497 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 864' ' ' LEU . . . . . 0.796 HD13 HD21 ' A' ' 897' ' ' LEU . 4.4 mt -68.02 -37.59 81.57 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.409 0.623 . . . . 0.0 110.5 178.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 1.4 m -78.92 -16.14 57.39 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.317 179.254 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 1.4 mtmm -81.53 -57.49 3.44 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.514 177.169 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -139.53 151.32 46.03 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.448 -178.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 80.3 t60 -78.24 105.52 9.53 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.286 0.565 . . . . 0.0 111.156 -177.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 869' ' ' ILE . . . . . 0.776 HG12 HD21 ' A' ' 828' ' ' LEU . 1.5 mp -93.86 146.24 6.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 171.846 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -84.06 -52.34 6.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.817 0.341 . . . . 0.0 110.884 -175.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 871' ' ' ILE . . . . . 0.474 ' HA ' HD13 ' A' ' 871' ' ' ILE . 12.9 mm -124.59 122.46 63.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.14 -179.237 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 872' ' ' VAL . . . . . 0.629 ' HB ' HG13 ' A' ' 899' ' ' VAL . 2.5 t -103.54 124.94 58.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.863 178.147 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 873' ' ' LEU . . . . . . . . . . . . . 67.7 mt -107.25 110.29 22.29 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 176.186 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -113.62 99.7 7.93 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.679 -179.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 875' ' ' ASP . . . . . 0.46 ' CG ' ' HZ2' ' A' ' 925' ' ' LYS . 47.2 t0 -97.48 113.26 24.91 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.219 -178.736 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -103.86 103.53 15.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.868 -178.004 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 877' ' ' ASN . . . . . 0.682 ' HB3' ' HB3' ' A' ' 832' ' ' ASP . 0.4 OUTLIER -65.45 -42.6 92.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.623 178.129 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 878' ' ' MET . . . . . 0.4 ' HE1' ' HB3' ' A' ' 878' ' ' MET . 10.1 ttp . . . . . 0 C--N 1.327 -0.409 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.942 -177.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.652 0 N-CA-C 111.504 -0.639 . . . . 0.0 111.504 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.63 -33.21 75.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.208 0.527 . . . . 0.0 109.754 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 885' ' ' ARG . . . . . 0.448 ' H ' ' HG3' ' A' ' 885' ' ' ARG . 0.6 OUTLIER -72.56 -31.33 65.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.528 176.919 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.59 -51.05 62.67 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.808 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 887' ' ' THR . . . . . 0.561 ' O ' HG22 ' A' ' 890' ' ' ILE . 44.4 m -63.52 -41.48 98.48 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.037 0.446 . . . . 0.0 111.007 178.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 888' ' ' GLN . . . . . 0.457 ' O ' ' HB2' ' A' ' 892' ' ' GLN . 1.5 tp60 -63.2 -41.7 99.2 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.765 178.757 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.09 -43.39 87.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.264 -178.227 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 890' ' ' ILE . . . . . 0.916 HG13 HD23 ' A' ' 861' ' ' LEU . 13.0 tt -66.37 -41.1 88.28 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.502 -176.753 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 891' ' ' ARG . . . . . 0.431 ' HG3' ' N ' ' A' ' 892' ' ' GLN . 0.2 OUTLIER -75.4 -29.09 59.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.541 0.21 . . . . 0.0 111.153 179.413 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 892' ' ' GLN . . . . . 0.457 ' HB2' ' O ' ' A' ' 888' ' ' GLN . 1.2 tp60 -73.31 -50.36 22.53 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 120.83 0.348 . . . . 0.0 111.389 -177.545 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.12 -38.16 78.73 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.725 -177.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 121.95 82.39 0.64 Allowed Glycine 0 N--CA 1.445 -0.752 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.656 177.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 895' ' ' LEU . . . . . 0.556 ' HG ' ' O ' ' A' ' 895' ' ' LEU . 0.1 OUTLIER -59.73 130.85 48.84 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 175.793 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -117.96 13.27 13.94 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.57 0.582 . . . . 0.0 112.57 -171.547 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 897' ' ' LEU . . . . . 0.796 HD21 HD13 ' A' ' 864' ' ' LEU . 0.0 OUTLIER -157.31 166.52 16.44 Favored Pre-proline 0 C--N 1.321 -0.645 0 CA-C-N 116.616 -0.266 . . . . 0.0 111.331 -174.38 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_exo -71.06 108.55 2.35 Favored 'Trans proline' 0 C--O 1.239 0.545 0 C-N-CA 122.492 2.128 . . . . 0.0 111.622 173.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 899' ' ' VAL . . . . . 0.629 HG13 ' HB ' ' A' ' 872' ' ' VAL . 2.4 t -97.54 121.32 47.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.868 176.539 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 900' ' ' ILE . . . . . . . . . . . . . 2.7 mp -103.48 106.27 19.87 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-O 121.242 0.544 . . . . 0.0 109.987 178.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -94.61 97.73 2.2 Favored Glycine 0 N--CA 1.443 -0.897 0 CA-C-N 115.458 -0.792 . . . . 0.0 112.203 -178.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 902' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -79.86 123.77 37.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 175.098 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -118.68 143.73 46.66 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.015 0.436 . . . . 0.0 111.094 -174.111 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 904' ' ' ALA . . . . . 0.546 ' HA ' ' HB2' ' A' ' 925' ' ' LYS . . . -82.22 119.23 23.82 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.198 178.7 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 62.8 56.68 1.87 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.985 174.412 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 906' ' ' ALA . . . . . 0.445 ' HB1' ' HG3' ' A' ' 909' ' ' GLU . . . -107.46 -39.08 5.75 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.232 174.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 72.48 -65.68 0.34 Allowed 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.797 177.673 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -82.86 53.93 2.56 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.077 0.465 . . . . 0.0 109.791 176.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 909' ' ' GLU . . . . . 0.529 ' O ' ' HB2' ' A' ' 922' ' ' CYS . 3.4 mp0 -62.63 -35.24 78.95 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.928 -177.667 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 910' ' ' GLU . . . . . 0.51 ' H ' ' HG3' ' A' ' 910' ' ' GLU . 0.0 OUTLIER -62.62 -45.29 93.53 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.421 0.629 . . . . 0.0 110.194 176.289 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 911' ' ' LYS . . . . . 0.511 ' HE2' HD13 ' A' ' 915' ' ' LEU . 1.1 tttt -63.69 -37.21 86.49 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.489 177.326 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 18.6 tt0 -60.57 -42.58 96.95 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.471 177.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.88 -40.34 76.03 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.563 178.542 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 3.9 m -75.58 -31.16 59.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.037 179.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 915' ' ' LEU . . . . . 0.511 HD13 ' HE2' ' A' ' 911' ' ' LYS . 0.2 OUTLIER -70.73 -52.73 18.98 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.664 -175.767 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 916' ' ' GLU . . . . . 0.476 ' HB2' HG22 ' A' ' 887' ' ' THR . 0.2 OUTLIER -79.23 -44.68 21.33 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.457 -177.341 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 67.4 m 50.72 45.4 27.12 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 123.257 0.348 . . . . 0.0 111.852 -176.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -122.23 -33.56 0.89 Allowed Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.561 -0.828 . . . . 0.0 112.133 -179.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 919' ' ' MET . . . . . 0.739 ' HE1' HG21 ' A' ' 890' ' ' ILE . 5.4 mmt -90.9 -71.82 0.61 Allowed 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 176.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 920' ' ' ASP . . . . . 0.433 ' HB2' ' O ' ' A' ' 919' ' ' MET . 13.6 t70 158.59 -67.34 0.0 OUTLIER 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 114.399 -1.273 . . . . 0.0 108.959 175.135 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -118.9 167.71 11.46 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.26 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 922' ' ' CYS . . . . . 0.529 ' HB2' ' O ' ' A' ' 909' ' ' GLU . 85.0 m -143.47 133.71 24.51 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.225 -0.443 . . . . 0.0 109.985 177.221 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 923' ' ' LEU . . . . . 0.441 HD11 HG21 ' A' ' 935' ' ' THR . 56.0 mt -120.93 169.4 10.5 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.9 -178.788 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 924' ' ' SER . . . . . 0.415 ' O ' HG21 ' A' ' 927' ' ' VAL . 0.7 OUTLIER -84.66 150.4 25.17 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.4 177.066 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 925' ' ' LYS . . . . . 0.546 ' HB2' ' HA ' ' A' ' 904' ' ' ALA . 0.0 OUTLIER -58.38 -40.82 85.69 Favored Pre-proline 0 CA--C 1.541 0.621 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -179.432 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -64.8 73.83 0.22 Allowed 'Trans proline' 0 C--N 1.357 0.999 0 C-N-CA 122.102 1.868 . . . . 0.0 112.757 173.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 927' ' ' VAL . . . . . 0.415 HG21 ' O ' ' A' ' 924' ' ' SER . 8.9 t -100.94 114.54 40.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 121.12 0.486 . . . . 0.0 109.828 174.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.53 177.46 7.74 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.251 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 929' ' ' LEU . . . . . 0.509 HD21 ' HA ' ' A' ' 929' ' ' LEU . 1.6 tm? -57.82 -45.45 86.15 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.804 0.335 . . . . 0.0 110.401 177.723 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 930' ' ' ASP . . . . . 0.44 ' O ' ' HG2' ' A' ' 934' ' ' GLN . 3.4 t0 -66.5 -40.65 89.37 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.665 -178.452 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 50.8 t -64.7 -47.9 86.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.868 -179.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 932' ' ' ILE . . . . . 0.503 HG22 ' N ' ' A' ' 933' ' ' LYS . 0.0 OUTLIER -64.95 -31.97 56.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.936 0.398 . . . . 0.0 110.09 178.673 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 933' ' ' LYS . . . . . 0.503 ' N ' HG22 ' A' ' 932' ' ' ILE . 4.8 ttmt -65.74 -48.31 72.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.242 177.36 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 934' ' ' GLN . . . . . 0.453 ' O ' ' HB3' ' A' ' 938' ' ' LEU . 56.5 mm-40 -60.54 -48.77 80.29 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.447 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 935' ' ' THR . . . . . 0.441 HG21 HD11 ' A' ' 923' ' ' LEU . 13.4 m -59.62 -51.85 68.06 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.371 -178.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 936' ' ' LEU . . . . . 0.488 HD11 HG13 ' A' ' 827' ' ' ILE . 0.3 OUTLIER -63.65 -47.19 82.28 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.208 -177.76 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 32.3 m -63.53 -50.29 70.15 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -178.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 938' ' ' LEU . . . . . 0.453 ' HB3' ' O ' ' A' ' 934' ' ' GLN . 0.0 OUTLIER -66.32 -36.33 82.66 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.466 -0.333 . . . . 0.0 111.232 -175.832 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -76.03 -37.66 58.11 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.843 -0.343 . . . . 0.0 111.03 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -65.07 -37.77 88.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.947 0.403 . . . . 0.0 110.713 178.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 941' ' ' GLU . . . . . 0.623 ' O ' ' HG2' ' A' ' 945' ' ' LYS . 2.2 pt-20 -75.76 -29.01 58.69 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.678 -0.409 . . . . 0.0 110.52 177.385 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 942' ' ' ARG . . . . . . . . . . . . . 1.4 tpt85 -66.59 -47.49 72.56 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.567 179.09 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 27.9 m -67.24 -29.16 44.96 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 121.283 0.563 . . . . 0.0 109.861 176.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.91 -24.93 66.15 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.804 175.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 945' ' ' LYS . . . . . 0.623 ' HG2' ' O ' ' A' ' 941' ' ' GLU . 9.6 mmtt -73.87 -43.63 58.0 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 120.855 0.36 . . . . 0.0 110.183 176.821 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.32 -30.89 71.92 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.743 177.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.39 -19.31 46.6 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.248 174.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 29.6 t70 . . . . . 0 C--N 1.33 -0.267 0 CA-C-N 114.957 -1.02 . . . . 0.0 111.538 177.914 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 3.3 m . . . . . 0 N--CA 1.454 -0.245 0 CA-C-O 120.908 0.385 . . . . 0.0 111.368 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 106.75 -12.71 42.18 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.76 175.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -75.48 132.0 40.49 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 174.618 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 708' ' ' ARG . . . . . 0.715 ' HG3' ' HB ' ' A' ' 732' ' ' VAL . 2.8 ttt180 -97.3 152.78 18.55 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.19 0.519 . . . . 0.0 111.445 -171.586 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 709' ' ' CYS . . . . . 0.483 ' SG ' HD13 ' A' ' 726' ' ' LEU . 0.0 OUTLIER -130.18 117.84 20.51 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.947 176.502 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 710' ' ' TRP . . . . . . . . . . . . . 47.2 m95 -94.82 120.19 34.65 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.56 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 711' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -122.36 132.38 54.35 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.393 0.616 . . . . 0.0 111.199 -177.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -125.76 70.4 1.2 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.422 176.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 60.8 t -128.15 120.58 53.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.114 -0.948 . . . . 0.0 109.952 -176.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 714' ' ' ARG . . . . . 0.568 ' HD2' ' OD2' ' A' ' 750' ' ' ASP . 0.3 OUTLIER -91.94 -8.99 44.71 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.385 -175.734 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -83.23 113.65 20.82 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 176.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -58.0 -43.95 86.93 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.49 -173.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.34 -45.66 86.89 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.009 0.433 . . . . 0.0 110.331 -179.171 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 718' ' ' LEU . . . . . 0.71 ' HG ' ' HB2' ' A' ' 787' ' ' ALA . 0.3 OUTLIER -67.15 -50.55 60.8 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.235 -179.396 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 719' ' ' CYS . . . . . . . . . . . . . 13.9 p -67.13 -44.9 78.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.221 -174.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 720' ' ' GLN . . . . . 0.631 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 0.3 OUTLIER -65.51 -37.87 88.04 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 121.002 -0.279 . . . . 0.0 111.173 -177.016 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 39.2 t80 -60.59 -48.16 83.02 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 121.013 -0.275 . . . . 0.0 110.692 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 722' ' ' LEU . . . . . 0.455 HD12 HD23 ' A' ' 718' ' ' LEU . 15.9 mt -66.16 -48.78 69.62 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.628 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 723' ' ' GLU . . . . . 0.729 ' HB2' HG12 ' A' ' 733' ' ' VAL . 8.7 pt-20 -61.88 -37.49 84.75 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.721 -175.181 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 724' ' ' THR . . . . . 0.515 ' HA ' ' HG2' ' A' ' 727' ' ' GLN . 26.2 m -68.96 -38.23 79.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.92 0.391 . . . . 0.0 110.797 179.226 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 24.3 m -70.71 -28.41 64.71 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.11 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 726' ' ' LEU . . . . . 0.483 HD13 ' SG ' ' A' ' 709' ' ' CYS . 18.3 mt -80.14 -44.21 20.3 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.98 0.419 . . . . 0.0 110.747 179.142 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 727' ' ' GLN . . . . . 0.515 ' HG2' ' HA ' ' A' ' 724' ' ' THR . 12.2 pt20 -72.03 -7.89 51.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.957 0.408 . . . . 0.0 110.705 178.183 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.74 -29.06 70.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.922 178.104 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 2.1 p -104.66 -88.55 0.43 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.065 0.459 . . . . 0.0 110.553 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 730' ' ' GLY . . . . . . . . . . . . . . . -158.05 19.68 0.35 Allowed Glycine 0 N--CA 1.445 -0.751 0 N-CA-C 111.343 -0.703 . . . . 0.0 111.343 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 731' ' ' ILE . . . . . . . . . . . . . 35.0 mm -79.35 128.09 38.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 120.886 0.374 . . . . 0.0 110.601 -179.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 732' ' ' VAL . . . . . 0.715 ' HB ' ' HG3' ' A' ' 708' ' ' ARG . 0.1 OUTLIER -79.15 89.26 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.554 -179.525 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 733' ' ' VAL . . . . . 0.729 HG12 ' HB2' ' A' ' 723' ' ' GLU . 94.7 t -66.09 114.43 3.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.015 176.416 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 734' ' ' THR . . . . . 0.549 HG22 HH21 ' A' ' 708' ' ' ARG . 0.7 OUTLIER -130.13 133.41 46.62 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.15 0.5 . . . . 0.0 110.862 -178.703 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.8 124.15 20.74 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.926 178.532 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -85.09 96.29 9.39 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.296 0.57 . . . . 0.0 110.556 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -107.95 -10.81 15.45 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.299 178.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 148.27 57.1 0.01 OUTLIER Glycine 0 CA--C 1.51 -0.25 0 N-CA-C 111.199 -0.76 . . . . 0.0 111.199 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 17.2 mp0 -106.81 173.99 6.08 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.953 0.406 . . . . 0.0 111.59 -173.069 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 740' ' ' GLU . . . . . 0.417 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 6.2 mm-40 -75.38 141.52 73.6 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.557 -177.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 741' ' ' PRO . . . . . 0.631 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 1.9 Cg_endo -84.72 123.52 2.88 Favored 'Trans proline' 0 N--CA 1.455 -0.744 0 C-N-CA 123.108 2.539 . . . . 0.0 112.415 176.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 742' ' ' THR . . . . . 0.464 HG23 ' HD2' ' A' ' 743' ' ' PRO . 0.0 OUTLIER -111.95 138.26 21.62 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.468 177.564 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 743' ' ' PRO . . . . . 0.464 ' HD2' HG23 ' A' ' 742' ' ' THR . 40.5 Cg_endo -67.12 -6.65 16.63 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 123.166 2.578 . . . . 0.0 113.916 -175.236 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -109.13 1.12 20.16 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.8 0.333 . . . . 0.0 110.895 178.044 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 82.7 m-20 -117.01 157.51 25.69 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-N 116.279 -0.419 . . . . 0.0 109.979 -175.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 746' ' ' VAL . . . . . 0.436 HG21 HD11 ' A' ' 795' ' ' LEU . 0.8 OUTLIER -123.6 149.08 27.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 120.915 0.388 . . . . 0.0 111.156 -177.809 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 747' ' ' LEU . . . . . 0.413 ' HB2' ' CE2' ' A' ' 757' ' ' TRP . 0.0 OUTLIER -105.82 112.56 25.68 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.877 176.191 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 17.9 mt -98.88 114.19 35.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 176.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 34.8 p -115.01 148.99 38.14 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.685 0.279 . . . . 0.0 111.253 -174.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 750' ' ' ASP . . . . . 0.568 ' OD2' ' HD2' ' A' ' 714' ' ' ARG . 0.0 OUTLIER -98.82 123.28 42.97 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 171.303 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 751' ' ' GLU . . . . . 0.455 ' HB3' ' H ' ' A' ' 752' ' ' VAL . 10.2 mm-40 57.89 -156.48 0.32 Allowed 'General case' 0 C--O 1.236 0.361 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.356 -175.419 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 752' ' ' VAL . . . . . 0.945 HG11 ' HA3' ' A' ' 771' ' ' GLY . 4.9 t -87.55 141.06 14.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 121.103 0.478 . . . . 0.0 111.422 -174.251 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 15.6 m -125.29 160.54 30.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.908 177.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -84.66 56.56 3.92 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.948 0.404 . . . . 0.0 110.9 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.72 176.3 12.14 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.415 179.304 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.53 -39.24 2.03 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.411 -179.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 757' ' ' TRP . . . . . 0.631 ' CH2' ' HA ' ' A' ' 741' ' ' PRO . 76.0 t-105 70.46 158.88 0.19 Allowed 'General case' 0 CA--C 1.537 0.462 0 O-C-N 123.702 0.626 . . . . 0.0 111.576 177.701 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -134.15 -85.45 0.42 Allowed 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 172.175 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 759' ' ' GLY . . . . . . . . . . . . . . . 50.25 -136.44 26.03 Favored Glycine 0 C--N 1.334 0.452 0 CA-C-N 116.394 -0.366 . . . . 0.0 112.946 176.289 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 30.7 ttm-85 -85.29 -50.58 7.23 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.241 0.543 . . . . 0.0 109.587 172.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -166.54 158.85 13.8 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.028 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 762' ' ' VAL . . . . . 0.484 ' HB ' ' CD1' ' A' ' 757' ' ' TRP . 2.4 p -120.41 128.09 75.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 174.334 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 763' ' ' VAL . . . . . 0.648 HG11 HD21 ' A' ' 791' ' ' LEU . 11.9 t -112.06 104.71 17.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 121.085 0.469 . . . . 0.0 110.273 -178.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 764' ' ' THR . . . . . . . . . . . . . 36.7 m -98.38 125.25 43.45 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.043 -179.088 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 765' ' ' PHE . . . . . 0.418 ' CE2' HG21 ' A' ' 785' ' ' VAL . 14.8 m-85 -83.12 112.99 20.32 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.661 175.275 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -95.1 133.03 39.36 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.161 -178.172 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 767' ' ' ARG . . . . . 0.469 ' HA ' ' HD2' ' A' ' 767' ' ' ARG . 13.6 mmm-85 -118.55 -48.37 2.5 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.731 0.301 . . . . 0.0 110.233 178.153 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.41 -19.13 1.25 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.941 -178.04 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -138.09 144.3 40.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.921 0.391 . . . . 0.0 111.013 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 16.2 mt -124.25 87.59 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.573 -178.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 771' ' ' GLY . . . . . 0.945 ' HA3' HG11 ' A' ' 752' ' ' VAL . . . -85.7 -33.88 14.93 Favored Glycine 0 N--CA 1.45 -0.378 0 N-CA-C 111.207 -0.757 . . . . 0.0 111.207 175.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 772' ' ' ILE . . . . . 0.45 ' HA ' ' HD3' ' A' ' 773' ' ' PRO . 0.9 OUTLIER -98.5 116.17 65.54 Favored Pre-proline 0 C--N 1.322 -0.596 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 173.118 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 773' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 772' ' ' ILE . 6.0 Cg_exo -77.51 -177.98 4.25 Favored 'Trans proline' 0 N--CA 1.461 -0.439 0 C-N-CA 123.101 2.534 . . . . 0.0 113.41 -174.432 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . 0.448 ' O ' ' HB3' ' A' ' 780' ' ' GLU . 1.7 pt? -88.06 -161.2 0.7 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.464 179.374 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 775' ' ' GLU . . . . . 0.5 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 9.8 mp0 -65.37 62.95 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 113.632 0.975 . . . . 0.0 113.632 -176.897 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 776' ' ' LYS . . . . . 0.421 ' HD3' ' CB ' ' A' ' 773' ' ' PRO . 0.1 OUTLIER -108.42 0.85 21.3 Favored 'General case' 0 C--N 1.309 -1.171 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 168.963 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -132.17 164.55 42.41 Favored Pre-proline 0 N--CA 1.447 -0.601 0 CA-C-N 113.833 -1.53 . . . . 0.0 108.435 177.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_endo -55.91 -17.96 20.59 Favored 'Trans proline' 0 CA--C 1.534 0.476 0 C-N-CA 123.087 2.525 . . . . 0.0 114.577 -173.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . -158.54 34.57 0.5 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 119.71 -1.234 . . . . 0.0 113.397 -177.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 780' ' ' GLU . . . . . 0.5 ' O ' ' HG3' ' A' ' 775' ' ' GLU . 0.1 OUTLIER -97.99 122.66 41.38 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.95 0.375 . . . . 0.0 110.043 178.622 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 16.4 m95 -131.46 146.71 52.37 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.521 -178.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 4.8 m -139.18 153.89 24.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.553 176.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 783' ' ' HIS . . . . . 0.4 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.9 OUTLIER -155.66 127.5 7.46 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.979 0.419 . . . . 0.0 110.688 173.056 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -95.0 99.93 11.86 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.633 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 785' ' ' VAL . . . . . 0.435 ' HB ' ' HD3' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -166.96 -173.57 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.931 179.629 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -124.39 48.19 1.98 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.904 0.383 . . . . 0.0 110.658 175.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 787' ' ' ALA . . . . . 0.71 ' HB2' ' HG ' ' A' ' 718' ' ' LEU . . . 54.05 66.17 4.63 Favored Pre-proline 0 N--CA 1.467 0.386 0 CA-C-N 115.248 -0.887 . . . . 0.0 112.547 178.547 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 788' ' ' PRO . . . . . 0.761 ' HD2' ' OE1' ' A' ' 790' ' ' GLU . 17.0 Cg_exo -68.75 -61.75 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.655 2.236 . . . . 0.0 111.673 175.653 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 789' ' ' HIS . . . . . 0.491 ' HB3' ' O ' ' A' ' 788' ' ' PRO . 0.1 OUTLIER 175.79 10.47 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 O-C-N 123.32 0.388 . . . . 0.0 111.881 178.235 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 790' ' ' GLU . . . . . 0.761 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -93.77 -41.95 9.4 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.812 0.339 . . . . 0.0 110.6 -175.724 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 791' ' ' LEU . . . . . 0.648 HD21 HG11 ' A' ' 763' ' ' VAL . 0.2 OUTLIER -62.86 -49.17 83.29 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.667 -179.976 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 792' ' ' PRO . . . . . 0.522 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 10.7 Cg_endo -56.12 -30.94 81.35 Favored 'Trans proline' 0 C--N 1.354 0.864 0 C-N-CA 121.8 1.667 . . . . 0.0 112.042 175.402 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -72.91 -44.72 60.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.772 178.097 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 794' ' ' LEU . . . . . 0.408 ' HA ' HD22 ' A' ' 794' ' ' LEU . 2.1 tm? -61.68 -38.18 86.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.181 177.05 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 795' ' ' LEU . . . . . 0.436 HD11 HG21 ' A' ' 746' ' ' VAL . 0.4 OUTLIER -66.68 -42.65 86.19 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.886 -179.774 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -63.85 -38.34 90.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.117 0.484 . . . . 0.0 110.481 176.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.17 -44.6 87.98 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.74 178.239 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -69.05 -22.15 25.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.525 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.741 -176.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -85.3 0.35 52.29 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.03 0.443 . . . . 0.0 110.126 176.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 6.6 mt . . . . . 0 N--CA 1.462 0.14 0 CA-C-N 114.847 -1.069 . . . . 0.0 112.521 171.861 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 32.5 t70 . . . . . 0 C--O 1.232 0.152 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -116.68 120.36 38.37 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.834 178.27 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 826' ' ' MET . . . . . 0.481 ' O ' HG23 ' A' ' 869' ' ' ILE . 18.9 ttm -95.13 118.58 32.17 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.349 0.595 . . . . 0.0 112.193 -172.163 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 827' ' ' ILE . . . . . 0.753 HD11 ' HB ' ' A' ' 871' ' ' ILE . 2.5 mm -115.9 135.82 54.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.779 177.404 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 828' ' ' LEU . . . . . 0.43 HD21 HG12 ' A' ' 872' ' ' VAL . 2.7 tp -117.28 128.99 55.61 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.111 0.481 . . . . 0.0 111.094 -177.698 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 829' ' ' VAL . . . . . 0.81 HG11 HD12 ' A' ' 873' ' ' LEU . 0.0 OUTLIER -110.1 110.38 31.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.269 179.511 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 830' ' ' VAL . . . . . 0.746 HG11 ' HB3' ' A' ' 854' ' ' ALA . 0.0 OUTLIER -113.07 101.63 12.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.594 -179.261 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 831' ' ' ASP . . . . . 0.684 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 5.7 t70 -104.76 157.18 17.38 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 110.089 -0.337 . . . . 0.0 110.089 178.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -90.06 -21.42 22.33 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.053 177.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 25.7 m170 -111.79 123.04 35.57 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.592 -178.42 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_exo -52.25 -44.72 44.3 Favored 'Trans proline' 0 C--O 1.237 0.446 0 C-N-CA 123.666 2.911 . . . . 0.0 114.191 -173.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -71.87 -40.14 68.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.637 0.256 . . . . 0.0 111.082 -176.119 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 836' ' ' ASN . . . . . 0.426 ' ND2' HD21 ' A' ' 840' ' ' LEU . 5.1 t30 -68.31 -37.04 80.21 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 178.134 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 837' ' ' ARG . . . . . 0.684 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 4.3 ttp85 -54.12 -44.09 71.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.736 176.2 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 838' ' ' ARG . . . . . 0.455 ' HD2' ' O ' ' A' ' 838' ' ' ARG . 0.0 OUTLIER -65.26 -37.66 87.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.217 178.676 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 839' ' ' LEU . . . . . 0.436 ' HG ' ' NE2' ' A' ' 843' ' ' GLN . 9.2 tp -61.1 -49.8 75.84 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.645 -176.588 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 840' ' ' LEU . . . . . 0.51 ' H ' ' HG ' ' A' ' 840' ' ' LEU . 0.0 OUTLIER -70.32 -35.57 73.73 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.778 179.564 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -62.79 -39.51 94.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.109 0.48 . . . . 0.0 110.772 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -70.23 -42.62 72.0 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.562 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 843' ' ' GLN . . . . . 0.473 ' HG2' ' CD1' ' A' ' 929' ' ' LEU . 20.8 mt-30 -55.98 -49.51 73.4 Favored 'General case' 0 C--O 1.23 0.078 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.363 176.321 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 844' ' ' LEU . . . . . 0.555 HD23 ' HB ' ' A' ' 827' ' ' ILE . 0.2 OUTLIER -59.65 -40.38 87.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.018 178.329 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -68.07 -24.05 74.56 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 121.069 -0.586 . . . . 0.0 112.502 179.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 5.4 m -86.31 -25.94 25.18 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.911 0.386 . . . . 0.0 110.591 178.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 847' ' ' LEU . . . . . 0.516 HD21 ' HA ' ' A' ' 933' ' ' LYS . 0.2 OUTLIER -67.54 -31.76 72.07 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.87 179.209 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 96.76 52.04 1.58 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.473 178.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 54.0 m-85 -133.65 174.56 10.31 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 178.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.4 107.89 13.57 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 175.477 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 851' ' ' CYS . . . . . 0.546 ' HB3' HD22 ' A' ' 844' ' ' LEU . 0.0 OUTLIER -97.57 129.85 44.67 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.618 -174.268 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 852' ' ' LYS . . . . . 0.45 ' HE2' ' SD ' ' A' ' 826' ' ' MET . 1.5 mptt -125.11 122.7 37.9 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 171.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 853' ' ' THR . . . . . 0.672 HG21 HG23 ' A' ' 829' ' ' VAL . 0.2 OUTLIER -110.6 144.28 39.72 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.911 0.386 . . . . 0.0 111.905 -175.083 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 854' ' ' ALA . . . . . 0.746 ' HB3' HG11 ' A' ' 830' ' ' VAL . . . -148.51 151.25 34.81 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.705 174.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 855' ' ' ASN . . . . . 0.474 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 1.1 t30 -130.69 74.56 1.6 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.318 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 856' ' ' ASP . . . . . 0.583 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 24.2 t0 171.26 146.65 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.34 0 O-C-N 123.595 0.559 . . . . 0.0 110.467 -178.554 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -75.3 -35.16 49.14 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.622 -0.799 . . . . 0.0 111.278 175.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 858' ' ' VAL . . . . . 0.403 ' H ' HG23 ' A' ' 858' ' ' VAL . 0.6 OUTLIER -68.65 -34.58 65.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 120.95 0.405 . . . . 0.0 110.415 178.077 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 859' ' ' ASP . . . . . 0.583 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 1.2 t70 -71.1 -30.11 66.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.455 179.36 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -64.5 -39.15 93.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.337 176.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 861' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.79 -40.23 83.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.181 175.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -59.53 -52.95 63.38 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.952 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 7.6 p -65.06 -31.36 53.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.04 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 864' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.48 -32.9 74.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.905 0.383 . . . . 0.0 111.319 179.167 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 865' ' ' SER . . . . . 0.421 ' HB3' HD12 ' A' ' 893' ' ' LEU . 0.1 OUTLIER -88.59 -16.83 31.49 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.924 0.392 . . . . 0.0 111.04 -178.198 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.03 -27.81 15.43 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.794 -177.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -146.02 158.2 43.87 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.691 0.281 . . . . 0.0 110.811 -175.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -90.31 -28.27 18.87 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 176.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 869' ' ' ILE . . . . . 0.481 HG23 ' O ' ' A' ' 826' ' ' MET . 2.3 mt 56.93 -136.52 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.528 0.135 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 -177.537 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 870' ' ' ASP . . . . . 0.453 ' H ' HG23 ' A' ' 869' ' ' ILE . 0.3 OUTLIER -157.95 -52.42 0.07 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.11 0.481 . . . . 0.0 109.824 169.309 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 871' ' ' ILE . . . . . 0.753 ' HB ' HD11 ' A' ' 827' ' ' ILE . 7.4 mm -122.4 124.0 69.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.726 179.418 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 872' ' ' VAL . . . . . 0.496 ' O ' ' HA ' ' A' ' 899' ' ' VAL . 38.4 t -118.27 129.28 74.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.316 178.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 873' ' ' LEU . . . . . 0.81 HD12 HG11 ' A' ' 829' ' ' VAL . 0.7 OUTLIER -131.76 135.23 46.64 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 177.152 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 874' ' ' SER . . . . . 0.487 ' HA ' ' O ' ' A' ' 830' ' ' VAL . 0.9 OUTLIER -123.69 126.63 46.89 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.686 -177.459 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 875' ' ' ASP . . . . . 0.505 ' CG ' ' HZ2' ' A' ' 925' ' ' LYS . 40.5 t0 -111.21 120.14 41.28 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.41 -178.291 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 4.1 t -121.39 131.93 71.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.031 -176.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 877' ' ' ASN . . . . . 0.438 ' HB2' ' HE2' ' A' ' 925' ' ' LYS . 1.8 t-20 -121.96 53.02 1.23 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.073 0.464 . . . . 0.0 110.863 179.049 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.323 -0.569 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.13 179.232 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.723 0 N-CA-C 110.397 -1.081 . . . . 0.0 110.397 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.2 -28.28 68.64 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 176.626 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 885' ' ' ARG . . . . . 0.474 ' O ' ' HB2' ' A' ' 889' ' ' ARG . 0.0 OUTLIER -63.82 -31.11 72.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.285 173.939 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 886' ' ' LEU . . . . . 0.436 ' O ' ' HB ' ' A' ' 890' ' ' ILE . 0.0 OUTLIER -68.32 -45.58 72.58 Favored 'General case' 0 C--O 1.226 -0.172 0 CA-C-N 116.662 -0.244 . . . . 0.0 110.523 -177.532 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.59 -43.82 92.61 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.114 0.483 . . . . 0.0 110.814 179.544 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 2.9 tm0? -63.96 -51.46 64.25 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.89 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 889' ' ' ARG . . . . . 0.474 ' HB2' ' O ' ' A' ' 885' ' ' ARG . 0.2 OUTLIER -72.51 -28.17 62.71 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.776 -0.647 . . . . 0.0 112.124 -174.611 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 890' ' ' ILE . . . . . 0.436 ' HB ' ' O ' ' A' ' 886' ' ' LEU . 0.8 OUTLIER -71.65 -38.59 67.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.707 179.273 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 891' ' ' ARG . . . . . 0.4 ' N ' HG22 ' A' ' 890' ' ' ILE . 0.1 OUTLIER -76.18 -24.88 54.76 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.121 0.486 . . . . 0.0 109.749 176.559 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -77.3 -31.89 55.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.459 179.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 893' ' ' LEU . . . . . 0.421 HD12 ' HB3' ' A' ' 865' ' ' SER . 1.6 tp -73.57 -49.36 26.73 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.345 -179.728 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 133.93 63.61 0.07 OUTLIER Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.297 -0.954 . . . . 0.0 112.161 -179.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 895' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.38 110.22 17.33 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.94 -0.392 . . . . 0.0 109.94 175.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -115.92 34.04 5.18 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.292 0.568 . . . . 0.0 110.996 -178.852 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 897' ' ' LEU . . . . . 0.408 ' CD1' HG22 ' A' ' 872' ' ' VAL . 0.2 OUTLIER -141.52 148.93 52.36 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.925 -178.283 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -69.66 130.12 18.9 Favored 'Trans proline' 0 C--O 1.24 0.599 0 C-N-CA 122.647 2.232 . . . . 0.0 113.03 -177.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 899' ' ' VAL . . . . . 0.673 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 8.0 t -112.05 129.45 67.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.586 176.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 900' ' ' ILE . . . . . 0.436 ' CG2' ' HG ' ' A' ' 923' ' ' LEU . 3.0 mp -99.2 111.93 30.07 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 175.805 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 901' ' ' GLY . . . . . 0.416 ' O ' ' HA ' ' A' ' 922' ' ' CYS . . . -95.07 101.13 2.67 Favored Glycine 0 N--CA 1.442 -0.938 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.035 -177.433 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 902' ' ' VAL . . . . . 1.004 ' HB ' ' HB2' ' A' ' 923' ' ' LEU . 0.1 OUTLIER -96.21 128.17 47.65 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 178.898 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 903' ' ' THR . . . . . 0.459 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.2 OUTLIER -135.51 169.12 18.0 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.321 -176.492 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 904' ' ' ALA . . . . . 0.413 ' HB2' ' HB2' ' A' ' 925' ' ' LYS . . . -142.81 104.73 4.38 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.678 0.275 . . . . 0.0 111.307 177.354 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 58.3 74.01 0.45 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.175 -0.921 . . . . 0.0 113.217 172.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 906' ' ' ALA . . . . . 0.535 ' HB2' ' CG ' ' A' ' 909' ' ' GLU . . . -117.76 -2.06 11.45 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 169.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 2.3 tp 71.76 -56.1 0.65 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 114.87 -1.059 . . . . 0.0 112.746 175.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 908' ' ' ALA . . . . . 0.588 ' O ' ' HB2' ' A' ' 912' ' ' GLN . . . -92.14 12.58 21.69 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -172.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 909' ' ' GLU . . . . . 0.535 ' CG ' ' HB2' ' A' ' 906' ' ' ALA . 0.5 OUTLIER -63.36 -36.19 82.89 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.583 0.23 . . . . 0.0 111.338 -175.192 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 910' ' ' GLU . . . . . 0.437 ' H ' ' HG3' ' A' ' 910' ' ' GLU . 0.0 OUTLIER -59.73 -61.89 2.28 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.209 -177.341 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.64 -29.31 66.75 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.088 -178.051 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 912' ' ' GLN . . . . . 0.588 ' HB2' ' O ' ' A' ' 908' ' ' ALA . 1.1 mt-30 -62.94 -45.04 94.33 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 177.55 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.61 -38.6 81.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.597 179.52 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 90.7 m -62.84 -35.25 79.31 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.956 176.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.47 -51.86 21.48 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.652 -179.051 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 916' ' ' GLU . . . . . 0.406 ' H ' ' HG3' ' A' ' 916' ' ' GLU . 0.0 OUTLIER -72.91 -50.31 24.45 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.672 -0.24 . . . . 0.0 111.292 -175.899 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 49.96 39.21 18.18 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.87 -174.512 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -99.11 -31.45 6.22 Favored Glycine 0 N--CA 1.445 -0.701 0 C-N-CA 120.845 -0.693 . . . . 0.0 111.975 -177.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 919' ' ' MET . . . . . 0.673 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 2.6 mtm -78.58 -94.0 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 110.533 -0.173 . . . . 0.0 110.533 179.325 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 920' ' ' ASP . . . . . 0.558 ' HB2' ' O ' ' A' ' 919' ' ' MET . 11.5 t70 157.47 -81.88 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.39 1.076 . . . . 0.0 108.871 179.479 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -97.48 173.04 7.37 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.752 -178.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 922' ' ' CYS . . . . . 0.416 ' HA ' ' O ' ' A' ' 901' ' ' GLY . 0.0 OUTLIER -144.18 136.76 26.86 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.943 0.401 . . . . 0.0 111.208 -178.248 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 923' ' ' LEU . . . . . 1.004 ' HB2' ' HB ' ' A' ' 902' ' ' VAL . 60.6 mt -127.25 -175.72 3.52 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.612 178.413 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 924' ' ' SER . . . . . 0.459 ' HA ' ' O ' ' A' ' 903' ' ' THR . 0.2 OUTLIER -126.31 144.17 50.9 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.362 178.3 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 925' ' ' LYS . . . . . 0.505 ' HZ2' ' CG ' ' A' ' 875' ' ' ASP . 2.3 tttp -53.82 -42.96 95.44 Favored Pre-proline 0 CA--C 1.54 0.564 0 O-C-N 123.538 0.524 . . . . 0.0 112.305 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -66.91 69.99 0.52 Allowed 'Trans proline' 0 C--N 1.36 1.168 0 C-N-CA 122.067 1.845 . . . . 0.0 111.807 171.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 3.0 p -115.48 158.1 15.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.72 -177.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -109.03 161.97 14.67 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.255 177.473 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 929' ' ' LEU . . . . . 0.508 ' HA ' HG22 ' A' ' 932' ' ' ILE . 1.2 tt -61.77 -29.52 70.19 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.925 0.393 . . . . 0.0 110.295 176.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 930' ' ' ASP . . . . . 0.551 ' O ' ' HG2' ' A' ' 934' ' ' GLN . 17.1 t0 -62.59 -46.24 89.22 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.246 179.375 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 55.2 t -71.73 -42.23 70.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.784 -176.285 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 932' ' ' ILE . . . . . 0.508 HG22 ' HA ' ' A' ' 929' ' ' LEU . 0.0 OUTLIER -64.95 -38.74 83.55 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.038 177.956 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 933' ' ' LYS . . . . . 0.516 ' HA ' HD21 ' A' ' 847' ' ' LEU . 2.0 tmmt? -62.7 -46.13 89.58 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.328 176.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 934' ' ' GLN . . . . . 0.551 ' HG2' ' O ' ' A' ' 930' ' ' ASP . 14.1 mm100 -57.05 -51.13 70.51 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.906 179.145 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 5.1 m -63.13 -42.45 99.5 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.464 -178.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 936' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.02 -35.85 82.07 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.712 178.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 90.2 m -68.32 -45.28 73.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.098 178.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 9.4 tp -61.83 -42.87 99.57 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.166 0.508 . . . . 0.0 110.506 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -72.67 -31.85 65.39 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.935 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -62.12 -41.15 97.95 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.807 178.037 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 941' ' ' GLU . . . . . 0.555 ' HG3' ' N ' ' A' ' 942' ' ' ARG . 0.0 OUTLIER -66.51 -35.43 80.23 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.342 178.139 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 942' ' ' ARG . . . . . 0.555 ' N ' ' HG3' ' A' ' 941' ' ' GLU . 5.0 mmt85 -66.1 -48.65 70.24 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.024 0.44 . . . . 0.0 110.89 178.37 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 943' ' ' VAL . . . . . 0.429 HG23 ' N ' ' A' ' 944' ' ' ARG . 25.4 m -74.17 -33.23 34.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.531 -174.263 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 944' ' ' ARG . . . . . 0.503 ' HG3' ' N ' ' A' ' 945' ' ' LYS . 0.0 OUTLIER -69.92 -34.59 73.69 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 121.187 -0.205 . . . . 0.0 110.696 -179.819 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 945' ' ' LYS . . . . . 0.503 ' N ' ' HG3' ' A' ' 944' ' ' ARG . 12.8 ptpt -79.16 -31.74 44.08 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 121.158 -0.217 . . . . 0.0 111.347 -178.332 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 7.7 m -74.42 -36.82 63.45 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.98 0.419 . . . . 0.0 110.508 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 1.7 ttm105 -78.51 -19.51 52.82 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.722 175.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 27.1 t70 . . . . . 0 N--CA 1.463 0.214 0 CA-C-N 115.036 -0.984 . . . . 0.0 111.118 177.976 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 705' ' ' SER . . . . . 0.622 ' O ' ' HA ' ' A' ' 846' ' ' SER . 0.9 OUTLIER . . . . . 0 CA--C 1.529 0.152 0 CA-C-O 121.186 0.517 . . . . 0.0 111.439 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . -171.83 -28.45 0.02 OUTLIER Glycine 0 N--CA 1.446 -0.681 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.614 -178.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 707' ' ' LYS . . . . . 0.995 ' CE ' ' HH ' ' A' ' 799' ' ' TYR . 0.0 OUTLIER -63.41 148.99 46.99 Favored 'General case' 0 C--N 1.334 -0.095 0 N-CA-C 109.862 -0.421 . . . . 0.0 109.862 176.595 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 708' ' ' ARG . . . . . 0.428 ' H ' ' HE3' ' A' ' 707' ' ' LYS . 4.7 mtt180 -116.53 146.86 42.32 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.125 0.488 . . . . 0.0 111.322 -177.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 709' ' ' CYS . . . . . 0.415 ' HB2' HD22 ' A' ' 726' ' ' LEU . 42.9 t -126.89 138.0 53.24 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.138 174.163 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 710' ' ' TRP . . . . . 0.611 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 38.9 m95 -105.49 130.83 53.48 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 120.783 0.325 . . . . 0.0 110.336 -177.335 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 711' ' ' LEU . . . . . 0.612 HD23 HG23 ' A' ' 733' ' ' VAL . 0.6 OUTLIER -136.37 137.73 40.85 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.217 0.532 . . . . 0.0 111.429 -178.412 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -126.91 53.45 1.7 Allowed 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.322 176.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 713' ' ' VAL . . . . . 0.965 ' HA ' ' HB2' ' A' ' 750' ' ' ASP . 15.8 t -109.13 132.76 56.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.807 -175.837 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.57 -11.81 16.21 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.583 -177.466 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -74.22 112.9 10.83 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 170.357 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 716' ' ' ALA . . . . . 0.598 ' O ' ' HB2' ' A' ' 720' ' ' GLN . . . -63.05 -44.75 94.96 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 122.73 0.412 . . . . 0.0 111.542 -172.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.3 -39.04 89.08 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.002 0.43 . . . . 0.0 110.709 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 718' ' ' LEU . . . . . 0.521 ' O ' ' HG ' ' A' ' 722' ' ' LEU . 2.3 tt -69.0 -51.17 42.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.596 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 719' ' ' CYS . . . . . 0.81 ' HA ' HD13 ' A' ' 722' ' ' LEU . 15.0 p -65.12 -42.03 94.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.548 -176.624 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 720' ' ' GLN . . . . . 0.7 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -60.95 -39.38 89.3 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.288 179.483 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.12 -53.7 55.3 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.96 0.409 . . . . 0.0 110.836 -179.623 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 722' ' ' LEU . . . . . 0.81 HD13 ' HA ' ' A' ' 719' ' ' CYS . 0.0 OUTLIER -67.4 -48.25 67.9 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.304 -178.314 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 723' ' ' GLU . . . . . 0.7 ' HG2' ' HA ' ' A' ' 720' ' ' GLN . 3.1 pt-20 -59.51 -41.13 89.2 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.669 -174.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 724' ' ' THR . . . . . 0.643 ' HA ' ' HG2' ' A' ' 727' ' ' GLN . 10.0 m -70.35 -36.6 74.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.688 0.28 . . . . 0.0 111.277 -179.1 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 25.1 m -66.92 -34.08 76.98 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.478 0.18 . . . . 0.0 111.336 -179.116 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 726' ' ' LEU . . . . . 0.699 HD23 HG22 ' A' ' 731' ' ' ILE . 1.1 mp -81.48 -41.67 21.4 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 121.17 -0.212 . . . . 0.0 111.301 178.161 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 727' ' ' GLN . . . . . 0.643 ' HG2' ' HA ' ' A' ' 724' ' ' THR . 0.0 OUTLIER -65.07 -21.76 66.86 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.219 0.533 . . . . 0.0 109.906 177.19 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 728' ' ' ARG . . . . . 0.453 ' HB2' ' O ' ' A' ' 724' ' ' THR . 20.2 ttp85 -60.48 -26.69 66.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.841 175.056 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -107.21 4.32 26.55 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.144 -179.588 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 730' ' ' GLY . . . . . 0.61 ' O ' ' HA ' ' A' ' 705' ' ' SER . . . 99.44 -5.82 58.97 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 121.122 -0.561 . . . . 0.0 112.436 177.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 731' ' ' ILE . . . . . 0.699 HG22 HD23 ' A' ' 726' ' ' LEU . 17.1 mt -75.6 113.75 14.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.116 0.484 . . . . 0.0 110.487 -177.053 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 732' ' ' VAL . . . . . . . . . . . . . 10.5 m -76.33 133.69 30.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.83 -177.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 733' ' ' VAL . . . . . 0.612 HG23 HD23 ' A' ' 711' ' ' LEU . 0.3 OUTLIER -97.6 138.86 21.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.351 179.42 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 4.7 m -133.98 135.31 43.38 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.254 179.082 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.33 118.82 9.22 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.425 177.016 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 736' ' ' TYR . . . . . 0.611 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 50.8 t80 -82.48 95.01 7.57 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.255 0.55 . . . . 0.0 110.556 -179.294 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.24 -70.82 0.78 Allowed 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.404 175.803 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -130.22 91.29 0.3 Allowed Glycine 0 N--CA 1.445 -0.75 0 N-CA-C 110.788 -0.925 . . . . 0.0 110.788 175.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.13 164.25 34.46 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.78 0.324 . . . . 0.0 111.002 -176.37 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 740' ' ' GLU . . . . . 0.429 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 1.9 mt-10 -79.28 138.49 55.92 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.771 -179.066 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 741' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 740' ' ' GLU . 5.0 Cg_endo -87.46 126.63 2.28 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 123.282 2.655 . . . . 0.0 112.246 177.013 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 742' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -104.65 134.62 19.57 Favored Pre-proline 0 C--N 1.323 -0.571 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.009 177.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 743' ' ' PRO . . . . . 1.006 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 18.7 Cg_endo -61.91 -16.88 52.4 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 123.084 2.523 . . . . 0.0 112.98 -179.564 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 56.8 mp0 -105.33 11.79 32.41 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.844 0.354 . . . . 0.0 110.839 178.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -111.53 159.86 17.72 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.465 -177.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 3.6 p -124.08 141.44 44.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.236 -174.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 747' ' ' LEU . . . . . 0.631 HD23 HG21 ' A' ' 749' ' ' THR . 0.5 OUTLIER -117.56 141.43 48.38 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.944 179.33 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 748' ' ' ILE . . . . . 0.626 ' N ' HD21 ' A' ' 747' ' ' LEU . 0.8 OUTLIER -121.75 120.92 63.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 N-CA-C 108.631 -0.878 . . . . 0.0 108.631 169.983 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 749' ' ' THR . . . . . 0.631 HG21 HD23 ' A' ' 747' ' ' LEU . 0.0 OUTLIER -119.27 150.42 40.13 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -169.575 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 750' ' ' ASP . . . . . 0.965 ' HB2' ' HA ' ' A' ' 713' ' ' VAL . 10.1 t0 -108.84 111.55 23.33 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.479 179.472 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 751' ' ' GLU . . . . . 0.938 ' HG2' HH21 ' A' ' 767' ' ' ARG . 17.1 mm-40 58.75 -151.9 0.41 Allowed 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 123.517 0.727 . . . . 0.0 111.248 -177.69 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 752' ' ' VAL . . . . . 0.417 ' H ' ' HB3' ' A' ' 751' ' ' GLU . 2.6 t -85.74 129.73 37.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 121.061 0.458 . . . . 0.0 111.741 -174.81 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 753' ' ' VAL . . . . . 0.453 HG21 HG22 ' A' ' 749' ' ' THR . 3.4 t -120.7 159.59 22.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.19 -0.671 . . . . 0.0 109.19 177.597 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 754' ' ' SER . . . . . 0.409 ' H ' HG12 ' A' ' 753' ' ' VAL . 1.4 m -79.78 37.93 0.37 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.974 0.416 . . . . 0.0 110.934 178.103 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 755' ' ' LYS . . . . . 0.418 ' H ' ' C ' ' A' ' 753' ' ' VAL . 3.8 mttt -159.31 -174.65 4.8 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 178.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 756' ' ' LYS . . . . . 0.622 ' O ' ' HB2' ' A' ' 757' ' ' TRP . 0.0 OUTLIER -140.03 -67.6 0.43 Allowed 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 172.627 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 757' ' ' TRP . . . . . 0.622 ' HB2' ' O ' ' A' ' 756' ' ' LYS . 0.7 OUTLIER 157.68 164.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 114.303 -1.317 . . . . 0.0 109.519 -175.265 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.69 49.97 1.14 Allowed 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 173.362 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 759' ' ' GLY . . . . . 1.006 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -150.14 -144.6 3.96 Favored Glycine 0 N--CA 1.442 -0.954 0 C-N-CA 120.403 -0.904 . . . . 0.0 113.654 -173.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 4.9 ttt85 -63.42 -61.51 2.29 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.22 -0.49 . . . . 0.0 111.652 -173.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -162.4 146.35 11.86 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.859 0.362 . . . . 0.0 111.068 -178.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 762' ' ' VAL . . . . . 0.555 HG21 ' HB3' ' A' ' 747' ' ' LEU . 4.0 p -126.57 122.96 62.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.738 174.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 16.6 t -102.08 95.56 4.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.824 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 764' ' ' THR . . . . . 0.698 HG22 HG13 ' A' ' 772' ' ' ILE . 91.5 m -92.14 122.53 34.72 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.618 -179.38 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 765' ' ' PHE . . . . . 0.867 ' HZ ' ' HG ' ' A' ' 791' ' ' LEU . 3.9 m-30 -99.39 101.65 12.98 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.098 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 766' ' ' CYS . . . . . 0.532 ' SG ' HG21 ' A' ' 764' ' ' THR . 0.0 OUTLIER -123.5 133.53 54.0 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.21 -177.646 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 767' ' ' ARG . . . . . 0.938 HH21 ' HG2' ' A' ' 751' ' ' GLU . 0.0 OUTLIER -140.19 -35.08 0.52 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.944 -179.048 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -84.98 -52.53 5.92 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 178.195 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -125.15 124.91 42.81 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.57 172.643 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 2.1 mt -115.39 85.34 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.161 0.505 . . . . 0.0 110.538 -177.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 771' ' ' GLY . . . . . 0.415 ' HA3' HG13 ' A' ' 752' ' ' VAL . . . -92.35 -6.54 64.42 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.858 -0.686 . . . . 0.0 111.815 178.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 772' ' ' ILE . . . . . 0.698 HG13 HG22 ' A' ' 764' ' ' THR . 3.0 mm -103.52 131.3 22.19 Favored Pre-proline 0 C--N 1.323 -0.583 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.431 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 773' ' ' PRO . . . . . 0.558 ' O ' ' HB3' ' A' ' 774' ' ' LEU . 31.6 Cg_exo -60.57 -94.04 0.0 OUTLIER 'Trans proline' 0 CA--C 1.532 0.391 0 C-N-CA 123.188 2.592 . . . . 0.0 113.075 -176.725 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . 0.663 HD23 ' HE3' ' A' ' 776' ' ' LYS . 0.4 OUTLIER 167.4 -163.68 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.19 0.596 . . . . 0.0 109.913 -178.98 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 775' ' ' GLU . . . . . 0.601 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 1.4 mp0 -62.94 69.47 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.743 0.782 . . . . 0.0 112.423 175.084 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 776' ' ' LYS . . . . . 0.663 ' HE3' HD23 ' A' ' 774' ' ' LEU . 18.3 ptpt -132.61 -1.03 3.49 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 114.796 -1.093 . . . . 0.0 108.872 171.208 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -131.62 158.36 75.58 Favored Pre-proline 0 N--CA 1.449 -0.494 0 CA-C-N 114.94 -1.027 . . . . 0.0 109.25 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -61.64 99.93 0.18 Allowed 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.58 2.187 . . . . 0.0 112.714 -178.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 94.23 15.62 47.09 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.883 -0.675 . . . . 0.0 113.408 175.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 780' ' ' GLU . . . . . 0.601 ' O ' ' HG3' ' A' ' 775' ' ' GLU . 2.7 tt0 -100.07 121.78 41.92 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 117.541 0.67 . . . . 0.0 110.322 179.251 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 12.0 m95 -129.33 124.23 33.77 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 176.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . 0.644 ' HB ' ' HA ' ' A' ' 774' ' ' LEU . 1.8 t -141.13 136.34 33.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 C-N-CA 120.696 -0.402 . . . . 0.0 111.711 -176.131 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 783' ' ' HIS . . . . . 0.432 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 1.0 OUTLIER -176.17 174.81 1.98 Allowed 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.913 168.432 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 784' ' ' SER . . . . . 0.704 ' HB3' ' HB3' ' A' ' 767' ' ' ARG . 0.7 OUTLIER -98.42 100.47 11.74 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.968 177.1 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 785' ' ' VAL . . . . . 0.688 HG12 ' H ' ' A' ' 787' ' ' ALA . 39.8 t -138.47 140.38 39.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -178.703 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -90.23 12.57 17.66 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.76 0.314 . . . . 0.0 111.138 -179.016 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 787' ' ' ALA . . . . . 0.688 ' H ' HG12 ' A' ' 785' ' ' VAL . . . 53.82 57.64 13.18 Favored Pre-proline 0 N--CA 1.467 0.381 0 CA-C-N 115.481 -0.781 . . . . 0.0 112.279 -178.782 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 788' ' ' PRO . . . . . 0.516 ' HD3' ' N ' ' A' ' 787' ' ' ALA . 24.2 Cg_exo -65.23 -57.83 0.24 Allowed 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 122.509 2.139 . . . . 0.0 112.375 178.22 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -160.73 -22.49 0.06 Allowed 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 179.041 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 790' ' ' GLU . . . . . 0.433 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 2.7 pm0 -73.09 -33.53 65.66 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 111.684 0.253 . . . . 0.0 111.684 -175.152 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 791' ' ' LEU . . . . . 0.867 ' HG ' ' HZ ' ' A' ' 765' ' ' PHE . 0.4 OUTLIER -71.07 -52.53 9.32 Favored Pre-proline 0 C--N 1.327 -0.382 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.761 -178.673 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 792' ' ' PRO . . . . . 0.438 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 9.5 Cg_endo -56.68 -30.77 85.17 Favored 'Trans proline' 0 C--N 1.356 0.949 0 C-N-CA 121.521 1.481 . . . . 0.0 111.831 175.228 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -69.7 -42.24 74.32 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.657 175.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.44 -42.57 96.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.66 177.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 795' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.68 -35.36 80.77 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.988 0.423 . . . . 0.0 110.693 -179.338 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -63.67 -38.43 91.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.626 177.116 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 797' ' ' ARG . . . . . 0.513 ' HG3' ' N ' ' A' ' 798' ' ' ILE . 0.0 OUTLIER -71.55 -33.06 68.8 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.106 176.593 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 798' ' ' ILE . . . . . 0.513 ' N ' ' HG3' ' A' ' 797' ' ' ARG . 0.9 OUTLIER -61.45 -35.53 67.24 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.445 -175.739 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 799' ' ' TYR . . . . . 0.995 ' HH ' ' CE ' ' A' ' 707' ' ' LYS . 0.2 OUTLIER -104.62 28.04 7.39 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 119.829 -0.749 . . . . 0.0 112.076 176.114 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.235 0.295 0 CA-C-N 115.291 -0.868 . . . . 0.0 112.993 170.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 3.1 t0 . . . . . 0 C--O 1.232 0.167 0 CA-C-O 121.211 0.529 . . . . 0.0 111.249 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 3.0 tpt -112.99 92.7 4.1 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.142 0.496 . . . . 0.0 110.252 176.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 826' ' ' MET . . . . . . . . . . . . . 8.7 ptp -114.27 129.89 56.64 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.938 -179.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 827' ' ' ILE . . . . . 0.487 ' O ' ' HA ' ' A' ' 851' ' ' CYS . 1.0 OUTLIER -126.39 137.76 56.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.998 -178.584 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 828' ' ' LEU . . . . . 0.546 HD21 ' HB ' ' A' ' 869' ' ' ILE . 0.2 OUTLIER -107.68 143.61 35.93 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.782 0.325 . . . . 0.0 110.632 -178.504 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 829' ' ' VAL . . . . . 0.566 HG21 HD13 ' A' ' 840' ' ' LEU . 0.1 OUTLIER -128.04 119.67 51.72 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 121.315 0.579 . . . . 0.0 110.231 -179.345 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 830' ' ' VAL . . . . . . . . . . . . . 69.0 t -122.6 107.89 20.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 115.285 -0.871 . . . . 0.0 109.333 176.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 831' ' ' ASP . . . . . 0.547 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -118.22 153.26 34.19 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.155 0.502 . . . . 0.0 111.177 -177.611 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 832' ' ' ASP . . . . . 0.427 ' HB2' ' HA ' ' A' ' 876' ' ' VAL . 6.8 t70 -68.94 -42.4 76.78 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.778 -1.101 . . . . 0.0 112.293 -177.289 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -126.41 105.06 24.52 Favored Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 110.299 -0.259 . . . . 0.0 110.299 -173.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -40.75 -25.12 0.18 Allowed 'Trans proline' 0 C--N 1.353 0.803 1 C-N-CA 125.892 4.395 . . . . 0.0 116.553 -164.38 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 835' ' ' ILE . . . . . 0.461 HG21 HD13 ' A' ' 835' ' ' ILE . 0.0 OUTLIER -61.01 -39.95 83.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 117.985 0.357 . . . . 0.0 111.173 -179.206 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 836' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -74.5 -41.6 60.41 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 837' ' ' ARG . . . . . 0.547 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 12.9 ttp180 -52.83 -49.93 64.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.25 177.682 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 838' ' ' ARG . . . . . 0.434 ' HG3' ' O ' ' A' ' 835' ' ' ILE . 0.0 OUTLIER -68.56 -34.61 76.13 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.94 -178.139 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 839' ' ' LEU . . . . . 0.482 ' HA ' HD23 ' A' ' 839' ' ' LEU . 0.6 OUTLIER -69.91 -49.15 54.88 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.077 -176.104 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 840' ' ' LEU . . . . . 0.566 HD13 HG21 ' A' ' 829' ' ' VAL . 2.6 pp -74.26 -31.44 62.55 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.405 -178.199 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 841' ' ' ALA . . . . . 0.518 ' HB1' ' O ' ' A' ' 837' ' ' ARG . . . -68.93 -35.21 76.53 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.941 0.401 . . . . 0.0 110.398 177.11 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 842' ' ' ASP . . . . . 0.4 ' HB2' ' O ' ' A' ' 838' ' ' ARG . 0.3 OUTLIER -63.5 -36.66 84.49 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.885 176.064 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 843' ' ' GLN . . . . . 0.709 ' HG3' HD22 ' A' ' 929' ' ' LEU . 2.5 mm-40 -68.44 -39.79 81.36 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.494 -0.775 . . . . 0.0 109.991 176.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 844' ' ' LEU . . . . . 0.444 ' HA ' HD12 ' A' ' 847' ' ' LEU . 0.3 OUTLIER -59.15 -43.46 92.06 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.273 176.579 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -61.92 -35.13 90.92 Favored Glycine 0 N--CA 1.451 -0.316 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.003 176.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 846' ' ' SER . . . . . 0.622 ' HA ' ' O ' ' A' ' 705' ' ' SER . 29.3 m -71.47 -17.26 62.37 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.792 0.33 . . . . 0.0 111.167 178.401 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 847' ' ' LEU . . . . . 0.444 HD12 ' HA ' ' A' ' 844' ' ' LEU . 44.3 mt -83.22 -18.39 39.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.374 175.312 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 88.97 30.02 15.99 Favored Glycine 0 C--N 1.33 0.213 0 C-N-CA 121.042 -0.599 . . . . 0.0 112.924 177.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -119.31 160.19 22.71 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 179.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.82 109.51 19.33 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.196 0.522 . . . . 0.0 111.085 -177.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 851' ' ' CYS . . . . . 0.487 ' HA ' ' O ' ' A' ' 827' ' ' ILE . 0.0 OUTLIER -93.39 151.79 19.53 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.996 179.97 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.92 109.94 13.63 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.517 173.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 853' ' ' THR . . . . . 0.449 HG23 ' CG ' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -94.43 124.07 38.23 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -171.189 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 854' ' ' ALA . . . . . . . . . . . . . . . -137.65 155.58 48.99 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.479 175.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -134.39 75.35 1.58 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 856' ' ' ASP . . . . . 0.611 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 26.8 t70 170.6 143.84 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.681 179.627 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -70.63 -37.42 67.82 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 121.038 -0.601 . . . . 0.0 113.148 -177.114 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -73.71 -31.54 32.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.846 0.355 . . . . 0.0 110.217 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 859' ' ' ASP . . . . . 0.611 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 1.0 OUTLIER -58.99 -29.21 67.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.764 177.275 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -63.76 -42.47 97.82 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.961 0.41 . . . . 0.0 110.495 177.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 861' ' ' LEU . . . . . 0.532 HD23 HD22 ' A' ' 893' ' ' LEU . 0.2 OUTLIER -71.14 -33.52 70.16 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.999 178.17 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -63.98 -52.23 60.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.602 179.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 9.4 p -69.14 -32.69 55.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.023 -177.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 864' ' ' LEU . . . . . 0.467 ' HA ' HD23 ' A' ' 864' ' ' LEU . 0.2 OUTLIER -61.3 -39.02 88.92 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.051 0.453 . . . . 0.0 110.571 177.984 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 11.0 m -82.14 -20.89 37.04 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.986 -178.49 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.8 -46.34 17.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.451 -179.607 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -150.5 138.92 20.46 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 177.729 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 18.3 m80 -86.7 88.66 7.72 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.301 0.572 . . . . 0.0 111.773 -172.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 869' ' ' ILE . . . . . 0.546 ' HB ' HD21 ' A' ' 828' ' ' LEU . 0.8 OUTLIER -69.48 154.74 8.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.301 173.22 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.03 -34.37 15.15 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -169.692 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 871' ' ' ILE . . . . . 0.462 HG23 ' N ' ' A' ' 872' ' ' VAL . 2.2 mt -130.37 136.01 59.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 O-C-N 122.208 -0.308 . . . . 0.0 110.721 -179.165 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 872' ' ' VAL . . . . . 0.828 ' HB ' ' HB ' ' A' ' 899' ' ' VAL . 2.2 t -103.38 126.2 57.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.425 -178.092 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 873' ' ' LEU . . . . . 0.54 ' HB2' ' HA ' ' A' ' 829' ' ' VAL . 13.0 mt -104.03 99.82 9.57 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 170.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -106.05 96.95 6.84 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.581 0.229 . . . . 0.0 110.645 -178.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 875' ' ' ASP . . . . . 0.506 ' HA ' ' HB ' ' A' ' 902' ' ' VAL . 10.2 t0 -109.26 110.69 21.94 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.395 -177.245 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 876' ' ' VAL . . . . . 0.427 ' HA ' ' HB2' ' A' ' 832' ' ' ASP . 0.2 OUTLIER -108.01 155.19 8.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.22 0.533 . . . . 0.0 111.538 -175.884 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -115.63 -65.75 1.16 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.476 176.031 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 2.5 ttm . . . . . 0 CA--C 1.538 0.491 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 177.062 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 0.332 0 N-CA-C 114.005 0.362 . . . . 0.0 114.005 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -168.06 -8.58 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.842 0.353 . . . . 0.0 110.6 178.512 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -63.51 -44.15 95.13 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.311 -176.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 886' ' ' LEU . . . . . 0.59 HD12 ' H ' ' A' ' 887' ' ' THR . 0.0 OUTLIER -68.72 -29.25 67.64 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.149 -177.796 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 887' ' ' THR . . . . . 0.59 ' H ' HD12 ' A' ' 886' ' ' LEU . 0.2 OUTLIER -72.33 -43.58 63.91 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 120.942 0.401 . . . . 0.0 110.409 176.863 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 33.1 mm-40 -59.53 -40.78 88.27 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.343 177.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.68 -34.78 62.74 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.355 -178.648 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 890' ' ' ILE . . . . . 0.449 HG22 ' N ' ' A' ' 891' ' ' ARG . 0.3 OUTLIER -73.32 -36.72 49.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 120.9 -0.32 . . . . 0.0 110.904 -179.712 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 891' ' ' ARG . . . . . 0.449 ' N ' HG22 ' A' ' 890' ' ' ILE . 6.2 ptm180 -75.57 -25.26 56.91 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.969 0.414 . . . . 0.0 110.097 176.799 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -71.01 -45.41 63.99 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.209 175.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 893' ' ' LEU . . . . . 0.532 HD22 HD23 ' A' ' 861' ' ' LEU . 4.4 tp -68.08 -45.81 72.77 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.571 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 125.49 66.41 0.18 Allowed Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.155 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 895' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 895' ' ' LEU . 0.0 OUTLIER -55.52 121.6 9.41 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.18 0.514 . . . . 0.0 110.204 176.599 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -123.12 17.8 9.97 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.323 0.582 . . . . 0.0 111.021 -176.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 897' ' ' LEU . . . . . 0.446 ' HA ' ' HD3' ' A' ' 898' ' ' PRO . 0.0 OUTLIER -144.03 138.54 15.09 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.203 -177.003 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 898' ' ' PRO . . . . . 0.446 ' HD3' ' HA ' ' A' ' 897' ' ' LEU . 33.1 Cg_exo -61.43 140.78 89.59 Favored 'Trans proline' 0 C--O 1.237 0.427 0 C-N-CA 122.709 2.273 . . . . 0.0 112.191 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 899' ' ' VAL . . . . . 0.888 HG13 ' HA ' ' A' ' 919' ' ' MET . 0.2 OUTLIER -128.88 138.42 54.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.655 0.74 . . . . 0.0 110.94 -178.425 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 900' ' ' ILE . . . . . . . . . . . . . 4.1 mt -91.15 114.29 28.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 115.33 -0.85 . . . . 0.0 109.905 177.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 901' ' ' GLY . . . . . 0.508 ' O ' ' HA ' ' A' ' 922' ' ' CYS . . . -84.52 106.66 2.94 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.266 -179.201 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 902' ' ' VAL . . . . . 0.506 ' HB ' ' HA ' ' A' ' 875' ' ' ASP . 1.1 t -110.07 140.04 30.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -150.82 150.03 30.44 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 110.267 -0.271 . . . . 0.0 110.267 176.542 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -69.79 114.54 8.08 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 169.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -54.7 106.45 0.21 Allowed 'General case' 0 CA--C 1.513 -0.453 0 CA-C-O 121.539 0.685 . . . . 0.0 110.64 -174.427 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 906' ' ' ALA . . . . . 0.569 ' O ' ' HB2' ' A' ' 907' ' ' LEU . . . -120.8 -81.64 0.64 Allowed 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 114.851 -1.068 . . . . 0.0 110.109 -175.464 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 907' ' ' LEU . . . . . 0.569 ' HB2' ' O ' ' A' ' 906' ' ' ALA . 0.4 OUTLIER 160.24 137.87 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.475 -1.239 . . . . 0.0 108.496 -176.692 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . 74.69 -50.72 0.67 Allowed 'General case' 0 N--CA 1.467 0.391 0 O-C-N 123.788 0.68 . . . . 0.0 111.977 175.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.98 -38.8 92.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.119 0.485 . . . . 0.0 111.027 179.7 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 910' ' ' GLU . . . . . 0.473 ' H ' ' HG3' ' A' ' 910' ' ' GLU . 0.5 OUTLIER -67.15 -29.12 68.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.449 0.642 . . . . 0.0 109.496 175.581 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 1.4 ttpm? -77.69 -15.94 58.83 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.315 178.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -75.59 -37.53 59.8 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 173.266 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.49 -40.46 87.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.672 172.582 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 70.8 m -71.54 -26.5 62.67 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.156 176.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.6 -44.6 70.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.643 -179.809 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -77.85 -48.11 17.25 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.059 178.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.8 25.92 3.23 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.066 0.546 . . . . 0.0 111.776 -175.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -98.62 24.02 33.82 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.156 -178.017 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 919' ' ' MET . . . . . 0.888 ' HA ' HG13 ' A' ' 899' ' ' VAL . 1.5 mpt? -112.44 -86.19 0.56 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 110.162 -0.31 . . . . 0.0 110.162 -179.396 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 920' ' ' ASP . . . . . 0.585 ' HB2' ' O ' ' A' ' 919' ' ' MET . 8.4 t70 160.38 -73.17 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.449 0 O-C-N 124.614 1.196 . . . . 0.0 109.357 175.549 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -90.77 172.97 8.27 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.077 -173.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 922' ' ' CYS . . . . . 0.508 ' HA ' ' O ' ' A' ' 901' ' ' GLY . 0.1 OUTLIER -149.73 121.33 8.01 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.485 177.794 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 923' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -143.7 173.04 12.02 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.894 0.378 . . . . 0.0 110.31 175.138 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 1.8 m -94.52 153.29 17.97 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.436 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 925' ' ' LYS . . . . . 0.413 ' N ' ' HD2' ' A' ' 926' ' ' PRO . 25.8 tttp -46.93 -48.99 51.42 Favored Pre-proline 0 CA--C 1.538 0.519 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -178.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 926' ' ' PRO . . . . . 0.413 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 50.2 Cg_endo -69.67 72.52 1.39 Allowed 'Trans proline' 0 C--N 1.355 0.901 0 C-N-CA 121.634 1.556 . . . . 0.0 112.815 177.257 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 927' ' ' VAL . . . . . 0.572 HG12 ' HB ' ' A' ' 932' ' ' ILE . 34.2 t -79.62 119.19 28.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.428 177.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.42 156.55 38.94 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.228 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 929' ' ' LEU . . . . . 0.709 HD22 ' HG3' ' A' ' 843' ' ' GLN . 1.4 tm? -56.57 -46.05 80.97 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.631 -176.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -67.43 -33.09 74.44 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.372 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 54.0 t -70.08 -49.23 57.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.876 -177.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 932' ' ' ILE . . . . . 0.572 ' HB ' HG12 ' A' ' 927' ' ' VAL . 0.8 OUTLIER -61.1 -39.59 82.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 178.861 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 2.4 tmmt? -61.93 -48.79 78.85 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.894 178.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 -66.16 -48.22 71.48 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.487 -177.081 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 4.3 m -61.85 -44.16 97.38 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.165 -178.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 936' ' ' LEU . . . . . 0.498 ' O ' ' HB1' ' A' ' 940' ' ' ALA . 0.7 OUTLIER -64.59 -41.73 96.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.513 179.527 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 86.4 m -62.36 -44.43 96.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.977 0.418 . . . . 0.0 110.819 178.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -64.98 -44.32 89.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.406 -177.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -76.64 -28.57 56.09 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.414 -177.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 940' ' ' ALA . . . . . 0.498 ' HB1' ' O ' ' A' ' 936' ' ' LEU . . . -66.71 -41.51 87.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.899 0.381 . . . . 0.0 110.179 175.248 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 941' ' ' GLU . . . . . 0.509 ' HA ' ' HB2' ' A' ' 944' ' ' ARG . 7.4 pt-20 -75.55 -22.1 57.34 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.347 177.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 942' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.28 -48.01 71.78 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.259 175.604 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 943' ' ' VAL . . . . . 0.477 HG22 ' O ' ' A' ' 940' ' ' ALA . 12.7 m -74.41 -30.93 26.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.892 0.377 . . . . 0.0 110.342 178.05 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 944' ' ' ARG . . . . . 0.509 ' HB2' ' HA ' ' A' ' 941' ' ' GLU . 0.8 OUTLIER -65.83 -31.94 73.19 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.002 177.928 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -87.73 -15.35 37.31 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.692 0.282 . . . . 0.0 110.623 177.11 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 53.2 m -72.52 -45.27 60.11 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.904 0.383 . . . . 0.0 110.053 174.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 2.9 ttp85 -78.07 -31.68 50.37 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 174.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 36.5 t70 . . . . . 0 C--O 1.233 0.235 0 CA-C-N 114.751 -1.113 . . . . 0.0 111.272 179.029 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 705' ' ' SER . . . . . 0.565 ' HA ' ' HA3' ' A' ' 730' ' ' GLY . 4.6 m . . . . . 0 N--CA 1.451 -0.392 0 CA-C-O 121.449 0.642 . . . . 0.0 109.444 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . -145.42 43.94 0.9 Allowed Glycine 0 N--CA 1.447 -0.596 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.617 -176.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 707' ' ' LYS . . . . . 0.639 ' HB2' HD12 ' A' ' 731' ' ' ILE . 1.2 mmtt -133.99 143.92 48.43 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 178.201 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 708' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.06 152.82 20.53 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.246 0.546 . . . . 0.0 110.993 -177.566 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -131.59 112.36 12.54 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.766 175.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 710' ' ' TRP . . . . . 0.641 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 84.5 m95 -92.51 121.12 33.66 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.431 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 711' ' ' LEU . . . . . 0.659 HD13 ' SG ' ' A' ' 719' ' ' CYS . 2.4 pt? -128.77 131.15 47.81 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.528 0.68 . . . . 0.0 111.297 -177.02 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -127.43 66.34 1.31 Allowed 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.876 177.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 713' ' ' VAL . . . . . 0.748 ' HB ' ' SG ' ' A' ' 719' ' ' CYS . 45.9 t -113.85 130.09 68.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.109 -179.015 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 714' ' ' ARG . . . . . 0.485 ' HD2' ' OD2' ' A' ' 750' ' ' ASP . 20.6 mtt180 -81.37 -13.42 58.35 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.209 -177.536 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -87.4 122.2 30.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.411 178.098 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -70.59 -35.65 73.14 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.74 -176.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.18 -54.41 47.23 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.115 0.483 . . . . 0.0 110.244 177.502 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 718' ' ' LEU . . . . . 0.71 HD21 HD13 ' A' ' 722' ' ' LEU . 0.8 OUTLIER -61.99 -49.38 76.29 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.763 -179.499 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 719' ' ' CYS . . . . . 0.748 ' SG ' ' HB ' ' A' ' 713' ' ' VAL . 0.7 OUTLIER -59.31 -53.08 62.3 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.205 -177.287 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 720' ' ' GLN . . . . . 0.46 ' O ' ' HG3' ' A' ' 723' ' ' GLU . 48.0 tt0 -65.28 -44.34 88.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.798 -174.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -56.52 -48.81 76.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.822 0.344 . . . . 0.0 110.954 -176.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 722' ' ' LEU . . . . . 0.71 HD13 HD21 ' A' ' 718' ' ' LEU . 76.3 mt -68.35 -48.12 65.65 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.09 -178.731 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 723' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 720' ' ' GLN . 0.0 OUTLIER -62.15 -42.73 99.53 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 111.705 0.261 . . . . 0.0 111.705 -174.092 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 724' ' ' THR . . . . . . . . . . . . . 27.8 m -69.08 -37.52 78.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.837 0.351 . . . . 0.0 111.022 -179.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 23.8 m -67.76 -37.88 82.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.804 0.335 . . . . 0.0 111.151 178.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 726' ' ' LEU . . . . . 0.752 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 18.4 mt -75.15 -38.57 60.9 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.998 0.428 . . . . 0.0 111.101 -178.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -74.47 -4.3 35.91 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.148 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.78 -44.11 94.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.277 -0.42 . . . . 0.0 109.95 174.988 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -80.67 -68.76 0.65 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.068 175.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 730' ' ' GLY . . . . . 0.565 ' HA3' ' HA ' ' A' ' 705' ' ' SER . . . 172.28 26.07 0.02 OUTLIER Glycine 0 N--CA 1.442 -0.919 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.942 176.051 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 731' ' ' ILE . . . . . 0.752 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 13.5 mm -84.09 91.49 2.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 177.763 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 732' ' ' VAL . . . . . . . . . . . . . 1.8 p -67.46 120.71 15.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.601 0.715 . . . . 0.0 111.173 -176.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 733' ' ' VAL . . . . . 0.47 ' HB ' HD22 ' A' ' 711' ' ' LEU . 4.3 m -91.32 147.63 5.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.087 -178.028 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 734' ' ' THR . . . . . 0.447 ' HB ' ' CZ3' ' A' ' 710' ' ' TRP . 0.1 OUTLIER -143.61 138.44 29.02 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.767 178.309 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.25 110.91 1.17 Allowed 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.788 176.46 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 736' ' ' TYR . . . . . 0.641 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 46.2 t80 -80.52 93.17 6.0 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.371 0.605 . . . . 0.0 110.175 178.158 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -97.21 -30.85 12.75 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.763 177.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 162.64 56.78 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 111.019 -0.832 . . . . 0.0 111.019 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 739' ' ' GLN . . . . . 0.45 ' HB3' ' H ' ' A' ' 740' ' ' GLU . 15.2 mp0 -101.99 -144.95 0.35 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.91 0.386 . . . . 0.0 111.728 -172.425 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 740' ' ' GLU . . . . . 0.45 ' H ' ' HB3' ' A' ' 739' ' ' GLN . 2.3 pt-20 -106.02 125.11 33.92 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.117 -173.609 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 741' ' ' PRO . . . . . 0.58 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 73.4 Cg_endo -78.5 123.34 5.92 Favored 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 122.471 2.114 . . . . 0.0 112.267 175.487 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 742' ' ' THR . . . . . 0.875 HG23 ' HD2' ' A' ' 743' ' ' PRO . 0.2 OUTLIER -118.84 141.8 30.72 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.589 178.506 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 743' ' ' PRO . . . . . 0.875 ' HD2' HG23 ' A' ' 742' ' ' THR . 34.7 Cg_endo -65.55 -1.38 4.72 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 123.314 2.676 . . . . 0.0 113.032 179.036 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -103.34 -8.48 20.24 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.245 0.545 . . . . 0.0 110.4 177.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -112.75 153.1 28.3 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.744 -171.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 746' ' ' VAL . . . . . 0.481 ' HA ' ' O ' ' A' ' 761' ' ' ALA . 8.3 m -116.94 147.92 20.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.817 178.353 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 747' ' ' LEU . . . . . 0.46 ' HA ' HD23 ' A' ' 747' ' ' LEU . 0.0 OUTLIER -107.86 104.61 14.12 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.372 179.933 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -99.49 111.89 30.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 177.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 14.0 p -124.09 156.22 36.98 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.896 0.379 . . . . 0.0 111.418 -175.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 750' ' ' ASP . . . . . 0.617 ' HB3' HG11 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -109.16 130.77 55.48 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 168.464 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 751' ' ' GLU . . . . . 0.433 ' HG3' ' N ' ' A' ' 752' ' ' VAL . 4.4 tp10 72.86 153.25 0.13 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.188 -167.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 752' ' ' VAL . . . . . 0.754 HG22 ' HB ' ' A' ' 772' ' ' ILE . 1.4 t -70.82 123.5 25.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.63 -178.401 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 11.1 m -101.32 155.09 4.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.563 -179.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -83.24 75.15 9.97 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.061 178.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -154.24 127.3 8.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.066 0.46 . . . . 0.0 111.568 -175.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.96 81.2 4.59 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 169.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 757' ' ' TRP . . . . . 0.58 ' CH2' ' HA ' ' A' ' 741' ' ' PRO . 70.7 t-105 -68.24 100.64 1.06 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.759 -177.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.39 49.15 0.99 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.38 0.61 . . . . 0.0 109.805 178.659 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 759' ' ' GLY . . . . . 0.458 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -104.13 -131.34 7.15 Favored Glycine 0 N--CA 1.444 -0.768 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.396 178.827 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 2.9 ttm-85 -79.83 -50.41 10.56 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.102 177.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 761' ' ' ALA . . . . . 0.481 ' O ' ' HA ' ' A' ' 746' ' ' VAL . . . -166.93 157.87 12.07 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.256 179.065 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 762' ' ' VAL . . . . . 0.555 HG12 ' HA ' ' A' ' 780' ' ' GLU . 1.4 p -133.91 122.8 43.16 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 176.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 763' ' ' VAL . . . . . 0.541 HG12 HD21 ' A' ' 791' ' ' LEU . 41.8 t -114.71 115.11 48.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.291 -0.413 . . . . 0.0 109.904 -178.284 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 764' ' ' THR . . . . . 0.458 HG22 ' HA ' ' A' ' 752' ' ' VAL . 34.2 m -112.2 119.09 37.17 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.246 0.546 . . . . 0.0 111.321 -178.321 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 765' ' ' PHE . . . . . 0.607 ' HA ' ' O ' ' A' ' 783' ' ' HIS . 91.3 m-85 -84.06 98.0 9.62 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.372 175.163 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 766' ' ' CYS . . . . . 0.423 ' SG ' ' HA ' ' A' ' 751' ' ' GLU . 1.7 t -140.04 141.35 36.27 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -172.807 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 767' ' ' ARG . . . . . 0.502 ' HE ' ' HB3' ' A' ' 767' ' ' ARG . 0.0 OUTLIER -104.29 -31.03 9.76 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.026 174.654 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.92 -50.86 7.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.194 177.401 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . 0.569 ' HA ' ' CG2' ' A' ' 752' ' ' VAL . 12.3 p-80 46.93 88.22 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.331 1.052 . . . . 0.0 113.037 177.484 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 6.1 mt -78.05 -74.21 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.919 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 771' ' ' GLY . . . . . 0.607 ' H ' HG11 ' A' ' 752' ' ' VAL . . . -111.85 7.91 27.62 Favored Glycine 0 C--N 1.332 0.317 0 C-N-CA 120.485 -0.864 . . . . 0.0 114.375 -170.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 772' ' ' ILE . . . . . 0.754 ' HB ' HG22 ' A' ' 752' ' ' VAL . 43.2 mm -105.0 115.58 62.16 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 117.647 0.724 . . . . 0.0 110.397 176.307 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 773' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -90.63 -170.41 0.38 Allowed 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 123.769 2.98 . . . . 0.0 112.465 176.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -95.32 -158.22 0.63 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.509 178.041 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 775' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.49 61.92 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -179.085 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -121.56 22.15 10.71 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 167.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 777' ' ' ALA . . . . . 0.836 ' HB1' ' HD2' ' A' ' 778' ' ' PRO . . . -148.47 176.31 2.3 Favored Pre-proline 0 N--CA 1.451 -0.399 0 CA-C-N 113.611 -1.632 . . . . 0.0 108.794 -175.39 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 778' ' ' PRO . . . . . 0.836 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 51.8 Cg_endo -68.65 61.96 1.2 Allowed 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 122.702 2.268 . . . . 0.0 114.176 -178.807 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 102.02 22.26 10.2 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.611 -0.804 . . . . 0.0 113.764 173.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 780' ' ' GLU . . . . . 0.565 ' HB2' ' HB3' ' A' ' 777' ' ' ALA . 0.3 OUTLIER -79.57 125.28 29.39 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 117.111 0.456 . . . . 0.0 110.564 178.213 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 20.3 m95 -130.12 115.62 17.32 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.65 0.262 . . . . 0.0 110.429 179.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . 0.436 ' H ' HG21 ' A' ' 782' ' ' VAL . 0.1 OUTLIER -103.04 136.02 37.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 110.176 -0.305 . . . . 0.0 110.176 175.263 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 783' ' ' HIS . . . . . 0.607 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.2 OUTLIER -152.1 132.93 14.11 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.725 0.298 . . . . 0.0 110.827 179.202 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -99.44 100.24 11.26 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.982 0.42 . . . . 0.0 110.176 174.121 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -164.56 178.92 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.764 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -111.51 28.95 8.27 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.94 0.4 . . . . 0.0 110.187 175.106 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 57.82 70.54 1.26 Allowed Pre-proline 0 N--CA 1.465 0.285 0 CA-C-N 115.32 -0.855 . . . . 0.0 111.278 -178.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 788' ' ' PRO . . . . . 0.4 ' HB2' ' H ' ' A' ' 789' ' ' HIS . 5.3 Cg_exo -77.09 -96.34 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.724 2.283 . . . . 0.0 112.438 -178.34 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 789' ' ' HIS . . . . . 0.4 ' H ' ' HB2' ' A' ' 788' ' ' PRO . 0.2 OUTLIER -124.11 2.94 8.62 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.964 0.411 . . . . 0.0 111.717 -178.319 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 790' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -104.38 -46.66 4.33 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.669 -175.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 791' ' ' LEU . . . . . 0.58 ' HG ' ' CZ ' ' A' ' 765' ' ' PHE . 0.4 OUTLIER -62.91 -51.23 72.73 Favored Pre-proline 0 C--N 1.327 -0.382 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -178.803 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 792' ' ' PRO . . . . . 0.425 ' HD3' ' HB3' ' A' ' 791' ' ' LEU . 24.5 Cg_exo -60.95 -30.59 90.22 Favored 'Trans proline' 0 C--N 1.354 0.836 0 C-N-CA 121.445 1.43 . . . . 0.0 111.626 179.747 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -68.98 -45.49 70.5 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.413 176.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 794' ' ' LEU . . . . . 0.453 HD22 ' HA ' ' A' ' 794' ' ' LEU . 0.2 OUTLIER -63.78 -36.58 84.36 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.687 179.437 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 795' ' ' LEU . . . . . 0.413 HD11 HD13 ' A' ' 726' ' ' LEU . 0.4 OUTLIER -63.56 -47.61 80.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.771 179.622 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -66.14 -33.6 76.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.105 179.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 1.5 ttt-85 -71.05 -37.12 72.53 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.889 179.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -69.53 -31.45 49.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.827 -178.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 799' ' ' TYR . . . . . 0.55 ' HD1' ' HE3' ' A' ' 707' ' ' LYS . 17.3 m-85 -85.39 -0.43 54.82 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.578 178.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 47.7 mt . . . . . 0 N--CA 1.463 0.216 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.337 178.438 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.16 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 825' ' ' MET . . . . . 0.535 ' O ' ' HB2' ' A' ' 850' ' ' GLN . 0.1 OUTLIER -127.83 106.66 9.27 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.979 -176.767 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 826' ' ' MET . . . . . 0.4 ' H ' ' HG2' ' A' ' 826' ' ' MET . 0.0 OUTLIER -97.84 108.86 21.66 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.301 0.572 . . . . 0.0 111.3 -177.042 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 827' ' ' ILE . . . . . 0.658 HD11 ' HB ' ' A' ' 871' ' ' ILE . 9.6 mm -107.52 136.13 43.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.312 175.755 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 828' ' ' LEU . . . . . 0.457 ' HB2' HG12 ' A' ' 869' ' ' ILE . 46.2 tp -106.17 122.61 46.56 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.994 0.425 . . . . 0.0 110.541 -176.599 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 829' ' ' VAL . . . . . 0.604 ' HB ' ' HD2' ' A' ' 837' ' ' ARG . 0.8 OUTLIER -113.38 111.55 36.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.19 -179.361 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 830' ' ' VAL . . . . . . . . . . . . . 12.7 t -117.37 129.27 74.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.335 -179.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 831' ' ' ASP . . . . . 0.743 ' HB2' ' NE ' ' A' ' 837' ' ' ARG . 9.1 t0 -134.61 142.54 46.94 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 173.028 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 832' ' ' ASP . . . . . 0.4 ' HB2' ' HB2' ' A' ' 878' ' ' MET . 4.8 p-10 -65.98 -15.1 62.71 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.132 0.492 . . . . 0.0 110.432 174.108 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 22.1 m170 -117.41 104.99 49.21 Favored Pre-proline 0 C--O 1.234 0.268 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.486 171.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -57.67 -35.77 98.7 Favored 'Trans proline' 0 CA--C 1.532 0.392 0 C-N-CA 123.184 2.589 . . . . 0.0 113.799 -173.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 835' ' ' ILE . . . . . 0.505 ' O ' ' HG3' ' A' ' 838' ' ' ARG . 0.0 OUTLIER -59.55 -44.38 93.0 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-O 121.006 0.432 . . . . 0.0 111.199 -177.737 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 836' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -65.41 -40.09 92.95 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.248 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 837' ' ' ARG . . . . . 0.743 ' NE ' ' HB2' ' A' ' 831' ' ' ASP . 0.0 OUTLIER -64.97 -46.99 79.21 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.675 -177.028 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 838' ' ' ARG . . . . . 0.505 ' HG3' ' O ' ' A' ' 835' ' ' ILE . 0.3 OUTLIER -65.87 -29.13 69.53 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.839 0.352 . . . . 0.0 110.962 -179.28 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 8.5 mt -66.41 -52.56 45.31 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.944 -179.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 840' ' ' LEU . . . . . 0.401 HD22 ' CZ ' ' A' ' 837' ' ' ARG . 1.2 pp -72.68 -26.66 61.7 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.588 179.247 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -65.58 -33.28 75.55 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.008 0.433 . . . . 0.0 110.202 174.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -63.14 -43.5 98.2 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.045 175.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 843' ' ' GLN . . . . . 0.467 ' CB ' HD22 ' A' ' 929' ' ' LEU . 45.2 mm-40 -64.29 -39.73 94.52 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.387 176.565 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 844' ' ' LEU . . . . . 0.804 HD11 ' HB2' ' A' ' 849' ' ' TYR . 0.0 OUTLIER -61.15 -34.96 75.86 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.578 176.575 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -62.41 -39.0 97.22 Favored Glycine 0 N--CA 1.445 -0.72 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.003 176.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -70.32 -23.25 62.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.92 0.391 . . . . 0.0 110.985 176.514 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 847' ' ' LEU . . . . . 0.454 HD22 ' HA ' ' A' ' 847' ' ' LEU . 5.4 mt -78.81 -21.47 47.69 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.885 0.374 . . . . 0.0 111.127 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 102.21 12.15 34.55 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.662 -0.78 . . . . 0.0 113.545 174.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 849' ' ' TYR . . . . . 0.804 ' HB2' HD11 ' A' ' 844' ' ' LEU . 66.6 m-85 -104.68 138.4 41.04 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.958 0.379 . . . . 0.0 109.986 178.658 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 850' ' ' GLN . . . . . 0.535 ' HB2' ' O ' ' A' ' 825' ' ' MET . 4.7 mp0 -73.03 121.08 19.57 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 179.275 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 851' ' ' CYS . . . . . 0.459 ' SG ' ' HB3' ' A' ' 844' ' ' LEU . 0.0 OUTLIER -108.13 126.83 53.23 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 120.988 0.423 . . . . 0.0 111.607 -173.884 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.36 111.76 24.48 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 174.797 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -91.18 124.58 35.5 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 120.93 0.395 . . . . 0.0 111.451 -174.632 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 854' ' ' ALA . . . . . . . . . . . . . . . -130.11 142.28 50.61 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.961 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 855' ' ' ASN . . . . . 0.558 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 20.2 t30 -124.22 74.99 1.34 Allowed 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 177.026 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 856' ' ' ASP . . . . . 0.704 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 12.0 t70 166.14 147.37 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.036 177.043 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -71.9 -41.91 54.13 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.566 178.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 2.0 t -73.7 -34.7 41.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.077 0.465 . . . . 0.0 110.598 -178.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 859' ' ' ASP . . . . . 0.704 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 1.1 t0 -64.27 -27.74 69.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.939 -178.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -62.14 -38.39 88.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.139 0.495 . . . . 0.0 110.352 176.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 861' ' ' LEU . . . . . 0.485 HD23 HG23 ' A' ' 890' ' ' ILE . 0.2 OUTLIER -74.14 -33.01 63.39 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.93 176.933 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -60.56 -53.76 53.64 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.858 178.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 10.7 p -66.01 -32.21 57.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.769 0.318 . . . . 0.0 110.945 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 864' ' ' LEU . . . . . 0.539 HD21 ' HA ' ' A' ' 864' ' ' LEU . 0.6 OUTLIER -62.99 -40.46 97.82 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.565 176.578 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 7.4 m -74.31 -27.28 60.64 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.862 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 866' ' ' LYS . . . . . 0.522 ' HA ' ' HD2' ' A' ' 866' ' ' LYS . 1.3 tptm -69.79 -55.85 8.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.716 179.532 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 867' ' ' ASN . . . . . 0.456 ' HB3' ' H ' ' A' ' 868' ' ' HIS . 6.0 t30 -119.15 -105.5 0.39 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.905 178.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 868' ' ' HIS . . . . . 0.456 ' H ' ' HB3' ' A' ' 867' ' ' ASN . 0.1 OUTLIER 178.93 155.54 0.45 Allowed 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 178.571 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 869' ' ' ILE . . . . . 0.457 HG12 ' HB2' ' A' ' 828' ' ' LEU . 0.7 OUTLIER -143.25 147.98 19.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 -179.794 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.69 -49.98 5.13 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.694 0.283 . . . . 0.0 111.356 -178.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 871' ' ' ILE . . . . . 0.658 ' HB ' HD11 ' A' ' 827' ' ' ILE . 18.7 mm -111.54 123.98 67.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.272 -178.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 872' ' ' VAL . . . . . 0.52 HG21 HD12 ' A' ' 897' ' ' LEU . 1.8 t -109.52 125.92 66.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.217 -179.086 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 873' ' ' LEU . . . . . 0.676 HD11 HD11 ' A' ' 936' ' ' LEU . 47.3 mt -111.49 100.83 9.32 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 173.456 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 5.7 m -105.77 101.49 11.0 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.939 0.4 . . . . 0.0 111.22 -176.206 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 875' ' ' ASP . . . . . 0.663 ' OD1' ' HG2' ' A' ' 925' ' ' LYS . 0.6 OUTLIER -92.62 106.6 18.55 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.383 -179.517 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 876' ' ' VAL . . . . . 0.412 ' H ' HG21 ' A' ' 876' ' ' VAL . 0.1 OUTLIER -115.45 111.99 37.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.314 0.578 . . . . 0.0 112.134 -172.25 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -119.65 -44.59 2.54 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.664 172.044 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 878' ' ' MET . . . . . 0.4 ' HB2' ' HB2' ' A' ' 832' ' ' ASP . 4.4 tpp . . . . . 0 CA--C 1.537 0.443 0 CA-C-N 115.559 -0.746 . . . . 0.0 112.699 -178.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 0.273 0 N-CA-C 112.047 -0.421 . . . . 0.0 112.047 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -137.22 -40.91 0.58 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -68.47 -47.33 67.39 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.677 -179.017 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 886' ' ' LEU . . . . . 0.635 ' HG ' ' N ' ' A' ' 887' ' ' THR . 0.0 OUTLIER -65.55 -43.55 89.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.646 -0.252 . . . . 0.0 110.384 -179.495 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 887' ' ' THR . . . . . 0.635 ' N ' ' HG ' ' A' ' 886' ' ' LEU . 0.0 OUTLIER -62.52 -44.89 95.25 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.218 0.532 . . . . 0.0 110.662 -179.483 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 888' ' ' GLN . . . . . 0.78 ' HA ' ' HD3' ' A' ' 891' ' ' ARG . 15.9 tt0 -63.47 -41.31 98.61 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.624 177.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -67.27 -41.66 85.13 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.192 0.441 . . . . 0.0 112.192 -175.185 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 890' ' ' ILE . . . . . 0.612 HG13 ' O ' ' A' ' 886' ' ' LEU . 22.2 mt -68.54 -42.63 83.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.881 -179.478 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 891' ' ' ARG . . . . . 0.78 ' HD3' ' HA ' ' A' ' 888' ' ' GLN . 0.7 OUTLIER -68.92 -23.93 64.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.032 0.444 . . . . 0.0 110.216 177.262 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 -71.18 -42.14 69.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.367 176.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 893' ' ' LEU . . . . . 0.461 ' HA ' HD22 ' A' ' 893' ' ' LEU . 0.2 OUTLIER -71.26 -32.8 69.14 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.183 179.071 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 115.66 87.5 1.41 Allowed Glycine 0 N--CA 1.441 -1.017 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.747 178.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 895' ' ' LEU . . . . . 0.562 HD12 HG22 ' A' ' 899' ' ' VAL . 0.3 OUTLIER -63.74 109.27 1.66 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.125 0.488 . . . . 0.0 110.602 177.781 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -120.77 16.95 11.9 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.805 0.812 . . . . 0.0 109.469 176.284 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 897' ' ' LEU . . . . . 0.52 HD12 HG21 ' A' ' 872' ' ' VAL . 0.0 OUTLIER -139.06 123.88 11.63 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 114.801 -1.09 . . . . 0.0 109.283 -176.665 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 898' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 897' ' ' LEU . 35.5 Cg_exo -59.28 121.41 9.86 Favored 'Trans proline' 0 C--O 1.238 0.494 0 C-N-CA 122.888 2.392 . . . . 0.0 112.305 -177.69 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 899' ' ' VAL . . . . . 0.601 HG13 ' HG2' ' A' ' 919' ' ' MET . 26.5 t -98.36 108.68 22.45 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 CA-C-O 121.257 0.551 . . . . 0.0 110.639 -179.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 900' ' ' ILE . . . . . 0.534 HD11 HD23 ' A' ' 873' ' ' LEU . 2.5 mt -84.41 92.42 3.11 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 175.445 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 901' ' ' GLY . . . . . 0.694 ' HA3' ' SD ' ' A' ' 919' ' ' MET . . . -83.4 122.41 5.77 Favored Glycine 0 N--CA 1.441 -1.026 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.075 -176.093 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 902' ' ' VAL . . . . . 0.661 ' HB ' ' HB2' ' A' ' 923' ' ' LEU . 0.2 OUTLIER -111.57 117.09 54.28 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 178.459 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 903' ' ' THR . . . . . 0.71 ' HB ' ' HB2' ' A' ' 906' ' ' ALA . 0.0 OUTLIER -107.64 148.88 28.77 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.917 -172.271 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 904' ' ' ALA . . . . . 0.659 ' HB1' ' HG3' ' A' ' 925' ' ' LYS . . . -90.51 134.51 34.31 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.494 175.538 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 53.69 43.26 31.34 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.298 179.627 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 906' ' ' ALA . . . . . 0.71 ' HB2' ' HB ' ' A' ' 903' ' ' THR . . . -92.25 93.76 8.82 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.059 177.245 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -52.33 -49.11 64.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.254 -178.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -127.06 88.56 2.83 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.103 176.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 909' ' ' GLU . . . . . 0.676 ' HB3' ' HB2' ' A' ' 922' ' ' CYS . 10.7 mt-10 -57.85 -34.97 70.28 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.179 -176.865 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 910' ' ' GLU . . . . . 0.434 ' H ' ' HG3' ' A' ' 910' ' ' GLU . 0.0 OUTLIER -58.78 -57.03 14.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.998 178.638 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 8.0 tttt -65.52 -27.93 68.82 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.197 179.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -62.91 -44.96 94.67 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 176.022 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 913' ' ' ARG . . . . . 0.492 ' O ' ' HD2' ' A' ' 913' ' ' ARG . 0.0 OUTLIER -65.63 -37.9 87.86 Favored 'General case' 0 C--O 1.225 -0.201 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.053 175.999 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 19.0 m -58.66 -37.16 75.39 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.871 0.367 . . . . 0.0 110.937 177.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.84 -51.23 42.69 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.755 -178.206 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 916' ' ' GLU . . . . . 0.429 ' OE2' ' HD3' ' A' ' 913' ' ' ARG . 0.0 OUTLIER -77.11 -42.64 37.18 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 111.627 0.232 . . . . 0.0 111.627 -175.219 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 1.4 m 53.06 52.15 14.35 Favored 'General case' 0 C--O 1.235 0.32 0 O-C-N 123.464 0.478 . . . . 0.0 112.149 -178.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -139.66 -32.8 0.17 Allowed Glycine 0 CA--C 1.523 0.578 0 C-N-CA 120.51 -0.853 . . . . 0.0 113.745 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 919' ' ' MET . . . . . 0.694 ' SD ' ' HA3' ' A' ' 901' ' ' GLY . 20.2 mtt -76.58 -93.54 0.03 OUTLIER 'General case' 0 C--O 1.238 0.488 0 CA-C-N 117.311 0.556 . . . . 0.0 112.171 -174.311 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 920' ' ' ASP . . . . . 0.507 ' HB2' ' O ' ' A' ' 919' ' ' MET . 45.0 t0 162.29 -73.16 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.191 0.996 . . . . 0.0 109.643 176.705 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -105.91 172.02 7.03 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.054 -179.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 922' ' ' CYS . . . . . 0.676 ' HB2' ' HB3' ' A' ' 909' ' ' GLU . 0.8 OUTLIER -140.42 136.78 33.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.292 0.568 . . . . 0.0 111.881 -178.278 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 923' ' ' LEU . . . . . 0.661 ' HB2' ' HB ' ' A' ' 902' ' ' VAL . 0.3 OUTLIER -133.73 178.21 7.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.192 177.158 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 924' ' ' SER . . . . . 0.492 ' O ' HG23 ' A' ' 927' ' ' VAL . 0.8 OUTLIER -104.18 143.1 33.39 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.268 178.594 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 925' ' ' LYS . . . . . 0.663 ' HG2' ' OD1' ' A' ' 875' ' ' ASP . 0.0 OUTLIER -48.63 -43.5 63.11 Favored Pre-proline 0 N--CA 1.475 0.823 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -176.034 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 926' ' ' PRO . . . . . 0.506 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 37.7 Cg_endo -66.71 68.44 0.51 Allowed 'Trans proline' 0 C--N 1.356 0.929 0 C-N-CA 121.885 1.723 . . . . 0.0 112.998 175.441 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 927' ' ' VAL . . . . . 0.616 HG12 ' HB ' ' A' ' 931' ' ' VAL . 42.3 t -87.8 110.67 21.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.038 0.447 . . . . 0.0 110.425 177.225 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.36 167.49 20.16 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.29 176.074 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 929' ' ' LEU . . . . . 0.486 HD21 ' HA ' ' A' ' 929' ' ' LEU . 0.7 OUTLIER -54.62 -38.66 67.09 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.69 0.281 . . . . 0.0 111.604 -177.975 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -68.72 -23.35 64.34 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.854 0.359 . . . . 0.0 110.747 -177.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 931' ' ' VAL . . . . . 0.616 ' HB ' HG12 ' A' ' 927' ' ' VAL . 18.4 t -78.13 -41.57 26.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.418 179.062 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 932' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -66.64 -37.16 78.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 177.277 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -60.7 -49.05 79.08 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.439 -179.503 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 934' ' ' GLN . . . . . 0.484 ' HG3' ' H ' ' A' ' 935' ' ' THR . 0.3 OUTLIER -71.74 -48.96 43.45 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -175.941 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 935' ' ' THR . . . . . 0.484 ' H ' ' HG3' ' A' ' 934' ' ' GLN . 1.6 m -66.73 -43.4 84.32 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 111.828 0.307 . . . . 0.0 111.828 -174.363 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 936' ' ' LEU . . . . . 0.676 HD11 HD11 ' A' ' 873' ' ' LEU . 0.3 OUTLIER -66.23 -49.92 65.6 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.636 0.255 . . . . 0.0 110.812 -179.577 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 95.0 m -62.2 -46.06 90.61 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.25 -178.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 938' ' ' LEU . . . . . 0.457 ' O ' ' HB3' ' A' ' 942' ' ' ARG . 29.3 tp -62.82 -47.77 81.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.182 -178.46 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 939' ' ' TYR . . . . . 0.409 ' HB3' HD13 ' A' ' 871' ' ' ILE . 0.2 OUTLIER -69.26 -40.73 77.67 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.613 -0.267 . . . . 0.0 111.171 -177.097 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 940' ' ' ALA . . . . . 0.49 ' O ' HG21 ' A' ' 943' ' ' VAL . . . -66.36 -40.98 90.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.737 0.303 . . . . 0.0 111.006 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 941' ' ' GLU . . . . . 0.575 ' O ' ' HG3' ' A' ' 944' ' ' ARG . 0.0 OUTLIER -69.99 -33.8 72.51 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.87 0.366 . . . . 0.0 110.216 178.473 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 942' ' ' ARG . . . . . 0.457 ' HB3' ' O ' ' A' ' 938' ' ' LEU . 0.0 OUTLIER -66.84 -37.7 84.98 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.446 -178.511 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 943' ' ' VAL . . . . . 0.49 HG21 ' O ' ' A' ' 940' ' ' ALA . 17.1 m -78.08 -33.8 18.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.646 -0.422 . . . . 0.0 110.954 -177.496 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 944' ' ' ARG . . . . . 0.575 ' HG3' ' O ' ' A' ' 941' ' ' GLU . 0.2 OUTLIER -73.56 -21.63 60.3 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.32 177.42 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 16.0 mmtp -67.32 -52.4 40.79 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-O 121.33 0.586 . . . . 0.0 109.885 171.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 50.3 m -63.5 -44.32 94.67 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.123 -0.944 . . . . 0.0 111.428 -177.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -68.38 -60.94 2.07 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.77 -0.196 . . . . 0.0 110.51 178.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 6.7 t70 . . . . . 0 N--CA 1.472 0.647 0 C-N-CA 123.724 0.81 . . . . 0.0 112.79 175.624 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 705' ' ' SER . . . . . 0.462 ' HA ' ' C ' ' A' ' 730' ' ' GLY . 0.8 OUTLIER . . . . . 0 N--CA 1.455 -0.203 0 CA-C-O 120.63 0.252 . . . . 0.0 111.012 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 108.51 -36.13 4.54 Favored Glycine 0 CA--C 1.52 0.355 0 C-N-CA 120.384 -0.912 . . . . 0.0 114.037 171.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 707' ' ' LYS . . . . . 0.462 ' O ' HG11 ' A' ' 732' ' ' VAL . 7.2 mmmt -75.4 155.61 36.23 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 117.011 0.406 . . . . 0.0 111.624 -174.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 708' ' ' ARG . . . . . 0.545 ' HD3' HG12 ' A' ' 732' ' ' VAL . 0.3 OUTLIER -97.63 149.32 22.38 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.875 178.585 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -134.88 131.7 37.65 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 177.454 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 710' ' ' TRP . . . . . 0.463 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 70.4 m95 -105.06 124.72 50.01 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.901 0.382 . . . . 0.0 110.679 -177.715 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 711' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -120.51 138.97 53.55 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.198 0.523 . . . . 0.0 111.046 -179.257 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 712' ' ' ALA . . . . . 0.682 ' HB3' HG22 ' A' ' 749' ' ' THR . . . -124.6 67.39 1.09 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.125 176.002 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 713' ' ' VAL . . . . . 0.747 HG11 ' HB3' ' A' ' 750' ' ' ASP . 41.4 t -122.39 122.44 66.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.277 -177.617 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 714' ' ' ARG . . . . . 0.461 ' HB2' HH11 ' A' ' 714' ' ' ARG . 0.1 OUTLIER -86.74 -25.29 24.79 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 176.271 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -67.63 104.53 1.63 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.274 178.271 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 716' ' ' ALA . . . . . 0.625 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -60.45 -43.25 97.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.065 -0.516 . . . . 0.0 112.0 -173.071 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.02 -39.64 95.36 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.193 0.521 . . . . 0.0 110.524 179.538 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 718' ' ' LEU . . . . . 0.504 HD11 ' HA ' ' A' ' 786' ' ' ALA . 0.3 OUTLIER -73.04 -49.57 27.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.155 -178.032 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 719' ' ' CYS . . . . . 0.718 ' HB3' ' HB ' ' A' ' 713' ' ' VAL . 28.4 p -64.79 -40.59 95.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.556 -177.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 720' ' ' GLN . . . . . 0.541 ' HB2' ' O ' ' A' ' 716' ' ' ALA . 0.0 OUTLIER -63.23 -40.39 97.31 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.382 -179.543 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -57.68 -48.76 78.63 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.958 0.409 . . . . 0.0 110.47 178.842 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 722' ' ' LEU . . . . . 0.455 ' O ' ' HG ' ' A' ' 726' ' ' LEU . 6.4 mt -67.66 -48.19 67.34 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.58 -178.342 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 723' ' ' GLU . . . . . 0.566 ' HA ' HG13 ' A' ' 733' ' ' VAL . 0.0 OUTLIER -62.57 -43.97 97.5 Favored 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 111.579 0.214 . . . . 0.0 111.579 -174.126 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 724' ' ' THR . . . . . 0.497 ' O ' ' HB3' ' A' ' 728' ' ' ARG . 28.1 m -64.83 -39.26 93.29 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.715 0.293 . . . . 0.0 110.811 -179.613 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 44.0 m -65.38 -32.57 74.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.783 0.325 . . . . 0.0 111.388 179.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 726' ' ' LEU . . . . . 0.756 HD22 HD12 ' A' ' 731' ' ' ILE . 24.9 mt -81.95 -47.9 12.14 Favored 'General case' 0 C--N 1.322 -0.626 0 O-C-N 122.208 -0.307 . . . . 0.0 110.921 -178.418 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 727' ' ' GLN . . . . . 0.435 ' HG2' ' HA ' ' A' ' 724' ' ' THR . 3.1 pt20 -67.92 -25.08 65.3 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.527 -177.283 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 728' ' ' ARG . . . . . 0.497 ' HB3' ' O ' ' A' ' 724' ' ' THR . 0.0 OUTLIER -64.03 -31.37 72.54 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 121.114 0.483 . . . . 0.0 110.304 178.303 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -85.67 -51.01 6.75 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.378 179.047 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 730' ' ' GLY . . . . . 0.462 ' C ' ' HA ' ' A' ' 705' ' ' SER . . . 154.32 -6.29 0.33 Allowed Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.508 -0.853 . . . . 0.0 112.689 178.448 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 731' ' ' ILE . . . . . 0.756 HD12 HD22 ' A' ' 726' ' ' LEU . 0.2 OUTLIER -75.3 114.08 14.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 176.604 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 732' ' ' VAL . . . . . 0.545 HG12 ' HD3' ' A' ' 708' ' ' ARG . 2.1 p -74.58 113.96 13.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 121.719 0.771 . . . . 0.0 110.78 -176.377 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 733' ' ' VAL . . . . . 0.566 HG13 ' HA ' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -85.94 136.88 21.92 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.861 -179.21 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -145.36 137.7 25.79 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.483 177.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -61.47 124.86 21.81 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 173.81 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 736' ' ' TYR . . . . . 0.463 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 47.2 t80 -55.71 -47.05 77.49 Favored 'General case' 0 C--O 1.232 0.17 0 O-C-N 123.242 0.339 . . . . 0.0 110.278 -179.259 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 54.61 -108.78 0.45 Allowed 'General case' 0 CA--C 1.53 0.183 0 O-C-N 123.728 0.643 . . . . 0.0 110.431 177.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -129.62 37.67 2.13 Favored Glycine 0 N--CA 1.445 -0.743 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 176.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -84.19 -172.48 4.18 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.002 0.43 . . . . 0.0 111.31 -177.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.61 126.89 54.59 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.977 -178.888 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 741' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -71.61 123.46 9.46 Favored 'Trans proline' 0 N--CA 1.462 -0.345 0 C-N-CA 122.612 2.208 . . . . 0.0 111.876 175.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 742' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.47 134.93 19.49 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-O 120.699 0.285 . . . . 0.0 111.066 179.691 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 743' ' ' PRO . . . . . 0.516 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 57.3 Cg_endo -71.15 3.72 3.27 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 123.102 2.535 . . . . 0.0 112.464 179.419 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -109.95 -12.29 14.57 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.714 178.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 85.2 m-20 -114.47 165.44 12.74 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.722 -172.106 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 746' ' ' VAL . . . . . 0.551 HG23 HD22 ' A' ' 795' ' ' LEU . 18.8 m -117.1 148.43 19.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.965 -175.334 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 747' ' ' LEU . . . . . 0.507 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 0.3 OUTLIER -104.72 113.27 26.75 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.91 175.764 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 3.7 mt -97.45 113.53 32.16 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 175.19 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 749' ' ' THR . . . . . 0.682 HG22 ' HB3' ' A' ' 712' ' ' ALA . 0.0 OUTLIER -114.77 164.74 13.65 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.576 -170.089 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 750' ' ' ASP . . . . . 0.747 ' HB3' HG11 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -125.62 123.35 38.81 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 168.548 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 751' ' ' GLU . . . . . 0.859 ' HG2' HH21 ' A' ' 767' ' ' ARG . 0.0 OUTLIER 61.95 176.84 0.13 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.681 -172.8 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 752' ' ' VAL . . . . . 0.509 HG21 ' HB ' ' A' ' 772' ' ' ILE . 2.6 p -69.86 131.76 33.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.402 -176.182 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 753' ' ' VAL . . . . . 0.505 HG13 HD13 ' A' ' 772' ' ' ILE . 4.4 p -120.41 164.69 16.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.161 179.36 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.2 50.29 1.91 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.879 0.371 . . . . 0.0 111.023 -179.531 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -152.71 132.17 12.95 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.149 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 6.2 tptp -89.97 -18.76 25.44 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.886 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 757' ' ' TRP . . . . . 0.507 ' CD2' ' HB2' ' A' ' 747' ' ' LEU . 73.7 t-105 67.37 96.98 0.06 Allowed 'General case' 0 C--O 1.234 0.248 0 C-N-CA 123.237 0.615 . . . . 0.0 111.928 176.558 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 32.3 tp60 -86.84 58.15 4.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.445 0.641 . . . . 0.0 109.789 173.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 759' ' ' GLY . . . . . 0.516 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -119.25 -147.29 8.06 Favored Glycine 0 N--CA 1.443 -0.834 0 CA-C-N 115.696 -0.684 . . . . 0.0 112.016 -179.075 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 5.3 ttm180 -77.01 -59.74 2.65 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.204 0.526 . . . . 0.0 109.922 177.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -152.88 155.12 36.44 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.0 -179.154 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 2.7 p -128.07 128.53 68.94 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 177.046 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -118.09 102.94 13.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.48 -178.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 764' ' ' THR . . . . . 0.491 ' HB ' HG22 ' A' ' 782' ' ' VAL . 91.0 m -100.66 124.45 46.27 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.798 -0.637 . . . . 0.0 112.022 -174.693 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 765' ' ' PHE . . . . . 0.556 ' HA ' ' O ' ' A' ' 783' ' ' HIS . 34.5 m-85 -79.79 78.49 6.37 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.539 173.345 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 766' ' ' CYS . . . . . 0.44 ' HB2' HG21 ' A' ' 782' ' ' VAL . 0.0 OUTLIER -106.93 133.24 51.88 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.327 -172.195 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 767' ' ' ARG . . . . . 0.859 HH21 ' HG2' ' A' ' 751' ' ' GLU . 0.0 OUTLIER -111.0 -24.62 10.25 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 174.06 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -103.41 -71.33 0.73 Allowed 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.084 175.584 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . 0.668 ' HB2' HG22 ' A' ' 772' ' ' ILE . 0.0 OUTLIER 66.6 129.0 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 122.112 0.958 . . . . 0.0 112.377 179.735 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 6.4 mt -128.66 -79.96 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.021 -0.991 . . . . 0.0 109.681 176.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -82.69 -21.2 60.19 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.932 -0.651 . . . . 0.0 111.846 177.327 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 772' ' ' ILE . . . . . 0.668 HG22 ' HB2' ' A' ' 769' ' ' HIS . 0.3 OUTLIER -67.45 141.91 95.99 Favored Pre-proline 0 C--O 1.237 0.405 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 176.395 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 773' ' ' PRO . . . . . 0.412 ' HB2' ' H ' ' A' ' 774' ' ' LEU . 87.8 Cg_endo -91.05 -143.41 0.02 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.098 0 C-N-CA 123.156 2.57 . . . . 0.0 113.22 -174.04 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . 0.49 ' HA ' ' HB ' ' A' ' 782' ' ' VAL . 0.4 OUTLIER -176.24 -172.26 0.47 Allowed 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 -177.729 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 775' ' ' GLU . . . . . 0.54 ' HA ' ' O ' ' A' ' 780' ' ' GLU . 0.6 OUTLIER -65.81 52.73 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 113.021 0.748 . . . . 0.0 113.021 175.745 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.3 -21.55 23.11 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 169.624 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -133.03 157.68 77.75 Favored Pre-proline 0 N--CA 1.449 -0.482 0 CA-C-N 114.382 -1.281 . . . . 0.0 108.443 174.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -68.58 -4.3 12.81 Favored 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 122.552 2.168 . . . . 0.0 114.089 -173.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . -112.58 -4.0 25.16 Favored Glycine 0 N--CA 1.453 -0.167 0 C-N-CA 120.575 -0.821 . . . . 0.0 112.358 -176.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 780' ' ' GLU . . . . . 0.54 ' O ' ' HA ' ' A' ' 775' ' ' GLU . 6.7 mt-10 -118.86 125.45 49.55 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 -179.167 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 781' ' ' TRP . . . . . 0.448 ' CZ3' HD13 ' A' ' 794' ' ' LEU . 15.2 m95 -130.25 147.16 51.94 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 -177.717 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . 0.491 HG22 ' HB ' ' A' ' 764' ' ' THR . 0.4 OUTLIER -142.69 145.94 22.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-O 120.848 0.356 . . . . 0.0 110.5 179.46 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 783' ' ' HIS . . . . . 0.556 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 2.1 t-160 -157.5 135.96 11.24 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.975 178.278 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -98.21 100.85 12.18 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.404 175.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 785' ' ' VAL . . . . . 0.477 ' HB ' ' HD3' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -163.21 -172.9 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 179.937 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 786' ' ' ALA . . . . . 0.504 ' HA ' HD11 ' A' ' 718' ' ' LEU . . . -117.66 39.28 3.37 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.639 177.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 787' ' ' ALA . . . . . 0.421 ' N ' ' HD3' ' A' ' 788' ' ' PRO . . . 57.87 61.94 5.46 Favored Pre-proline 0 N--CA 1.463 0.213 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.632 -179.186 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 788' ' ' PRO . . . . . 0.477 ' HD3' ' HB ' ' A' ' 785' ' ' VAL . 19.3 Cg_exo -66.93 -65.51 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.433 2.089 . . . . 0.0 111.979 -177.448 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -171.63 -16.61 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 178.17 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 790' ' ' GLU . . . . . . . . . . . . . 6.3 pm0 -76.15 -35.46 59.19 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 121.006 -0.278 . . . . 0.0 111.407 -173.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 791' ' ' LEU . . . . . 0.472 ' N ' ' HD2' ' A' ' 792' ' ' PRO . 0.2 OUTLIER -73.31 -50.18 6.47 Favored Pre-proline 0 CA--C 1.533 0.308 0 CA-C-O 119.489 -0.291 . . . . 0.0 111.77 -179.128 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 792' ' ' PRO . . . . . 0.472 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 11.0 Cg_endo -57.37 -32.87 95.12 Favored 'Trans proline' 0 C--N 1.357 1.024 0 C-N-CA 121.7 1.6 . . . . 0.0 112.212 175.216 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -70.93 -44.27 66.5 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.952 0.406 . . . . 0.0 110.678 177.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 794' ' ' LEU . . . . . 0.448 HD13 ' CZ3' ' A' ' 781' ' ' TRP . 1.5 tm? -61.9 -40.47 95.56 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.506 178.452 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 795' ' ' LEU . . . . . 0.551 HD22 HG23 ' A' ' 746' ' ' VAL . 0.0 OUTLIER -65.13 -34.7 79.01 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.119 -179.453 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -61.4 -41.73 97.6 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.255 0.55 . . . . 0.0 110.021 176.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 2.7 ttt-85 -71.28 -32.37 68.59 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.734 178.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 798' ' ' ILE . . . . . 0.472 HG23 HD11 ' A' ' 798' ' ' ILE . 2.8 mt -66.22 -45.75 89.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.826 179.628 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -75.17 -43.55 51.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.149 -176.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 4.9 mt . . . . . 0 C--O 1.236 0.366 0 O-C-N 123.644 0.59 . . . . 0.0 111.534 179.022 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 25.6 t0 . . . . . 0 N--CA 1.456 -0.14 0 CA-C-O 121.076 0.465 . . . . 0.0 110.884 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -107.6 135.34 49.22 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.404 175.292 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 826' ' ' MET . . . . . 0.642 ' HG3' ' HA ' ' A' ' 869' ' ' ILE . 0.4 OUTLIER -115.76 124.11 49.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.277 0.56 . . . . 0.0 111.587 -173.684 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 827' ' ' ILE . . . . . . . . . . . . . 3.1 mm -117.34 138.77 46.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.086 178.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 828' ' ' LEU . . . . . 0.759 HD11 HD11 ' A' ' 869' ' ' ILE . 0.5 OUTLIER -105.21 122.39 45.82 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.727 0.299 . . . . 0.0 110.728 179.309 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -104.31 100.82 11.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.993 176.19 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 830' ' ' VAL . . . . . . . . . . . . . 5.1 t -109.04 112.2 39.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.304 -179.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 831' ' ' ASP . . . . . 0.747 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 11.5 t0 -121.58 142.94 49.61 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 178.778 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 832' ' ' ASP . . . . . 0.431 ' HB3' HG13 ' A' ' 876' ' ' VAL . 0.0 OUTLIER -78.75 -21.01 48.6 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.699 -178.765 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 15.7 m80 -114.31 109.85 48.49 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.132 177.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -51.13 -38.57 60.69 Favored 'Trans proline' 0 CA--C 1.531 0.368 0 C-N-CA 123.766 2.978 . . . . 0.0 114.668 -173.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 835' ' ' ILE . . . . . 0.438 HG23 ' N ' ' A' ' 836' ' ' ASN . 0.0 OUTLIER -64.19 -38.99 83.92 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-O 121.223 0.535 . . . . 0.0 110.678 -179.275 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 836' ' ' ASN . . . . . 0.61 ' ND2' ' HZ2' ' A' ' 925' ' ' LYS . 4.7 t30 -73.57 -37.83 65.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.613 178.41 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 837' ' ' ARG . . . . . 0.747 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 16.2 ttp180 -55.83 -44.34 77.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.448 176.579 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 7.1 ttm180 -59.18 -41.78 89.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.789 178.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 1.7 tp -58.88 -52.6 65.02 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.744 -179.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 840' ' ' LEU . . . . . 0.633 HD13 ' HA ' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -72.99 -30.44 63.8 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 120.79 -0.364 . . . . 0.0 111.597 -177.476 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -66.44 -37.55 85.43 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.097 0.475 . . . . 0.0 110.702 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -67.9 -41.04 83.33 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.301 178.042 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 843' ' ' GLN . . . . . 0.659 ' HG3' HD22 ' A' ' 929' ' ' LEU . 0.5 OUTLIER -62.74 -50.8 69.63 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.679 178.459 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 844' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.48 -35.78 74.75 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.993 178.038 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -62.97 -35.01 91.49 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.058 177.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 4.2 m -76.64 -26.81 55.3 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.873 0.368 . . . . 0.0 110.521 178.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 847' ' ' LEU . . . . . 0.653 HD22 ' HG2' ' A' ' 933' ' ' LYS . 3.6 mp -63.13 -33.68 75.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.013 177.503 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 97.59 26.91 9.49 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.692 -0.765 . . . . 0.0 112.918 176.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 849' ' ' TYR . . . . . 0.411 ' HE2' HD21 ' A' ' 847' ' ' LEU . 38.9 m-85 -112.09 155.77 23.32 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 176.863 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -69.08 118.0 11.43 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 178.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -107.3 126.19 52.12 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.16 0.505 . . . . 0.0 111.399 -173.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -111.0 140.44 45.53 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 171.633 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -118.31 144.05 46.14 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 120.559 -0.456 . . . . 0.0 111.643 -174.013 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 854' ' ' ALA . . . . . . . . . . . . . . . -149.21 150.55 32.8 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.157 178.024 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 855' ' ' ASN . . . . . 0.544 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 13.6 t-20 -133.84 74.97 1.57 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.399 175.572 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 856' ' ' ASP . . . . . 0.631 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 4.1 t70 165.53 170.44 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.118 -0.946 . . . . 0.0 108.836 -178.302 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -92.73 -47.29 3.22 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.865 -0.683 . . . . 0.0 111.922 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -71.67 -31.1 40.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.984 0.421 . . . . 0.0 110.661 -178.955 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 859' ' ' ASP . . . . . 0.631 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 0.3 OUTLIER -64.23 -35.4 80.68 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.007 -179.53 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 860' ' ' ALA . . . . . 0.418 ' O ' HG22 ' A' ' 863' ' ' VAL . . . -68.34 -33.64 74.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.181 0.515 . . . . 0.0 110.49 178.65 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 861' ' ' LEU . . . . . . . . . . . . . 15.3 tp -73.59 -32.37 64.07 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.596 179.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 -62.82 -47.12 84.8 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.816 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 863' ' ' VAL . . . . . 0.418 HG22 ' O ' ' A' ' 860' ' ' ALA . 0.3 OUTLIER -68.81 -31.27 50.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 C-N-CA 120.861 -0.336 . . . . 0.0 110.61 177.915 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 864' ' ' LEU . . . . . 0.413 HD21 ' HA ' ' A' ' 864' ' ' LEU . 1.0 OUTLIER -60.84 -34.84 75.19 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 120.704 0.288 . . . . 0.0 111.138 179.118 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.89 -33.41 34.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.929 0.395 . . . . 0.0 110.482 179.426 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.14 -46.15 78.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.525 179.613 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -144.39 129.33 18.45 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 176.855 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 10.0 t-80 -70.7 88.36 0.71 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.8 0.333 . . . . 0.0 111.291 -177.335 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 869' ' ' ILE . . . . . 0.759 HD11 HD11 ' A' ' 828' ' ' LEU . 1.4 mp -65.43 139.91 20.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.524 174.101 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 35.6 m-20 -73.91 -60.34 2.3 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.066 -172.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 871' ' ' ILE . . . . . 0.562 HD11 ' HB3' ' A' ' 939' ' ' TYR . 8.0 mm -117.43 128.61 74.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.223 -178.482 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 872' ' ' VAL . . . . . 0.48 HG21 HD12 ' A' ' 828' ' ' LEU . 48.1 t -115.33 125.72 72.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.34 179.324 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 873' ' ' LEU . . . . . 0.537 HD21 HD13 ' A' ' 936' ' ' LEU . 0.1 OUTLIER -109.13 121.73 45.77 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 178.956 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -106.78 96.49 6.48 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.033 178.202 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 875' ' ' ASP . . . . . 0.552 ' HA ' HG11 ' A' ' 902' ' ' VAL . 22.1 t0 -97.89 110.29 22.89 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.719 179.388 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 876' ' ' VAL . . . . . 0.431 HG13 ' HB3' ' A' ' 832' ' ' ASP . 0.0 OUTLIER -121.89 132.1 71.64 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.41 -173.591 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -99.52 12.2 37.09 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.773 0.797 . . . . 0.0 108.879 171.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 6.0 ttm . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 114.68 -1.146 . . . . 0.0 110.27 179.228 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.603 0 N-CA-C 111.368 -0.693 . . . . 0.0 111.368 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -84.43 -32.43 24.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.519 0.676 . . . . 0.0 109.425 -178.246 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.55 -32.77 63.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.796 178.019 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 4.1 tp -67.06 -51.52 53.56 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.753 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -45.26 92.79 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.213 -178.557 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 888' ' ' GLN . . . . . 0.547 ' HA ' ' HD3' ' A' ' 891' ' ' ARG . 7.7 tp-100 -56.98 -42.6 80.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.164 0.506 . . . . 0.0 110.737 178.609 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.97 -38.65 66.62 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.077 -178.613 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 890' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -69.98 -37.13 71.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.726 0.298 . . . . 0.0 111.203 -176.682 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 891' ' ' ARG . . . . . 0.547 ' HD3' ' HA ' ' A' ' 888' ' ' GLN . 1.9 ptm180 -74.15 -28.7 61.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.824 0.345 . . . . 0.0 110.613 178.005 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -78.07 -27.99 48.74 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.075 0.464 . . . . 0.0 110.752 178.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -80.59 -11.34 59.66 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.239 179.448 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 86.28 56.93 2.19 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.294 178.271 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 895' ' ' LEU . . . . . 0.503 HD22 ' HA ' ' A' ' 891' ' ' ARG . 0.2 OUTLIER -57.72 135.16 56.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.111 0.481 . . . . 0.0 110.577 178.471 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -141.01 49.47 1.66 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.305 0.574 . . . . 0.0 110.637 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 897' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -157.79 151.73 19.74 Favored Pre-proline 0 C--N 1.32 -0.698 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.704 -177.274 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_exo -73.18 112.93 3.64 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 122.454 2.103 . . . . 0.0 111.496 177.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 899' ' ' VAL . . . . . 0.546 HG13 ' HA ' ' A' ' 919' ' ' MET . 0.2 OUTLIER -115.41 130.79 69.4 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 CA-C-O 121.5 0.667 . . . . 0.0 110.126 176.746 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 900' ' ' ILE . . . . . 0.42 HD12 HD22 ' A' ' 873' ' ' LEU . 21.2 mt -96.34 117.0 39.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.719 -176.145 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 901' ' ' GLY . . . . . 0.552 ' HA3' ' HD3' ' A' ' 913' ' ' ARG . . . -92.7 105.82 3.34 Favored Glycine 0 N--CA 1.444 -0.811 0 C-N-CA 120.621 -0.799 . . . . 0.0 111.989 177.785 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 902' ' ' VAL . . . . . 0.871 ' HB ' HD11 ' A' ' 923' ' ' LEU . 0.1 OUTLIER -113.83 126.18 71.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 177.49 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 903' ' ' THR . . . . . 0.424 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.4 OUTLIER -143.87 165.23 28.3 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.679 -0.237 . . . . 0.0 110.398 -175.026 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -119.44 103.12 9.17 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.968 0.414 . . . . 0.0 111.722 -178.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 52.22 56.23 8.03 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.064 -0.971 . . . . 0.0 112.856 171.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 906' ' ' ALA . . . . . 0.492 ' HB1' ' HB3' ' A' ' 909' ' ' GLU . . . -95.75 46.91 1.1 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.073 0.463 . . . . 0.0 110.123 174.676 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 907' ' ' LEU . . . . . 0.487 ' HB3' ' H ' ' A' ' 908' ' ' ALA . 0.1 OUTLIER 64.94 -108.71 0.18 Allowed 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.115 -178.998 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 908' ' ' ALA . . . . . 0.487 ' H ' ' HB3' ' A' ' 907' ' ' LEU . . . -98.53 33.56 2.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.96 0.409 . . . . 0.0 110.682 -177.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 909' ' ' GLU . . . . . 0.492 ' HB3' ' HB1' ' A' ' 906' ' ' ALA . 0.0 OUTLIER -52.1 -47.15 65.39 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.42 -0.809 . . . . 0.0 112.314 -176.625 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 910' ' ' GLU . . . . . 0.675 ' HA ' ' NH1' ' A' ' 913' ' ' ARG . 1.5 pt-20 -64.82 -37.46 87.68 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.978 -176.668 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.39 -42.34 71.84 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.872 0.368 . . . . 0.0 110.269 178.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -61.81 -40.59 95.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.706 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 913' ' ' ARG . . . . . 0.837 ' HD2' ' HB2' ' A' ' 922' ' ' CYS . 3.0 mtm105 -59.81 -45.54 92.03 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.756 178.128 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 80.7 m -64.73 -44.9 88.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.6 178.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 915' ' ' LEU . . . . . 0.4 HD21 ' HA ' ' A' ' 915' ' ' LEU . 0.1 OUTLIER -59.83 -43.51 94.54 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.308 -179.535 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.52 -43.21 81.37 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.569 179.536 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 51.67 33.84 11.67 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.139 -175.687 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -106.08 24.66 25.92 Favored Glycine 0 N--CA 1.447 -0.568 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.715 178.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 919' ' ' MET . . . . . 0.546 ' HA ' HG13 ' A' ' 899' ' ' VAL . 2.1 mtt -132.2 -94.89 0.35 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 110.328 -0.249 . . . . 0.0 110.328 -177.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 920' ' ' ASP . . . . . 0.455 ' H ' ' HB3' ' A' ' 919' ' ' MET . 9.6 t70 166.36 -64.77 0.0 OUTLIER 'General case' 0 CA--C 1.518 -0.279 0 O-C-N 124.205 0.941 . . . . 0.0 109.175 175.433 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -115.08 165.81 12.5 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.799 -177.459 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 922' ' ' CYS . . . . . 0.837 ' HB2' ' HD2' ' A' ' 913' ' ' ARG . 0.0 OUTLIER -147.37 135.12 21.11 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.332 -179.683 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 923' ' ' LEU . . . . . 0.871 HD11 ' HB ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -155.98 -175.8 5.62 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 178.37 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 924' ' ' SER . . . . . 0.687 ' HB2' ' HD2' ' A' ' 926' ' ' PRO . 0.0 OUTLIER -106.29 154.68 20.41 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.916 -178.839 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 925' ' ' LYS . . . . . 0.61 ' HZ2' ' ND2' ' A' ' 836' ' ' ASN . 8.4 tttp -52.92 -43.33 93.86 Favored Pre-proline 0 N--CA 1.47 0.531 0 N-CA-C 112.762 0.652 . . . . 0.0 112.762 179.4 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 926' ' ' PRO . . . . . 0.687 ' HD2' ' HB2' ' A' ' 924' ' ' SER . 23.2 Cg_exo -66.5 75.33 0.38 Allowed 'Trans proline' 0 C--N 1.357 0.997 0 C-N-CA 121.983 1.788 . . . . 0.0 111.798 172.474 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -107.09 152.98 8.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.188 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -95.06 149.56 21.13 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.913 179.854 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 929' ' ' LEU . . . . . 0.659 HD22 ' HG3' ' A' ' 843' ' ' GLN . 0.5 OUTLIER -55.93 -37.78 69.4 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.652 -179.029 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.92 -27.21 65.55 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.82 -178.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 931' ' ' VAL . . . . . 0.513 ' O ' ' HG2' ' A' ' 934' ' ' GLN . 93.2 t -75.94 -51.34 20.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.863 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 932' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -58.52 -37.06 62.4 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-O 121.056 0.455 . . . . 0.0 109.826 178.403 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 933' ' ' LYS . . . . . 0.653 ' HG2' HD22 ' A' ' 847' ' ' LEU . 0.0 OUTLIER -65.37 -47.43 76.43 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.288 -179.978 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 934' ' ' GLN . . . . . 0.546 ' O ' ' HB2' ' A' ' 938' ' ' LEU . 10.2 pt20 -63.72 -41.96 98.0 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.406 -177.049 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 1.3 m -69.44 -39.33 77.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.612 0.244 . . . . 0.0 110.732 -179.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 936' ' ' LEU . . . . . 0.537 HD13 HD21 ' A' ' 873' ' ' LEU . 0.7 OUTLIER -63.89 -54.8 29.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.618 179.595 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 74.6 m -60.6 -41.86 95.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.575 -179.076 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 938' ' ' LEU . . . . . 0.546 ' HB2' ' O ' ' A' ' 934' ' ' GLN . 0.1 OUTLIER -68.01 -40.16 83.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.732 0.301 . . . . 0.0 111.416 -178.156 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 939' ' ' TYR . . . . . 0.562 ' HB3' HD11 ' A' ' 871' ' ' ILE . 1.6 m-85 -77.19 -27.21 53.5 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.93 -0.308 . . . . 0.0 111.101 -178.087 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -64.28 -43.61 94.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.007 0.432 . . . . 0.0 110.254 174.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 941' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -73.73 -21.99 60.04 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.333 177.575 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 942' ' ' ARG . . . . . 0.56 ' HB3' ' HA ' ' A' ' 939' ' ' TYR . 0.0 OUTLIER -67.57 -47.55 69.46 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.266 177.234 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 10.1 m -74.11 -33.07 34.45 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 CA-C-O 120.946 0.403 . . . . 0.0 110.155 178.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 19.1 ttt85 -58.56 -48.1 82.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.517 176.472 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.03 -19.33 60.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.199 -179.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 71.4 m -71.9 -21.95 61.56 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.09 0.472 . . . . 0.0 109.903 175.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.63 -30.21 14.45 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.311 174.489 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.027 -175.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 705' ' ' SER . . . . . 0.545 ' HA ' ' O ' ' A' ' 730' ' ' GLY . 1.5 m . . . . . 0 CA--C 1.531 0.234 0 CA-C-O 121.27 0.557 . . . . 0.0 111.495 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 170.49 -23.98 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.345 -0.931 . . . . 0.0 112.597 -178.05 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 707' ' ' LYS . . . . . 0.417 ' O ' HG22 ' A' ' 732' ' ' VAL . 1.4 mptt -75.16 135.75 41.08 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 -179.778 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 708' ' ' ARG . . . . . 0.848 ' HG2' HG23 ' A' ' 732' ' ' VAL . 0.0 OUTLIER -100.24 155.13 17.94 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.054 0.454 . . . . 0.0 111.612 -174.445 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -136.47 127.17 27.21 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.812 176.698 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 710' ' ' TRP . . . . . 0.646 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 90.2 m95 -107.07 117.45 34.09 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 177.113 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 711' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -120.27 123.02 42.17 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.233 0.54 . . . . 0.0 111.191 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -121.27 68.92 0.9 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.368 176.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 713' ' ' VAL . . . . . 0.552 ' HB ' ' HB3' ' A' ' 719' ' ' CYS . 55.3 t -117.84 127.98 75.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.182 -178.216 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 714' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' A' ' 714' ' ' ARG . 3.3 mtt85 -73.53 -35.45 65.56 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.942 0.401 . . . . 0.0 110.667 178.757 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 41.2 t-20 -63.36 112.53 2.76 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.375 177.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 716' ' ' ALA . . . . . 0.643 ' O ' ' HB2' ' A' ' 720' ' ' GLN . . . -66.71 -38.1 86.04 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.328 -175.006 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.83 -38.28 83.02 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.935 0.398 . . . . 0.0 110.092 178.662 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 718' ' ' LEU . . . . . 0.655 HD12 ' HA ' ' A' ' 786' ' ' ALA . 0.9 OUTLIER -67.95 -50.22 57.14 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.663 179.908 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 719' ' ' CYS . . . . . 0.552 ' HB3' ' HB ' ' A' ' 713' ' ' VAL . 21.8 p -67.35 -38.46 84.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.65 -177.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 720' ' ' GLN . . . . . 0.684 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -63.96 -39.14 93.46 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.176 177.574 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -57.3 -55.17 38.23 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.704 -179.588 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 722' ' ' LEU . . . . . 0.412 HD12 HG23 ' A' ' 748' ' ' ILE . 0.7 OUTLIER -63.87 -48.35 77.04 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.952 -179.42 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 723' ' ' GLU . . . . . 0.684 ' HG2' ' HA ' ' A' ' 720' ' ' GLN . 2.9 pt-20 -60.39 -43.41 96.68 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.67 -174.154 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 724' ' ' THR . . . . . 0.538 ' N ' ' HG3' ' A' ' 723' ' ' GLU . 14.6 m -71.8 -38.55 70.23 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.841 0.353 . . . . 0.0 111.166 -177.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 725' ' ' SER . . . . . 0.416 ' O ' ' HG2' ' A' ' 728' ' ' ARG . 37.5 m -69.03 -36.42 77.73 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.877 0.37 . . . . 0.0 111.299 -179.083 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 726' ' ' LEU . . . . . 0.462 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 11.1 mt -82.06 -42.86 18.66 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.869 -176.655 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 727' ' ' GLN . . . . . 0.509 ' HB3' HG22 ' A' ' 733' ' ' VAL . 8.5 pt20 -62.43 -29.76 70.74 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.57 0.224 . . . . 0.0 111.392 -176.387 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 728' ' ' ARG . . . . . 0.416 ' HG2' ' O ' ' A' ' 725' ' ' SER . 11.7 ptt180 -69.51 -17.83 63.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.956 0.408 . . . . 0.0 111.128 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 1.4 m -99.35 -1.82 37.87 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.094 -178.123 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 730' ' ' GLY . . . . . 0.545 ' O ' ' HA ' ' A' ' 705' ' ' SER . . . 100.31 14.68 32.34 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.35 -0.929 . . . . 0.0 112.578 179.237 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 731' ' ' ILE . . . . . 0.462 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 32.0 mm -90.57 129.07 41.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 176.438 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 732' ' ' VAL . . . . . 0.848 HG23 ' HG2' ' A' ' 708' ' ' ARG . 0.2 OUTLIER -85.78 94.33 4.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 121.981 0.896 . . . . 0.0 110.428 -178.784 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 733' ' ' VAL . . . . . 0.509 HG22 ' HB3' ' A' ' 727' ' ' GLN . 0.1 OUTLIER -83.22 122.8 38.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 114.595 -1.184 . . . . 0.0 111.08 -177.398 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.66 147.91 52.39 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.717 -179.66 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 3.9 m -77.46 119.27 20.82 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.032 0.444 . . . . 0.0 110.766 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 736' ' ' TYR . . . . . 0.646 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 86.0 t80 -81.84 114.58 20.55 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.616 -178.551 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -109.33 -42.59 4.33 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.075 177.313 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 176.97 47.76 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.432 0 N-CA-C 111.208 -0.757 . . . . 0.0 111.208 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 13.3 mp0 -91.79 -176.31 4.42 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.528 -0.336 . . . . 0.0 110.863 -174.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 740' ' ' GLU . . . . . 0.498 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 0.0 OUTLIER -97.78 131.77 26.21 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.455 179.897 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 741' ' ' PRO . . . . . 0.64 ' HG2' ' HB2' ' A' ' 758' ' ' GLN . 6.5 Cg_endo -87.25 127.54 2.49 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 123.348 2.699 . . . . 0.0 113.313 -175.519 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 742' ' ' THR . . . . . 0.588 ' CG2' ' HD2' ' A' ' 743' ' ' PRO . 0.2 OUTLIER -90.92 148.59 38.5 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 172.392 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 743' ' ' PRO . . . . . 0.588 ' HD2' ' CG2' ' A' ' 742' ' ' THR . 23.8 Cg_endo -61.77 5.01 0.23 Allowed 'Trans proline' 0 N--CA 1.48 0.687 0 C-N-CA 123.208 2.605 . . . . 0.0 113.931 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -118.03 -2.57 11.23 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.772 0.32 . . . . 0.0 110.424 175.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 745' ' ' ASP . . . . . 0.432 ' HB3' ' HD1' ' A' ' 710' ' ' TRP . 87.1 m-20 -89.38 149.09 23.15 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.746 -176.149 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 746' ' ' VAL . . . . . 0.465 ' HA ' ' O ' ' A' ' 761' ' ' ALA . 2.8 p -120.51 137.25 54.92 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.3 178.458 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 747' ' ' LEU . . . . . 0.472 ' HA ' HD23 ' A' ' 747' ' ' LEU . 0.0 OUTLIER -106.01 100.01 9.57 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.874 0.369 . . . . 0.0 110.903 -179.748 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 748' ' ' ILE . . . . . 0.412 HG23 HD12 ' A' ' 722' ' ' LEU . 12.0 mt -93.78 106.83 18.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 173.783 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 6.0 t -128.98 160.38 32.9 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 110.113 -0.328 . . . . 0.0 110.113 -177.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 750' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -105.51 145.86 30.34 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.02 0.438 . . . . 0.0 111.171 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 751' ' ' GLU . . . . . 0.492 ' HA ' ' HA ' ' A' ' 766' ' ' CYS . 22.5 mm-40 63.91 -157.06 0.31 Allowed 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.366 -178.656 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 752' ' ' VAL . . . . . 0.519 HG22 ' H ' ' A' ' 771' ' ' GLY . 62.1 t -75.68 127.16 37.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 120.992 0.425 . . . . 0.0 111.287 -176.295 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 753' ' ' VAL . . . . . 0.415 HG11 HD12 ' A' ' 772' ' ' ILE . 8.6 p -102.12 142.74 15.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.823 175.437 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -94.37 39.84 1.09 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.906 0.384 . . . . 0.0 111.236 -178.266 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.02 148.24 18.67 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.223 178.684 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 6.4 mmtm -97.2 10.51 39.26 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.826 179.092 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 757' ' ' TRP . . . . . 0.592 ' CH2' ' HB3' ' A' ' 741' ' ' PRO . 4.5 t-105 69.61 153.96 0.11 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.419 -0.81 . . . . 0.0 112.123 177.255 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 758' ' ' GLN . . . . . 0.64 ' HB2' ' HG2' ' A' ' 741' ' ' PRO . 4.9 mp0 -135.22 47.96 2.29 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.797 178.249 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 759' ' ' GLY . . . . . 0.53 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -146.1 -140.86 3.54 Favored Glycine 0 N--CA 1.443 -0.87 0 C-N-CA 120.409 -0.901 . . . . 0.0 113.1 -175.481 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -74.31 -59.97 2.48 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 111.597 0.221 . . . . 0.0 111.597 -178.226 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 761' ' ' ALA . . . . . 0.465 ' O ' ' HA ' ' A' ' 746' ' ' VAL . . . -156.99 157.85 35.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.738 -176.235 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 3.2 p -126.59 131.81 70.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.139 177.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 92.2 t -111.37 96.66 4.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 178.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 764' ' ' THR . . . . . 0.671 HG22 HG13 ' A' ' 772' ' ' ILE . 0.2 OUTLIER -86.39 92.67 8.9 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.083 -178.593 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 765' ' ' PHE . . . . . 0.728 ' CZ ' ' HG ' ' A' ' 791' ' ' LEU . 0.2 OUTLIER -84.23 83.63 7.9 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.207 179.085 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 766' ' ' CYS . . . . . 0.52 ' HB2' HG12 ' A' ' 770' ' ' ILE . 0.0 OUTLIER -94.54 132.85 38.8 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 -175.049 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 5.1 mmm-85 -88.86 -56.15 3.41 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.913 -171.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.28 -34.16 2.96 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.271 -176.33 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -108.75 106.59 16.68 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.291 0.567 . . . . 0.0 110.402 -179.425 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 770' ' ' ILE . . . . . 0.52 HG12 ' HB2' ' A' ' 766' ' ' CYS . 24.2 mt -107.26 87.39 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.467 178.377 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 771' ' ' GLY . . . . . 0.519 ' H ' HG22 ' A' ' 752' ' ' VAL . . . -95.28 6.71 68.78 Favored Glycine 0 N--CA 1.454 -0.156 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.693 177.873 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 772' ' ' ILE . . . . . 0.79 HG22 ' HD2' ' A' ' 773' ' ' PRO . 41.9 mm -104.06 141.79 23.26 Favored Pre-proline 0 C--N 1.32 -0.686 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 178.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 773' ' ' PRO . . . . . 0.79 ' HD2' HG22 ' A' ' 772' ' ' ILE . 50.7 Cg_exo -53.39 -96.83 0.0 OUTLIER 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 123.135 2.557 . . . . 0.0 113.37 178.657 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . 0.674 ' HB3' ' O ' ' A' ' 773' ' ' PRO . 0.3 OUTLIER 153.05 -161.85 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.462 1.105 . . . . 0.0 109.477 -177.365 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 775' ' ' GLU . . . . . 0.501 ' HA ' ' O ' ' A' ' 780' ' ' GLU . 0.8 OUTLIER -62.65 54.05 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.911 0.884 . . . . 0.0 113.335 177.266 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 776' ' ' LYS . . . . . 0.568 ' HD3' ' HB3' ' A' ' 773' ' ' PRO . 0.1 OUTLIER -118.75 0.41 11.44 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 170.122 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -126.93 150.87 72.96 Favored Pre-proline 0 C--N 1.324 -0.526 0 CA-C-N 114.615 -1.175 . . . . 0.0 109.114 176.123 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_endo -62.14 100.32 0.21 Allowed 'Trans proline' 0 CA--C 1.529 0.232 0 C-N-CA 122.617 2.212 . . . . 0.0 112.626 -178.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 96.48 20.11 25.78 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.832 -0.699 . . . . 0.0 113.004 177.475 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 780' ' ' GLU . . . . . 0.501 ' O ' ' HA ' ' A' ' 775' ' ' GLU . 0.1 OUTLIER -109.59 125.06 52.16 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 179.808 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 35.5 m95 -142.66 106.78 4.73 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.853 -0.158 . . . . 0.0 111.152 -175.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . 0.53 HG21 ' HB3' ' A' ' 774' ' ' LEU . 3.6 m -102.19 156.43 4.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 C-N-CA 120.781 -0.367 . . . . 0.0 110.156 175.19 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 783' ' ' HIS . . . . . 0.418 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.1 OUTLIER -176.36 150.16 0.88 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.61 177.415 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 3.1 m -104.96 100.21 9.82 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.935 0.397 . . . . 0.0 110.533 173.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 785' ' ' VAL . . . . . 0.405 HG23 ' CE1' ' A' ' 765' ' ' PHE . 0.1 OUTLIER -159.45 164.55 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 178.239 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 786' ' ' ALA . . . . . 0.655 ' HA ' HD12 ' A' ' 718' ' ' LEU . . . -103.56 40.36 1.43 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.997 179.094 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 49.39 64.09 9.18 Favored Pre-proline 0 N--CA 1.469 0.487 0 CA-C-N 115.26 -0.882 . . . . 0.0 112.705 177.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 788' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -68.59 -70.37 0.02 OUTLIER 'Trans proline' 0 CA--C 1.533 0.455 0 C-N-CA 122.254 1.969 . . . . 0.0 112.545 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 2.2 p-80 -153.32 -30.82 0.13 Allowed 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -178.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 790' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -71.18 -34.28 70.77 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 111.747 0.277 . . . . 0.0 111.747 -174.258 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 791' ' ' LEU . . . . . 0.728 ' HG ' ' CZ ' ' A' ' 765' ' ' PHE . 0.7 OUTLIER -65.46 -55.62 23.68 Favored Pre-proline 0 C--N 1.327 -0.382 0 C-N-CA 120.986 -0.286 . . . . 0.0 111.272 -178.922 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 792' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -58.55 -26.71 79.79 Favored 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 121.585 1.523 . . . . 0.0 111.871 175.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -68.09 -45.69 73.07 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.892 176.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 794' ' ' LEU . . . . . 0.482 HD21 ' HA ' ' A' ' 794' ' ' LEU . 0.2 OUTLIER -65.63 -36.89 85.0 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 176.797 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 795' ' ' LEU . . . . . 0.463 ' O ' HG21 ' A' ' 798' ' ' ILE . 0.6 OUTLIER -63.04 -44.26 96.36 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.865 179.158 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -63.69 -31.73 72.99 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.148 0.499 . . . . 0.0 110.727 177.053 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.24 -47.18 65.46 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.674 178.69 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 798' ' ' ILE . . . . . 0.463 HG21 ' O ' ' A' ' 795' ' ' LEU . 0.9 OUTLIER -70.1 -16.94 20.58 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.589 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.308 -177.562 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 799' ' ' TYR . . . . . 0.425 ' HD1' ' HA ' ' A' ' 799' ' ' TYR . 2.4 m-30 -78.53 -8.32 58.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.282 175.188 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 34.1 mt . . . . . 0 C--O 1.231 0.126 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.532 177.206 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.938 0.399 . . . . 0.0 110.513 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 825' ' ' MET . . . . . 0.507 ' O ' ' HB3' ' A' ' 849' ' ' TYR . 0.5 OUTLIER -92.29 127.76 37.89 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 -178.501 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 826' ' ' MET . . . . . 0.578 ' HG3' ' HA ' ' A' ' 869' ' ' ILE . 5.0 ptp -125.61 131.02 52.76 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.121 0.486 . . . . 0.0 111.383 -176.763 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 827' ' ' ILE . . . . . . . . . . . . . 10.3 mm -120.71 128.91 76.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.075 176.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 828' ' ' LEU . . . . . 0.556 ' HB3' HD13 ' A' ' 869' ' ' ILE . 0.1 OUTLIER -106.36 134.75 49.01 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.259 0.552 . . . . 0.0 110.768 -178.063 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -112.33 111.73 37.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.509 -177.373 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 830' ' ' VAL . . . . . 0.612 ' HA ' ' O ' ' A' ' 854' ' ' ALA . 48.7 t -112.17 100.59 11.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.316 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 831' ' ' ASP . . . . . 0.747 ' HB2' ' HB3' ' A' ' 875' ' ' ASP . 0.1 OUTLIER -121.26 137.55 54.64 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.935 0.398 . . . . 0.0 110.505 -178.27 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 832' ' ' ASP . . . . . 0.46 ' O ' ' HD3' ' A' ' 834' ' ' PRO . 7.2 t70 -74.24 -37.7 63.73 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.854 -176.181 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -108.49 93.1 11.04 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.28 -174.531 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 834' ' ' PRO . . . . . 0.46 ' HD3' ' O ' ' A' ' 832' ' ' ASP . 98.1 Cg_exo -45.62 -25.34 2.33 Favored 'Trans proline' 0 N--CA 1.482 0.849 0 C-N-CA 125.14 3.893 . . . . 0.0 116.374 -164.0 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 1.2 pp -58.25 -40.49 77.87 Favored 'Isoleucine or valine' 0 C--O 1.239 0.524 0 CA-C-O 121.242 0.544 . . . . 0.0 110.758 179.524 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 836' ' ' ASN . . . . . 0.528 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 2.2 t30 -74.53 -39.82 62.12 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.903 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 837' ' ' ARG . . . . . 0.734 ' HA ' HD13 ' A' ' 840' ' ' LEU . 6.7 ttp-105 -53.43 -39.96 64.8 Favored 'General case' 0 CA--C 1.518 -0.281 0 O-C-N 123.338 0.399 . . . . 0.0 110.542 175.856 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 838' ' ' ARG . . . . . 0.443 ' HG3' ' N ' ' A' ' 839' ' ' LEU . 0.0 OUTLIER -59.39 -44.0 92.84 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 176.297 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 839' ' ' LEU . . . . . 0.443 ' N ' ' HG3' ' A' ' 838' ' ' ARG . 0.7 OUTLIER -69.04 -45.22 70.98 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.971 -0.559 . . . . 0.0 112.098 -175.279 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 840' ' ' LEU . . . . . 0.734 HD13 ' HA ' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -67.59 -37.37 82.47 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.183 177.629 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 841' ' ' ALA . . . . . 0.561 ' HB1' ' O ' ' A' ' 837' ' ' ARG . . . -67.22 -24.25 65.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.005 0.431 . . . . 0.0 110.444 178.517 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.08 -57.76 8.66 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.052 176.011 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 843' ' ' GLN . . . . . 1.0 ' HG2' HD21 ' A' ' 929' ' ' LEU . 4.4 mp0 -68.1 -42.03 80.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.095 -177.654 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 844' ' ' LEU . . . . . 0.428 ' HB2' ' O ' ' A' ' 840' ' ' LEU . 0.0 OUTLIER -66.04 -32.76 74.42 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.11 0.481 . . . . 0.0 110.743 179.263 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -65.46 -38.41 94.8 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.933 -0.651 . . . . 0.0 111.874 178.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -70.98 -44.38 66.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.618 0.247 . . . . 0.0 111.099 179.09 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -161.23 78.65 0.58 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.065 0.459 . . . . 0.0 111.39 178.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . -147.8 32.5 1.31 Allowed Glycine 0 N--CA 1.445 -0.753 0 C-N-CA 120.673 -0.775 . . . . 0.0 111.786 176.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 849' ' ' TYR . . . . . 0.507 ' HB3' ' O ' ' A' ' 825' ' ' MET . 70.0 m-85 62.89 -156.9 0.33 Allowed 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 -178.895 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -77.24 108.81 10.62 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.866 0.365 . . . . 0.0 110.298 179.211 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -96.6 134.3 40.0 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.256 -176.228 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.43 122.44 36.69 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.069 177.095 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -92.94 137.25 32.53 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -175.668 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 854' ' ' ALA . . . . . 0.612 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -150.65 161.66 42.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.952 176.258 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 855' ' ' ASN . . . . . 0.451 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 16.1 p-10 -147.29 74.83 1.35 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.271 0.558 . . . . 0.0 111.647 -179.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 856' ' ' ASP . . . . . 0.451 ' HB2' ' O ' ' A' ' 855' ' ' ASN . 7.3 t0 172.86 147.9 0.05 Allowed 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 114.999 -1.0 . . . . 0.0 109.613 175.127 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -74.06 -35.31 53.88 Favored Glycine 0 N--CA 1.443 -0.861 0 C-N-CA 120.949 -0.643 . . . . 0.0 111.685 179.515 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 858' ' ' VAL . . . . . 0.424 HG23 ' N ' ' A' ' 859' ' ' ASP . 19.4 m -73.09 -31.37 34.77 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 CA-C-O 120.899 0.38 . . . . 0.0 110.645 -179.749 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 859' ' ' ASP . . . . . 0.424 ' N ' HG23 ' A' ' 858' ' ' VAL . 2.2 t70 -70.55 -38.52 74.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.051 179.003 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 860' ' ' ALA . . . . . 0.605 ' O ' ' HG ' ' A' ' 864' ' ' LEU . . . -61.33 -42.44 98.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.12 176.278 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 861' ' ' LEU . . . . . 0.494 HD21 ' HB3' ' A' ' 893' ' ' LEU . 1.3 mt -60.13 -41.63 93.06 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.719 177.604 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -63.88 -39.89 95.25 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.793 179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 863' ' ' VAL . . . . . 0.405 HG13 ' O ' ' A' ' 860' ' ' ALA . 0.3 OUTLIER -66.14 -33.9 66.63 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.764 -177.997 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 864' ' ' LEU . . . . . 0.605 ' HG ' ' O ' ' A' ' 860' ' ' ALA . 4.9 mt -69.85 -35.06 74.43 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.048 0.451 . . . . 0.0 110.109 176.27 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 4.1 m -81.5 -6.63 59.15 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.074 -178.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 17.2 mtpt -99.99 -45.59 5.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.729 176.009 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 867' ' ' ASN . . . . . 0.438 ' HB3' ' H ' ' A' ' 868' ' ' HIS . 22.9 t-20 -124.68 -112.16 0.3 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.518 -178.66 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 868' ' ' HIS . . . . . 0.438 ' H ' ' HB3' ' A' ' 867' ' ' ASN . 11.5 t60 -161.68 -67.27 0.06 Allowed 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 179.237 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 869' ' ' ILE . . . . . 0.578 ' HA ' ' HG3' ' A' ' 826' ' ' MET . 35.7 mt 66.07 147.42 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 O-C-N 123.846 0.716 . . . . 0.0 110.468 -175.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 870' ' ' ASP . . . . . 0.44 ' N ' HG23 ' A' ' 869' ' ' ILE . 0.2 OUTLIER -96.69 -36.42 10.69 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.251 -0.58 . . . . 0.0 112.421 -171.495 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 871' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -136.51 133.88 49.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.908 0.385 . . . . 0.0 110.837 -178.366 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 872' ' ' VAL . . . . . 0.545 HG22 HD12 ' A' ' 897' ' ' LEU . 12.0 t -101.81 124.83 55.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.444 177.67 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 873' ' ' LEU . . . . . 0.505 ' HA ' HD23 ' A' ' 873' ' ' LEU . 45.5 mt -104.85 100.06 9.68 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 174.616 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -95.52 96.31 8.98 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.626 -178.252 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 875' ' ' ASP . . . . . 0.747 ' HB3' ' HB2' ' A' ' 831' ' ' ASP . 25.0 t0 -93.19 106.91 18.81 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.988 -177.842 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 21.6 t -108.61 135.77 46.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.091 -170.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 877' ' ' ASN . . . . . 0.819 ' HB2' ' HE3' ' A' ' 925' ' ' LYS . 10.9 t-20 -163.6 80.37 0.44 Allowed 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.7 176.205 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.583 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.81 178.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.283 0 N-CA-C 111.58 -0.608 . . . . 0.0 111.58 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 884' ' ' TYR . . . . . 0.422 ' O ' ' HB2' ' A' ' 888' ' ' GLN . 54.6 t80 -158.99 -54.99 0.06 Allowed 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 -179.752 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 885' ' ' ARG . . . . . 0.73 ' O ' ' HB2' ' A' ' 889' ' ' ARG . 0.0 OUTLIER -58.39 -50.73 72.64 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.409 -179.486 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.43 -52.61 17.57 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.815 -176.435 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -60.87 -48.36 82.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 0.0 112.141 -174.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 888' ' ' GLN . . . . . 0.499 ' O ' ' HB2' ' A' ' 892' ' ' GLN . 3.8 mm-40 -68.68 -45.22 72.26 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.956 -0.297 . . . . 0.0 110.745 -178.124 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 889' ' ' ARG . . . . . 0.73 ' HB2' ' O ' ' A' ' 885' ' ' ARG . 0.0 OUTLIER -61.38 -48.09 82.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.595 0.236 . . . . 0.0 111.223 -177.724 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 890' ' ' ILE . . . . . 0.625 HG23 ' N ' ' A' ' 891' ' ' ARG . 0.7 OUTLIER -62.71 -42.69 97.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.25 -175.94 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 891' ' ' ARG . . . . . 0.625 ' N ' HG23 ' A' ' 890' ' ' ILE . 0.0 OUTLIER -75.45 -28.53 59.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.652 0.263 . . . . 0.0 111.04 -178.84 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 892' ' ' GLN . . . . . 0.499 ' HB2' ' O ' ' A' ' 888' ' ' GLN . 0.0 OUTLIER -70.15 -36.05 74.46 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.046 179.312 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 893' ' ' LEU . . . . . 0.494 ' HB3' HD21 ' A' ' 861' ' ' LEU . 0.1 OUTLIER -83.58 -3.58 57.81 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.889 -176.536 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 109.32 30.76 3.48 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.122 -1.037 . . . . 0.0 114.313 172.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 895' ' ' LEU . . . . . 0.593 HD11 HD11 ' A' ' 864' ' ' LEU . 0.2 OUTLIER -66.79 112.03 4.03 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 117.393 0.596 . . . . 0.0 109.524 172.837 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 8.4 t -130.16 59.67 1.63 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 122.08 0.943 . . . . 0.0 110.537 -177.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 897' ' ' LEU . . . . . 0.545 HD12 HG22 ' A' ' 872' ' ' VAL . 1.0 OUTLIER -156.07 151.73 22.18 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.655 178.454 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -58.03 116.39 3.2 Favored 'Trans proline' 0 C--O 1.235 0.327 0 C-N-CA 122.956 2.437 . . . . 0.0 113.117 -176.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 899' ' ' VAL . . . . . 0.4 ' HB ' ' CA ' ' A' ' 919' ' ' MET . 16.2 t -103.38 124.91 57.89 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.634 177.037 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 900' ' ' ILE . . . . . 0.495 HG21 ' HB2' ' A' ' 921' ' ' SER . 8.7 mt -104.74 102.03 13.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 177.06 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 901' ' ' GLY . . . . . 0.497 ' HA3' ' HE1' ' A' ' 919' ' ' MET . . . -83.5 112.73 3.59 Favored Glycine 0 N--CA 1.444 -0.799 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.0 -178.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 902' ' ' VAL . . . . . 0.851 ' HB ' HD13 ' A' ' 923' ' ' LEU . 0.2 OUTLIER -104.23 114.55 44.15 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.915 0 N-CA-C 109.268 -0.642 . . . . 0.0 109.268 178.311 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 903' ' ' THR . . . . . 0.498 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.1 OUTLIER -119.86 152.76 36.84 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.546 -176.347 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -76.14 103.84 6.38 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.749 -179.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 57.88 79.07 0.21 Allowed 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.751 178.649 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 906' ' ' ALA . . . . . 0.434 ' HB1' ' HG3' ' A' ' 909' ' ' GLU . . . -85.16 -11.92 53.95 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.744 179.161 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 907' ' ' LEU . . . . . 0.423 ' HB2' ' O ' ' A' ' 906' ' ' ALA . 1.5 mt 73.86 -54.25 0.68 Allowed 'General case' 0 N--CA 1.471 0.599 0 O-C-N 124.048 0.842 . . . . 0.0 111.27 176.631 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -132.85 72.3 1.49 Allowed 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 177.006 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 909' ' ' GLU . . . . . 0.434 ' HG3' ' HB1' ' A' ' 906' ' ' ALA . 1.8 mp0 -46.61 -52.46 13.56 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.377 -0.828 . . . . 0.0 112.304 -176.028 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 910' ' ' GLU . . . . . 0.436 ' O ' ' HB3' ' A' ' 913' ' ' ARG . 1.0 OUTLIER -56.77 -46.44 81.49 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 120.946 0.403 . . . . 0.0 111.575 -179.136 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -66.53 -37.32 84.77 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.23 0.538 . . . . 0.0 110.692 -178.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -63.3 -31.29 72.4 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.039 177.23 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 913' ' ' ARG . . . . . 0.645 ' HB2' ' SG ' ' A' ' 922' ' ' CYS . 13.6 ttp180 -67.12 -38.88 86.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.444 177.536 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 13.3 m -63.45 -27.94 69.63 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.037 0.446 . . . . 0.0 110.32 176.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.02 -49.68 42.34 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.641 177.31 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 916' ' ' GLU . . . . . 0.452 ' H ' ' HG3' ' A' ' 916' ' ' GLU . 0.0 OUTLIER -74.18 -50.28 19.93 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 121.106 -0.237 . . . . 0.0 111.266 -176.535 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 50.38 40.95 24.03 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.802 -175.575 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -136.9 -29.38 0.3 Allowed Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.572 -0.823 . . . . 0.0 113.483 -176.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 919' ' ' MET . . . . . 0.577 ' O ' ' HB2' ' A' ' 920' ' ' ASP . 0.3 OUTLIER -84.23 -87.53 0.11 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 117.183 0.491 . . . . 0.0 110.826 -176.763 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 920' ' ' ASP . . . . . 0.577 ' HB2' ' O ' ' A' ' 919' ' ' MET . 25.6 t70 164.32 -53.15 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.533 0.733 . . . . 0.0 110.39 176.081 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 921' ' ' SER . . . . . 0.495 ' HB2' HG21 ' A' ' 900' ' ' ILE . 1.0 OUTLIER -134.81 171.06 14.91 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.871 179.819 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 922' ' ' CYS . . . . . 0.645 ' SG ' ' HB2' ' A' ' 913' ' ' ARG . 0.4 OUTLIER -149.59 145.43 26.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.815 0.34 . . . . 0.0 111.372 -178.213 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 923' ' ' LEU . . . . . 0.851 HD13 ' HB ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -145.82 -176.86 5.31 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.933 175.654 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 924' ' ' SER . . . . . 0.519 ' HB3' ' HD2' ' A' ' 926' ' ' PRO . 4.1 m -103.55 144.55 31.27 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.802 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 925' ' ' LYS . . . . . 0.819 ' HE3' ' HB2' ' A' ' 877' ' ' ASN . 12.9 tttm -54.44 -45.85 99.25 Favored Pre-proline 0 CA--C 1.539 0.547 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 -179.154 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 926' ' ' PRO . . . . . 0.519 ' HD2' ' HB3' ' A' ' 924' ' ' SER . 14.8 Cg_exo -69.93 71.96 1.57 Allowed 'Trans proline' 0 C--N 1.356 0.953 0 C-N-CA 121.851 1.701 . . . . 0.0 111.923 175.157 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 10.0 p -95.04 140.75 16.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.992 -178.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 928' ' ' THR . . . . . 0.472 ' OG1' HG22 ' A' ' 931' ' ' VAL . 0.0 OUTLIER -92.56 159.56 15.43 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.857 179.182 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 929' ' ' LEU . . . . . 1.0 HD21 ' HG2' ' A' ' 843' ' ' GLN . 1.3 tm? -52.69 -43.26 65.48 Favored 'General case' 0 N--CA 1.464 0.271 0 O-C-N 123.468 0.48 . . . . 0.0 111.027 179.269 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.39 -37.71 88.47 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.97 0.414 . . . . 0.0 110.659 -177.282 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 931' ' ' VAL . . . . . 0.472 HG22 ' OG1' ' A' ' 928' ' ' THR . 44.2 t -75.6 -47.14 34.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.147 -176.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 932' ' ' ILE . . . . . 0.453 HG21 ' N ' ' A' ' 933' ' ' LYS . 0.0 OUTLIER -63.59 -40.1 87.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 121.148 -0.221 . . . . 0.0 110.702 -179.329 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 933' ' ' LYS . . . . . 0.453 ' N ' HG21 ' A' ' 932' ' ' ILE . 1.8 tmmt? -62.96 -48.47 78.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.066 0.46 . . . . 0.0 110.33 177.829 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -62.34 -49.35 75.92 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.379 -177.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 4.7 m -63.87 -44.8 92.0 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.386 -177.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 936' ' ' LEU . . . . . 0.415 ' HB2' ' O ' ' A' ' 932' ' ' ILE . 0.1 OUTLIER -63.9 -47.64 79.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.558 -179.045 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 55.0 m -63.27 -45.95 89.09 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.308 -179.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 938' ' ' LEU . . . . . 0.462 ' O ' ' HB2' ' A' ' 942' ' ' ARG . 0.4 OUTLIER -64.01 -43.19 96.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.254 -178.372 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -73.89 -32.57 63.64 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 121.084 -0.246 . . . . 0.0 111.082 -177.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -69.54 -45.99 67.5 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.806 0.336 . . . . 0.0 110.678 177.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 941' ' ' GLU . . . . . 0.425 ' HA ' ' HB2' ' A' ' 944' ' ' ARG . 1.7 pt-20 -70.42 -23.78 62.8 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.833 0.349 . . . . 0.0 110.463 178.524 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 942' ' ' ARG . . . . . 0.462 ' HB2' ' O ' ' A' ' 938' ' ' LEU . 0.4 OUTLIER -66.13 -48.47 70.73 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.724 178.722 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 943' ' ' VAL . . . . . 0.419 ' H ' HG22 ' A' ' 943' ' ' VAL . 2.8 m -72.69 -30.44 33.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.046 0.45 . . . . 0.0 110.043 178.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 944' ' ' ARG . . . . . 0.425 ' HB2' ' HA ' ' A' ' 941' ' ' GLU . 0.9 OUTLIER -62.68 -48.74 77.96 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.981 177.37 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -74.48 -16.13 60.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.769 0.318 . . . . 0.0 111.26 -179.562 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 63.4 m -79.29 -26.78 42.26 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.15 0.5 . . . . 0.0 109.971 174.088 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 1.6 mpp_? -82.63 -38.49 23.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.647 175.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.325 -0.495 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.856 177.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 705' ' ' SER . . . . . 0.467 ' HA ' ' O ' ' A' ' 730' ' ' GLY . 3.7 m . . . . . 0 CA--C 1.538 0.493 0 CA-C-O 121.029 0.442 . . . . 0.0 111.827 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 67.68 15.72 66.87 Favored Glycine 0 CA--C 1.52 0.346 0 CA-C-N 116.142 -0.481 . . . . 0.0 113.603 175.025 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 707' ' ' LYS . . . . . 0.632 ' HB2' HD11 ' A' ' 731' ' ' ILE . 10.0 mmmt -118.88 148.34 43.01 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 708' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -109.38 122.96 48.52 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.058 0.456 . . . . 0.0 110.863 -176.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -101.86 113.79 27.29 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 175.507 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 710' ' ' TRP . . . . . . . . . . . . . 87.8 m95 -89.91 115.38 27.17 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -178.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 711' ' ' LEU . . . . . 0.494 HD12 ' HB2' ' A' ' 719' ' ' CYS . 0.0 OUTLIER -114.87 125.48 53.7 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.75 -172.158 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 712' ' ' ALA . . . . . 0.408 ' HB2' HG21 ' A' ' 749' ' ' THR . . . -126.29 43.37 3.11 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.191 177.256 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 713' ' ' VAL . . . . . 0.754 ' HA ' ' CB ' ' A' ' 750' ' ' ASP . 25.2 t -98.82 133.76 40.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.63 -0.713 . . . . 0.0 110.652 -178.053 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -98.3 -34.04 10.84 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.639 -176.647 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -69.96 122.52 19.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.436 178.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 716' ' ' ALA . . . . . 0.707 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -64.18 -37.59 88.02 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.087 -0.506 . . . . 0.0 112.066 -173.404 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 717' ' ' SER . . . . . 0.409 ' O ' ' HB2' ' A' ' 721' ' ' PHE . 1.7 m -63.09 -45.61 91.27 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.116 0.484 . . . . 0.0 110.24 179.126 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 718' ' ' LEU . . . . . 0.576 ' HB3' HG12 ' A' ' 713' ' ' VAL . 0.4 OUTLIER -68.93 -49.74 55.47 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.514 -0.767 . . . . 0.0 111.566 -179.534 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 719' ' ' CYS . . . . . 0.707 ' SG ' ' HA ' ' A' ' 716' ' ' ALA . 30.5 p -67.13 -51.02 59.17 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.212 -174.675 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 720' ' ' GLN . . . . . 0.408 ' HA ' ' CG ' ' A' ' 723' ' ' GLU . 4.6 tp60 -60.24 -39.23 86.0 Favored 'General case' 0 C--N 1.332 -0.163 0 O-C-N 122.997 0.185 . . . . 0.0 111.37 -178.21 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 721' ' ' PHE . . . . . 0.409 ' HB2' ' O ' ' A' ' 717' ' ' SER . 10.6 t80 -55.87 -55.8 28.19 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.021 0.438 . . . . 0.0 110.433 179.755 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 722' ' ' LEU . . . . . 0.489 HD11 HG22 ' A' ' 748' ' ' ILE . 20.5 mt -68.42 -46.54 69.62 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.427 -176.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 723' ' ' GLU . . . . . 0.408 ' CG ' ' HA ' ' A' ' 720' ' ' GLN . 0.0 OUTLIER -64.66 -44.23 91.07 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.549 0.203 . . . . 0.0 111.549 -173.892 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 724' ' ' THR . . . . . 0.624 ' O ' ' HG3' ' A' ' 728' ' ' ARG . 55.4 m -67.36 -36.76 82.04 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.769 0.318 . . . . 0.0 110.804 -179.189 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 24.5 m -70.67 -49.08 51.08 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.737 0.304 . . . . 0.0 111.467 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 726' ' ' LEU . . . . . . . . . . . . . 9.6 mt -68.6 -37.09 79.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.649 -175.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.61 -18.96 65.71 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.044 0.45 . . . . 0.0 110.88 -179.707 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 728' ' ' ARG . . . . . 0.624 ' HG3' ' O ' ' A' ' 724' ' ' THR . 8.9 mtm180 -74.69 -11.25 60.13 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.013 0.435 . . . . 0.0 110.74 178.297 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -103.7 8.02 37.34 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.045 0.45 . . . . 0.0 110.803 178.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 730' ' ' GLY . . . . . 0.467 ' O ' ' HA ' ' A' ' 705' ' ' SER . . . 89.86 13.17 61.24 Favored Glycine 0 C--N 1.329 0.169 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.784 179.006 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 731' ' ' ILE . . . . . 0.632 HD11 ' HB2' ' A' ' 707' ' ' LYS . 15.2 mm -90.35 128.94 41.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 O-C-N 122.791 -0.24 . . . . 0.0 110.475 179.686 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 732' ' ' VAL . . . . . . . . . . . . . 1.4 p -90.01 115.81 30.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.201 0.524 . . . . 0.0 110.566 -179.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 733' ' ' VAL . . . . . . . . . . . . . 10.1 t -86.81 137.14 21.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.195 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -141.48 137.34 32.04 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.827 0.346 . . . . 0.0 110.948 -177.845 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.72 116.6 7.82 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.632 178.548 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -85.4 80.01 9.27 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.401 0.619 . . . . 0.0 110.873 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 737' ' ' GLU . . . . . 0.537 ' H ' ' HG3' ' A' ' 737' ' ' GLU . 0.0 OUTLIER -79.01 -29.41 43.65 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.065 176.26 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 146.77 67.49 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.57 178.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 739' ' ' GLN . . . . . 0.411 ' HB2' ' H ' ' A' ' 740' ' ' GLU . 0.1 OUTLIER -112.99 -119.96 0.3 Allowed 'General case' 0 C--N 1.329 -0.312 0 O-C-N 122.879 -0.189 . . . . 0.0 110.817 179.304 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 740' ' ' GLU . . . . . 0.483 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 17.2 mm-40 -112.5 134.14 21.67 Favored Pre-proline 0 C--N 1.326 -0.432 0 CA-C-O 120.659 0.266 . . . . 0.0 111.045 -177.065 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 741' ' ' PRO . . . . . 0.483 ' HD3' ' HA ' ' A' ' 740' ' ' GLU . 4.5 Cg_endo -88.0 125.81 1.98 Allowed 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 123.434 2.756 . . . . 0.0 111.98 175.607 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 742' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -95.71 125.17 50.14 Favored Pre-proline 0 N--CA 1.449 -0.525 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.377 176.777 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 743' ' ' PRO . . . . . 0.666 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 34.0 Cg_endo -64.28 -9.41 19.79 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.834 2.356 . . . . 0.0 112.465 -179.314 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -104.85 -6.96 19.74 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.055 -179.902 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -117.13 167.28 11.32 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.519 -173.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 746' ' ' VAL . . . . . 0.665 HG23 HD12 ' A' ' 795' ' ' LEU . 33.0 m -118.91 148.21 21.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.352 0.596 . . . . 0.0 112.417 -171.454 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 747' ' ' LEU . . . . . 0.463 HD23 HG23 ' A' ' 749' ' ' THR . 0.3 OUTLIER -107.89 115.14 29.59 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.481 175.141 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 748' ' ' ILE . . . . . 0.489 HG22 HD11 ' A' ' 722' ' ' LEU . 19.3 mt -98.86 107.55 20.67 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 172.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 749' ' ' THR . . . . . 0.67 HG22 ' HB ' ' A' ' 753' ' ' VAL . 0.0 OUTLIER -102.68 160.55 14.48 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.319 -0.855 . . . . 0.0 112.192 -170.388 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 750' ' ' ASP . . . . . 0.754 ' CB ' ' HA ' ' A' ' 713' ' ' VAL . 36.7 t0 -124.14 121.61 35.59 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 171.426 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 64.84 -165.77 0.23 Allowed 'General case' 0 C--N 1.327 -0.385 0 O-C-N 123.785 0.678 . . . . 0.0 110.715 -174.288 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 752' ' ' VAL . . . . . 0.593 HG22 HG12 ' A' ' 772' ' ' ILE . 42.0 t -82.46 122.4 37.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.06 0.457 . . . . 0.0 111.317 -175.164 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 753' ' ' VAL . . . . . 0.67 ' HB ' HG22 ' A' ' 749' ' ' THR . 8.7 p -93.21 -7.16 10.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.269 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 54.72 51.24 14.17 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.388 -178.666 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.72 167.87 28.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.713 178.196 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 756' ' ' LYS . . . . . 0.458 ' HZ1' ' CD ' ' A' ' 780' ' ' GLU . 0.3 OUTLIER -101.77 -29.47 11.86 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 123.108 0.255 . . . . 0.0 110.987 -179.686 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 757' ' ' TRP . . . . . 0.511 ' CD1' ' HB ' ' A' ' 762' ' ' VAL . 68.9 t-105 65.03 94.01 0.06 Allowed 'General case' 0 N--CA 1.464 0.271 0 O-C-N 123.794 0.684 . . . . 0.0 111.007 -179.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.81 64.58 8.13 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.255 0.55 . . . . 0.0 110.326 177.447 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 759' ' ' GLY . . . . . 0.666 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -123.44 -151.82 8.33 Favored Glycine 0 N--CA 1.446 -0.644 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.457 178.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.14 -51.01 19.49 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.993 0.425 . . . . 0.0 110.051 178.563 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -162.39 151.17 15.03 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.377 178.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 762' ' ' VAL . . . . . 0.511 ' HB ' ' CD1' ' A' ' 757' ' ' TRP . 2.7 p -128.15 117.04 44.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.606 176.754 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 763' ' ' VAL . . . . . 0.411 HG11 HD23 ' A' ' 791' ' ' LEU . 1.6 t -109.49 104.19 16.69 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.693 -178.2 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 764' ' ' THR . . . . . . . . . . . . . 90.4 m -95.43 121.44 37.12 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.951 -175.132 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 765' ' ' PHE . . . . . 0.835 ' HE1' HG22 ' A' ' 785' ' ' VAL . 5.6 m-85 -91.13 89.3 7.31 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.334 173.629 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -110.61 133.54 53.22 Favored 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.57 -175.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.79 61.06 4.08 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.98 0.419 . . . . 0.0 110.053 179.565 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 3.3 mtm180 57.39 29.9 17.69 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.868 178.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -96.17 118.66 33.19 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.114 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 770' ' ' ILE . . . . . 0.533 ' HB ' HG21 ' A' ' 752' ' ' VAL . 53.6 mt 71.31 -70.01 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 O-C-N 123.76 0.662 . . . . 0.0 111.477 178.123 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . 126.73 96.93 0.99 Allowed Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 120.504 -0.855 . . . . 0.0 113.248 178.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 772' ' ' ILE . . . . . 0.593 HG12 HG22 ' A' ' 752' ' ' VAL . 39.2 mm -104.42 129.28 25.33 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 171.49 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 773' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -75.12 170.91 19.35 Favored 'Trans proline' 0 CA--C 1.53 0.279 0 C-N-CA 122.578 2.186 . . . . 0.0 113.184 -178.311 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . 0.571 ' O ' ' HB3' ' A' ' 780' ' ' GLU . 0.7 OUTLIER -101.93 -148.88 0.38 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.459 -178.706 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 775' ' ' GLU . . . . . 0.482 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 1.7 mp0 -65.38 60.56 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -179.688 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -102.01 -16.06 16.59 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 170.75 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -132.26 149.25 72.67 Favored Pre-proline 0 N--CA 1.449 -0.514 0 CA-C-N 114.188 -1.369 . . . . 0.0 108.423 175.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -60.67 100.41 0.16 Allowed 'Trans proline' 0 C--O 1.232 0.206 0 C-N-CA 122.572 2.181 . . . . 0.0 112.956 -176.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 123.05 -17.28 8.09 Favored Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.693 -0.765 . . . . 0.0 113.109 175.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 780' ' ' GLU . . . . . 0.571 ' HB3' ' O ' ' A' ' 774' ' ' LEU . 1.1 tt0 -81.07 126.29 31.26 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 117.13 0.465 . . . . 0.0 111.418 -175.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 32.3 m95 -138.68 143.07 39.0 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 176.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 1.2 m -143.93 155.35 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-O 121.121 0.486 . . . . 0.0 111.633 178.015 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 783' ' ' HIS . . . . . 0.479 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 1.4 t-160 -161.52 139.98 9.54 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.565 174.167 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -105.4 99.36 8.97 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 175.623 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 785' ' ' VAL . . . . . 0.835 HG22 ' HE1' ' A' ' 765' ' ' PHE . 0.0 OUTLIER -171.29 -160.98 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.953 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -133.33 68.15 1.51 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.796 -0.184 . . . . 0.0 110.659 177.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 50.2 67.95 3.9 Favored Pre-proline 0 N--CA 1.468 0.447 0 CA-C-N 115.878 -0.601 . . . . 0.0 112.011 178.095 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 788' ' ' PRO . . . . . 0.408 ' C ' ' H ' ' A' ' 790' ' ' GLU . 54.8 Cg_endo -87.36 46.77 1.41 Allowed 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 122.595 2.197 . . . . 0.0 112.947 -174.336 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 71.21 -32.26 0.24 Allowed 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.415 0.686 . . . . 0.0 112.85 175.726 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 790' ' ' GLU . . . . . 0.415 ' H ' ' HG3' ' A' ' 790' ' ' GLU . 1.8 pp20? -71.19 -37.92 72.13 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -175.78 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 791' ' ' LEU . . . . . 0.573 HD21 ' HE2' ' A' ' 765' ' ' PHE . 0.2 OUTLIER -71.12 -48.3 13.58 Favored Pre-proline 0 C--N 1.327 -0.372 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -176.362 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 792' ' ' PRO . . . . . 0.457 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 2.9 Cg_endo -53.65 -33.08 67.75 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 121.373 1.382 . . . . 0.0 112.119 173.855 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -66.79 -44.65 80.74 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 120.909 0.385 . . . . 0.0 110.464 175.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 794' ' ' LEU . . . . . 0.469 ' HA ' HD22 ' A' ' 794' ' ' LEU . 1.8 tm? -59.75 -44.36 93.86 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.292 177.155 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 795' ' ' LEU . . . . . 0.665 HD12 HG23 ' A' ' 746' ' ' VAL . 0.2 OUTLIER -59.84 -47.36 86.04 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.096 -179.282 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -62.13 -45.06 95.14 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.097 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.02 -24.63 62.4 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.352 -178.008 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -77.62 -28.65 15.96 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 CA-C-O 120.732 0.301 . . . . 0.0 111.116 -179.135 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 799' ' ' TYR . . . . . 0.454 ' HD1' ' HA ' ' A' ' 799' ' ' TYR . 0.2 OUTLIER -81.45 -16.96 50.42 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.445 178.488 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 1.8 mt . . . . . 0 C--O 1.235 0.292 0 CA-C-N 115.426 -0.807 . . . . 0.0 111.92 174.894 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 31.8 t70 . . . . . 0 N--CA 1.461 0.094 0 CA-C-O 120.779 0.324 . . . . 0.0 111.576 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.32 103.53 12.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.743 0.306 . . . . 0.0 111.049 -176.462 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 826' ' ' MET . . . . . 0.438 ' SD ' ' HA ' ' A' ' 869' ' ' ILE . 0.0 OUTLIER -100.55 117.08 33.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.495 178.949 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 827' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -113.66 120.14 62.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.93 178.811 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 828' ' ' LEU . . . . . 0.77 ' HB2' HG12 ' A' ' 869' ' ' ILE . 2.2 tm? -95.55 129.72 42.64 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 -179.03 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 829' ' ' VAL . . . . . 0.608 ' HB ' ' CZ ' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -123.44 124.22 69.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 120.725 0.298 . . . . 0.0 110.667 179.329 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 830' ' ' VAL . . . . . 0.756 HG13 ' HA ' ' A' ' 874' ' ' SER . 2.2 p -122.25 105.29 16.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.993 0.425 . . . . 0.0 111.338 -176.799 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 831' ' ' ASP . . . . . 0.687 ' HA ' ' O ' ' A' ' 875' ' ' ASP . 4.7 t0 -110.11 155.42 21.93 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.276 0.56 . . . . 0.0 111.415 -175.541 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -93.24 -21.45 19.61 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.031 -0.986 . . . . 0.0 109.496 175.184 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 10.9 m170 -110.75 118.1 49.21 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.837 -179.025 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -61.2 -40.5 49.86 Favored 'Trans proline' 0 C--O 1.234 0.313 0 C-N-CA 122.892 2.394 . . . . 0.0 112.66 -178.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 835' ' ' ILE . . . . . 0.414 HG23 ' H ' ' A' ' 836' ' ' ASN . 0.0 OUTLIER -61.04 -40.92 87.26 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.421 178.925 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 836' ' ' ASN . . . . . 0.414 ' H ' HG23 ' A' ' 835' ' ' ILE . 4.9 m120 -66.46 -46.1 77.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.638 178.282 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 837' ' ' ARG . . . . . 0.67 ' NH1' ' HB2' ' A' ' 831' ' ' ASP . 0.0 OUTLIER -52.06 -53.3 43.86 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.653 179.926 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 838' ' ' ARG . . . . . 0.495 ' HG3' ' N ' ' A' ' 839' ' ' LEU . 0.0 OUTLIER -64.24 -42.46 96.52 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.728 0.299 . . . . 0.0 111.37 -175.728 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 839' ' ' LEU . . . . . 0.495 ' N ' ' HG3' ' A' ' 838' ' ' ARG . 0.2 OUTLIER -76.3 -49.02 18.06 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -171.347 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 840' ' ' LEU . . . . . 0.528 HD13 ' NH2' ' A' ' 837' ' ' ARG . 1.7 pp -75.15 -30.04 60.64 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.387 -0.525 . . . . 0.0 111.168 -176.624 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -71.87 -25.26 61.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.822 0.344 . . . . 0.0 110.24 175.493 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -63.59 -44.66 93.37 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 172.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 843' ' ' GLN . . . . . 0.511 ' HG2' HD22 ' A' ' 929' ' ' LEU . 1.4 mt-30 -62.7 -38.3 89.88 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.286 176.397 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 844' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.81 -34.91 76.78 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.229 0.538 . . . . 0.0 110.416 175.12 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -68.45 -31.77 74.44 Favored Glycine 0 N--CA 1.446 -0.644 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.993 176.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -68.65 -24.85 64.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.939 0.4 . . . . 0.0 110.413 177.088 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 847' ' ' LEU . . . . . 0.513 HD23 ' HA ' ' A' ' 933' ' ' LYS . 0.2 OUTLIER -68.29 -38.38 81.61 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.442 174.995 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 92.0 55.66 1.71 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.742 -0.742 . . . . 0.0 113.094 175.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -136.14 164.18 28.62 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 177.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 850' ' ' GLN . . . . . 0.404 ' O ' ' HA ' ' A' ' 826' ' ' MET . 0.0 OUTLIER -80.65 108.34 14.22 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 -179.45 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -112.16 148.37 34.15 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.634 -176.122 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 852' ' ' LYS . . . . . 0.416 ' O ' HD21 ' A' ' 828' ' ' LEU . 0.0 OUTLIER -121.51 116.83 25.41 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 175.007 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 32.8 p -92.68 128.62 38.61 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.836 -178.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 854' ' ' ALA . . . . . 0.496 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -137.35 132.35 33.45 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.367 176.796 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -112.21 73.7 0.83 Allowed 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 172.235 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 856' ' ' ASP . . . . . 0.625 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 2.1 t0 -173.56 126.82 0.41 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.074 -0.966 . . . . 0.0 109.689 -170.929 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -71.86 -61.87 3.61 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.197 -177.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -59.23 -31.51 46.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 111.933 0.346 . . . . 0.0 111.933 -178.43 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 859' ' ' ASP . . . . . 0.625 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 0.2 OUTLIER -68.91 -20.85 64.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.578 0.227 . . . . 0.0 111.364 -178.049 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 860' ' ' ALA . . . . . 0.448 ' O ' ' HB2' ' A' ' 864' ' ' LEU . . . -64.77 -36.27 83.78 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.975 0.417 . . . . 0.0 110.078 176.165 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 861' ' ' LEU . . . . . 0.607 HD13 ' HG2' ' A' ' 889' ' ' ARG . 1.3 mt -71.56 -37.22 71.1 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.706 175.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 36.4 t-20 -56.18 -53.16 60.46 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 114.98 -1.009 . . . . 0.0 111.034 179.636 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 863' ' ' VAL . . . . . 0.434 HG12 ' N ' ' A' ' 864' ' ' LEU . 8.3 p -72.79 -32.71 41.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.49 -178.054 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 864' ' ' LEU . . . . . 0.502 HD22 HG23 ' A' ' 872' ' ' VAL . 0.2 OUTLIER -62.71 -45.87 90.75 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.024 0.44 . . . . 0.0 110.857 -179.956 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 1.4 m -80.2 -20.05 45.61 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.015 -178.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -74.09 -52.14 13.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.072 0.463 . . . . 0.0 110.58 178.104 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -109.84 -88.22 0.5 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.02 -179.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 868' ' ' HIS . . . . . 0.492 ' O ' ' HB ' ' A' ' 869' ' ' ILE . 0.2 OUTLIER 172.73 -64.87 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 O-C-N 123.267 0.355 . . . . 0.0 110.662 -179.409 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 869' ' ' ILE . . . . . 0.77 HG12 ' HB2' ' A' ' 828' ' ' LEU . 1.7 mp 71.89 142.66 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 O-C-N 123.783 0.677 . . . . 0.0 110.496 -175.368 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 870' ' ' ASP . . . . . 0.512 ' N ' HG23 ' A' ' 869' ' ' ILE . 0.1 OUTLIER -87.01 -42.66 12.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.883 0.373 . . . . 0.0 111.323 -176.118 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 871' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -141.07 136.16 33.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.158 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 872' ' ' VAL . . . . . 0.733 HG22 HG22 ' A' ' 869' ' ' ILE . 3.2 t -115.1 131.57 66.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.725 -178.728 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 873' ' ' LEU . . . . . 0.467 ' HA ' ' O ' ' A' ' 900' ' ' ILE . 1.9 mt -113.35 118.84 35.69 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 173.635 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 874' ' ' SER . . . . . 0.756 ' HA ' HG13 ' A' ' 830' ' ' VAL . 72.1 p -105.56 97.02 6.91 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.046 0.45 . . . . 0.0 110.282 -178.726 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 875' ' ' ASP . . . . . 0.687 ' O ' ' HA ' ' A' ' 831' ' ' ASP . 0.0 OUTLIER -87.9 105.8 17.67 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.841 -179.317 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 876' ' ' VAL . . . . . 0.593 HG22 ' H ' ' A' ' 878' ' ' MET . 5.1 p -127.19 143.11 41.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-O 121.226 0.536 . . . . 0.0 111.14 -176.203 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -98.12 -0.41 44.43 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.599 179.205 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 878' ' ' MET . . . . . 0.593 ' H ' HG22 ' A' ' 876' ' ' VAL . 2.2 tpp . . . . . 0 C--N 1.326 -0.442 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.516 -179.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.232 0 CA-C-O 120.482 -0.066 . . . . 0.0 113.039 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 1.7 p90 -63.52 -22.11 66.71 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.982 0.42 . . . . 0.0 111.541 -174.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 885' ' ' ARG . . . . . 0.47 ' H ' ' HG3' ' A' ' 885' ' ' ARG . 0.2 OUTLIER -66.27 -31.8 72.83 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.865 0.364 . . . . 0.0 110.139 176.594 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -69.39 -49.59 53.89 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 178.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.57 -39.62 94.26 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.072 0.463 . . . . 0.0 110.935 179.797 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 888' ' ' GLN . . . . . 0.795 ' HA ' ' HD3' ' A' ' 891' ' ' ARG . 1.4 tp-100 -61.01 -45.51 94.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.972 175.23 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 889' ' ' ARG . . . . . 0.607 ' HG2' HD13 ' A' ' 861' ' ' LEU . 0.0 OUTLIER -60.34 -42.95 96.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.777 179.564 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 890' ' ' ILE . . . . . 0.551 HD12 HD22 ' A' ' 861' ' ' LEU . 11.4 mm -58.69 -52.3 61.59 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.024 179.657 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 891' ' ' ARG . . . . . 0.795 ' HD3' ' HA ' ' A' ' 888' ' ' GLN . 0.4 OUTLIER -68.38 -30.09 68.94 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.42 -178.153 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -74.23 -34.85 63.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.594 -177.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 893' ' ' LEU . . . . . 0.52 HD23 HD21 ' A' ' 861' ' ' LEU . 0.6 OUTLIER -75.16 -46.73 32.29 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.838 177.608 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 133.23 89.01 0.38 Allowed Glycine 0 N--CA 1.443 -0.89 0 C-N-CA 120.638 -0.792 . . . . 0.0 112.42 179.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 895' ' ' LEU . . . . . 0.676 HD13 ' H ' ' A' ' 895' ' ' LEU . 0.0 OUTLIER -77.93 150.26 34.06 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.041 0.448 . . . . 0.0 110.783 177.918 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -135.54 13.74 3.46 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.985 -178.569 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 897' ' ' LEU . . . . . 0.414 HD21 HD11 ' A' ' 864' ' ' LEU . 1.7 pt? -149.03 154.41 39.48 Favored Pre-proline 0 C--N 1.32 -0.706 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.409 -173.609 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_exo -67.2 122.57 9.87 Favored 'Trans proline' 0 C--O 1.238 0.517 0 C-N-CA 122.873 2.382 . . . . 0.0 112.153 178.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 899' ' ' VAL . . . . . 0.799 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 18.9 t -103.19 108.3 24.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 121.266 0.555 . . . . 0.0 110.451 178.048 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 900' ' ' ILE . . . . . 0.467 ' O ' ' HA ' ' A' ' 873' ' ' LEU . 8.1 mt -96.15 102.84 14.0 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.717 178.355 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -89.94 124.71 7.55 Favored Glycine 0 N--CA 1.44 -1.049 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.475 -176.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 902' ' ' VAL . . . . . 0.51 ' CG2' ' HA ' ' A' ' 925' ' ' LYS . 0.1 OUTLIER -103.33 106.84 20.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 174.438 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 17.8 p -108.53 144.63 35.94 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.063 -173.447 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 904' ' ' ALA . . . . . 0.478 ' HA ' ' HB2' ' A' ' 925' ' ' LYS . . . -74.59 103.26 4.83 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.789 -0.364 . . . . 0.0 110.586 177.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 42.34 73.33 0.14 Allowed 'General case' 0 N--CA 1.468 0.44 0 O-C-N 124.225 0.953 . . . . 0.0 112.854 176.428 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -81.2 -14.08 57.92 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.244 177.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 51.8 mt 74.29 -60.44 0.52 Allowed 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.501 179.135 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -107.64 54.97 0.65 Allowed 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 175.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -44.71 -46.74 10.52 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.506 -0.77 . . . . 0.0 112.287 -177.09 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 910' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -44.97 95.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.809 0.338 . . . . 0.0 111.413 -177.829 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.82 -38.26 79.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.012 0.434 . . . . 0.0 110.462 -178.847 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 912' ' ' GLN . . . . . 0.633 ' O ' ' HG2' ' A' ' 916' ' ' GLU . 1.7 tt0 -60.81 -45.91 92.59 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.0 176.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -57.76 -35.27 70.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.305 178.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 61.7 m -68.72 -35.64 77.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.475 177.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 915' ' ' LEU . . . . . 0.53 ' HA ' HD22 ' A' ' 915' ' ' LEU . 0.3 OUTLIER -70.17 -32.69 70.75 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.055 0.455 . . . . 0.0 110.424 177.769 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 916' ' ' GLU . . . . . 0.633 ' HG2' ' O ' ' A' ' 912' ' ' GLN . 53.3 mm-40 -67.9 -38.72 83.32 Favored 'General case' 0 C--O 1.226 -0.178 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.651 176.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 50.06 24.66 1.45 Allowed 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.379 0.671 . . . . 0.0 112.755 176.55 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 918' ' ' GLY . . . . . 0.429 ' HA3' ' HB3' ' A' ' 891' ' ' ARG . . . -147.49 25.94 1.52 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.143 -177.502 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 919' ' ' MET . . . . . 0.799 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 2.1 mtt -118.18 -116.89 0.32 Allowed 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.614 0.245 . . . . 0.0 110.671 -175.234 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 920' ' ' ASP . . . . . 0.464 ' H ' ' HB3' ' A' ' 919' ' ' MET . 3.6 t70 175.56 -59.36 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.261 177.017 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 37.6 m -136.6 157.81 45.91 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.876 178.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 922' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -132.12 142.58 49.55 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.688 0.28 . . . . 0.0 111.031 -177.343 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 923' ' ' LEU . . . . . 0.501 HD11 ' HB ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -145.14 170.35 16.4 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 174.362 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 17.3 m -93.33 153.87 18.3 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 120.636 0.255 . . . . 0.0 111.13 -178.173 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 925' ' ' LYS . . . . . 0.559 ' HE3' ' HB3' ' A' ' 875' ' ' ASP . 0.0 OUTLIER -50.02 -49.2 76.34 Favored Pre-proline 0 CA--C 1.538 0.513 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 -178.64 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 926' ' ' PRO . . . . . 0.492 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 16.0 Cg_endo -58.15 103.03 0.14 Allowed 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 121.984 1.789 . . . . 0.0 111.714 174.558 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -125.73 154.72 34.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.709 -175.169 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 928' ' ' THR . . . . . 0.539 ' H ' HG13 ' A' ' 931' ' ' VAL . 0.8 OUTLIER -115.03 161.32 18.51 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.129 177.676 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 929' ' ' LEU . . . . . 0.511 HD22 ' HG2' ' A' ' 843' ' ' GLN . 0.6 OUTLIER -61.74 -42.24 98.71 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.849 0.357 . . . . 0.0 110.418 178.877 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -60.21 -50.01 75.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.275 -179.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 931' ' ' VAL . . . . . 0.539 HG13 ' H ' ' A' ' 928' ' ' THR . 1.4 p -71.65 -30.46 38.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-O 120.516 0.198 . . . . 0.0 111.254 -177.592 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 932' ' ' ILE . . . . . 0.509 ' N ' HG11 ' A' ' 931' ' ' VAL . 0.4 OUTLIER -70.48 -38.42 73.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 177.723 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 933' ' ' LYS . . . . . 0.513 ' HA ' HD23 ' A' ' 847' ' ' LEU . 1.5 tmtm? -67.82 -42.16 81.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.02 176.163 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -48.96 79.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.929 179.383 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 11.9 m -63.72 -43.95 95.02 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.333 -179.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 936' ' ' LEU . . . . . 0.509 HD23 HD21 ' A' ' 847' ' ' LEU . 0.0 OUTLIER -62.22 -56.83 14.76 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.773 179.995 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 25.5 m -59.04 -48.23 82.35 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.708 -178.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.02 -45.97 86.04 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.353 -175.283 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 939' ' ' TYR . . . . . 0.426 ' HA ' ' HB3' ' A' ' 942' ' ' ARG . 0.6 OUTLIER -80.81 -31.48 35.59 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.696 -0.402 . . . . 0.0 111.524 -176.647 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 940' ' ' ALA . . . . . 0.49 ' HB1' ' O ' ' A' ' 936' ' ' LEU . . . -61.26 -43.75 98.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.94 0.4 . . . . 0.0 110.451 176.407 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 941' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.45 -34.59 70.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.341 177.736 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 942' ' ' ARG . . . . . 0.426 ' HB3' ' HA ' ' A' ' 939' ' ' TYR . 6.8 ttt85 -65.08 -48.06 75.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.979 -177.906 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 26.9 m -71.27 -30.76 41.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.799 0.333 . . . . 0.0 110.558 -178.412 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 19.5 mtp85 -71.38 -37.5 71.58 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.819 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.15 -23.95 35.31 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.683 0.278 . . . . 0.0 111.135 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 57.1 m -76.24 -28.54 57.18 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.192 0.52 . . . . 0.0 110.281 175.576 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 1.7 mtp180 -84.94 -19.52 32.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.571 173.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 27.7 t0 . . . . . 0 CA--C 1.521 -0.165 0 CA-C-N 114.587 -1.188 . . . . 0.0 110.843 -177.759 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 705' ' ' SER . . . . . 0.504 ' HA ' ' HA3' ' A' ' 730' ' ' GLY . 2.6 m . . . . . 0 CA--C 1.533 0.325 0 CA-C-O 121.135 0.493 . . . . 0.0 111.846 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 100.1 -23.09 37.29 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.872 -0.68 . . . . 0.0 113.098 174.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 707' ' ' LYS . . . . . 0.478 ' HB2' HD11 ' A' ' 731' ' ' ILE . 17.4 mmtt -82.3 153.0 26.06 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 122.803 -0.234 . . . . 0.0 110.438 -179.7 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 708' ' ' ARG . . . . . 0.462 ' HA ' HG11 ' A' ' 732' ' ' VAL . 0.0 OUTLIER -103.38 159.42 15.58 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.871 0.367 . . . . 0.0 110.863 -176.828 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 709' ' ' CYS . . . . . 0.531 ' HB2' HG23 ' A' ' 731' ' ' ILE . 0.0 OUTLIER -142.44 119.54 11.4 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.635 175.049 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 710' ' ' TRP . . . . . . . . . . . . . 86.5 m95 -98.21 123.57 42.35 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.894 0.378 . . . . 0.0 110.047 -179.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 711' ' ' LEU . . . . . 0.489 ' O ' ' HG ' ' A' ' 711' ' ' LEU . 0.6 OUTLIER -119.99 123.33 43.22 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 121.527 0.679 . . . . 0.0 110.899 -179.164 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -105.82 32.73 4.16 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.111 175.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 713' ' ' VAL . . . . . 0.901 HG13 ' HB2' ' A' ' 750' ' ' ASP . 4.0 t -79.53 102.28 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.894 179.173 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 714' ' ' ARG . . . . . 0.524 ' H ' ' HB3' ' A' ' 750' ' ' ASP . 2.9 mtp180 -73.35 -18.28 61.2 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.682 -178.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -77.36 111.1 12.67 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.591 -0.732 . . . . 0.0 109.789 176.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 716' ' ' ALA . . . . . 0.553 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -63.61 -37.85 88.9 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.769 0.285 . . . . 0.0 111.769 -173.579 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.89 -47.31 75.27 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.008 0.432 . . . . 0.0 110.372 179.64 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 718' ' ' LEU . . . . . 0.543 HD12 ' HA ' ' A' ' 786' ' ' ALA . 0.2 OUTLIER -69.22 -43.54 73.88 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.198 179.229 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 719' ' ' CYS . . . . . 0.553 ' SG ' ' HA ' ' A' ' 716' ' ' ALA . 2.5 p -65.5 -46.54 79.28 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.094 -176.263 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 720' ' ' GLN . . . . . 0.407 ' N ' ' SG ' ' A' ' 719' ' ' CYS . 2.0 tt0 -61.66 -43.32 99.07 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 121.041 -0.263 . . . . 0.0 110.692 -179.73 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -59.53 -57.65 12.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.029 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 9.5 mt -56.73 -46.1 81.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.078 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 723' ' ' GLU . . . . . 0.476 ' HB3' ' O ' ' A' ' 719' ' ' CYS . 0.0 OUTLIER -59.85 -40.42 88.48 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.861 -177.264 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 724' ' ' THR . . . . . . . . . . . . . 9.6 m -67.55 -43.28 81.07 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.793 0.33 . . . . 0.0 111.071 -179.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 48.7 m -64.2 -32.92 74.69 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.657 -179.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 726' ' ' LEU . . . . . 0.442 HD21 ' SG ' ' A' ' 709' ' ' CYS . 3.5 mt -82.15 -45.79 14.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.576 -178.432 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 14.8 pt20 -64.95 -22.23 66.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.698 0.285 . . . . 0.0 111.343 -177.43 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 1.7 ptt-85 -65.61 -21.88 66.62 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.109 0.481 . . . . 0.0 110.629 177.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 3.2 m -100.98 16.13 26.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.15 0.5 . . . . 0.0 110.727 178.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 730' ' ' GLY . . . . . 0.504 ' HA3' ' HA ' ' A' ' 705' ' ' SER . . . 83.74 14.88 71.93 Favored Glycine 0 N--CA 1.449 -0.451 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.921 176.333 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 731' ' ' ILE . . . . . 0.531 HG23 ' HB2' ' A' ' 709' ' ' CYS . 8.0 mm -95.37 105.28 16.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-O 120.841 0.353 . . . . 0.0 110.114 179.491 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 732' ' ' VAL . . . . . 0.462 HG11 ' HA ' ' A' ' 708' ' ' ARG . 1.1 p -69.07 110.14 2.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.684 0.754 . . . . 0.0 110.555 -177.061 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 733' ' ' VAL . . . . . 0.442 ' H ' HG21 ' A' ' 733' ' ' VAL . 0.1 OUTLIER -87.47 134.63 27.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.755 -178.138 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -138.72 139.15 38.27 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.555 -178.656 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 1.9 m -69.12 123.49 21.24 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.641 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 33.1 t80 -84.66 101.75 12.41 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.886 -178.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.2 -50.46 4.13 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.841 176.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -169.6 42.9 0.21 Allowed Glycine 0 N--CA 1.447 -0.592 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.352 178.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 13.9 mp0 -86.39 175.1 8.58 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.731 0.301 . . . . 0.0 110.871 -177.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.38 146.16 50.04 Favored Pre-proline 0 C--N 1.325 -0.496 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.001 -176.508 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 741' ' ' PRO . . . . . 0.551 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 85.3 Cg_endo -83.82 146.91 11.92 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 122.809 2.339 . . . . 0.0 112.731 178.365 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 742' ' ' THR . . . . . 0.814 HG21 ' HD2' ' A' ' 743' ' ' PRO . 0.2 OUTLIER -133.18 141.91 42.49 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.407 178.538 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 743' ' ' PRO . . . . . 0.814 ' HD2' HG21 ' A' ' 742' ' ' THR . 38.2 Cg_endo -66.57 -9.23 23.53 Favored 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 123.025 2.483 . . . . 0.0 113.447 -178.649 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 744' ' ' GLU . . . . . 0.412 ' CD ' ' HZ3' ' A' ' 707' ' ' LYS . 0.3 OUTLIER -107.21 -3.55 19.69 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.963 0.411 . . . . 0.0 110.456 176.928 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -102.36 144.12 31.25 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.847 -174.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 3.4 p -114.9 139.49 40.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.44 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 747' ' ' LEU . . . . . 0.481 HD12 ' HB2' ' A' ' 757' ' ' TRP . 0.1 OUTLIER -104.17 110.7 23.0 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.28 177.893 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -97.26 107.53 20.12 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 176.388 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 17.6 p -104.56 148.57 26.35 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.001 0.429 . . . . 0.0 111.735 -172.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 750' ' ' ASP . . . . . 0.901 ' HB2' HG13 ' A' ' 713' ' ' VAL . 2.9 t70 -96.52 108.78 21.41 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 170.389 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 751' ' ' GLU . . . . . 0.412 ' CD ' ' HB2' ' A' ' 769' ' ' HIS . 18.2 mm-40 62.93 -147.3 0.36 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.238 -174.757 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 752' ' ' VAL . . . . . 0.69 HG12 ' HA3' ' A' ' 771' ' ' GLY . 2.1 t -79.86 133.78 28.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.758 -174.367 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 11.3 p -117.97 141.32 37.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.417 178.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.67 53.31 2.72 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.225 -178.804 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -157.85 131.76 8.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.422 -179.193 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 756' ' ' LYS . . . . . 0.484 ' HA ' ' HD2' ' A' ' 756' ' ' LYS . 0.1 OUTLIER -91.01 81.9 5.61 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.229 0.537 . . . . 0.0 110.114 177.869 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 757' ' ' TRP . . . . . 0.551 ' CH2' ' HA ' ' A' ' 741' ' ' PRO . 64.3 t-105 -65.24 124.57 22.53 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.604 178.304 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -131.49 62.56 1.62 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.206 0.527 . . . . 0.0 110.227 176.394 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 759' ' ' GLY . . . . . . . . . . . . . . . -109.8 -118.98 4.07 Favored Glycine 0 N--CA 1.444 -0.783 0 C-N-CA 120.786 -0.721 . . . . 0.0 111.565 178.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -78.45 -49.66 13.05 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.078 0.466 . . . . 0.0 110.102 177.145 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -168.16 164.64 13.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.533 179.425 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 2.5 p -141.1 126.66 19.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.453 175.195 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 3.6 t -119.52 114.7 45.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.631 -176.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 764' ' ' THR . . . . . . . . . . . . . 23.7 m -95.45 113.29 24.93 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.226 -179.114 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 765' ' ' PHE . . . . . 0.434 ' HA ' ' O ' ' A' ' 783' ' ' HIS . 30.4 m-85 -84.85 109.3 18.0 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 174.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 766' ' ' CYS . . . . . 0.541 ' O ' ' HA ' ' A' ' 784' ' ' SER . 0.0 OUTLIER -96.48 153.9 17.58 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.911 -174.075 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 11.9 ptt85 -140.39 -37.98 0.45 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.123 176.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.26 34.52 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -179.313 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . 0.412 ' HB2' ' CD ' ' A' ' 751' ' ' GLU . 0.1 OUTLIER -135.65 -71.41 0.47 Allowed 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 110.089 -0.337 . . . . 0.0 110.089 174.016 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 3.9 mt 64.09 101.19 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.403 176.264 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 771' ' ' GLY . . . . . 0.69 ' HA3' HG12 ' A' ' 752' ' ' VAL . . . -125.13 -4.92 6.95 Favored Glycine 0 N--CA 1.451 -0.306 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.014 176.731 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 772' ' ' ILE . . . . . 0.458 HG23 ' N ' ' A' ' 773' ' ' PRO . 1.1 mp -104.33 146.45 32.62 Favored Pre-proline 0 C--N 1.325 -0.461 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 178.266 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 773' ' ' PRO . . . . . 0.499 ' O ' ' HB3' ' A' ' 774' ' ' LEU . 32.8 Cg_exo -60.01 -100.77 0.0 OUTLIER 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.932 2.421 . . . . 0.0 112.627 179.387 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . 0.968 ' HA ' HG13 ' A' ' 782' ' ' VAL . 0.4 OUTLIER 172.49 -167.52 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -179.582 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 775' ' ' GLU . . . . . 0.655 ' HG3' ' HA ' ' A' ' 781' ' ' TRP . 1.5 mp0 -61.42 69.24 0.01 OUTLIER 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.824 0.821 . . . . 0.0 112.393 173.455 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.04 6.02 2.36 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 114.573 -1.194 . . . . 0.0 108.771 173.441 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 777' ' ' ALA . . . . . 0.619 ' HB1' ' HB2' ' A' ' 780' ' ' GLU . . . -127.72 162.49 48.97 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-N 114.745 -1.116 . . . . 0.0 109.409 -179.625 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 778' ' ' PRO . . . . . 0.514 ' HD2' ' HB2' ' A' ' 777' ' ' ALA . 55.6 Cg_endo -68.99 66.67 1.31 Allowed 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 122.977 2.451 . . . . 0.0 113.474 -177.196 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 118.48 31.23 1.54 Allowed Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.631 178.038 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 780' ' ' GLU . . . . . 0.629 ' O ' ' HA ' ' A' ' 775' ' ' GLU . 1.4 tt0 -115.29 129.04 56.5 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 178.445 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 781' ' ' TRP . . . . . 0.655 ' HA ' ' HG3' ' A' ' 775' ' ' GLU . 26.6 m95 -134.3 144.58 48.4 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 -179.356 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . 0.968 HG13 ' HA ' ' A' ' 774' ' ' LEU . 10.7 m -134.55 151.76 32.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 120.834 0.35 . . . . 0.0 110.63 172.613 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 783' ' ' HIS . . . . . 0.434 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.3 OUTLIER -162.98 121.88 2.12 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.664 176.362 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 784' ' ' SER . . . . . 0.541 ' HA ' ' O ' ' A' ' 766' ' ' CYS . 0.3 OUTLIER -88.65 100.91 13.47 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.582 177.274 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 785' ' ' VAL . . . . . 0.778 HG11 ' H ' ' A' ' 787' ' ' ALA . 2.0 p 178.55 170.34 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.158 -0.473 . . . . 0.0 109.893 -173.501 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 786' ' ' ALA . . . . . 0.543 ' HA ' HD12 ' A' ' 718' ' ' LEU . . . -103.59 32.23 3.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.575 0.226 . . . . 0.0 111.265 179.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 787' ' ' ALA . . . . . 0.778 ' H ' HG11 ' A' ' 785' ' ' VAL . . . 57.2 70.45 1.36 Allowed Pre-proline 0 N--CA 1.468 0.43 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.145 177.906 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 788' ' ' PRO . . . . . 0.614 ' HD2' ' OE1' ' A' ' 790' ' ' GLU . 24.2 Cg_exo -63.29 -50.15 3.9 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.727 2.284 . . . . 0.0 112.534 -178.213 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 789' ' ' HIS . . . . . 0.46 ' O ' ' HB1' ' A' ' 793' ' ' ALA . 6.5 p-80 -177.12 -29.5 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -178.01 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 790' ' ' GLU . . . . . 0.614 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -74.22 -50.38 19.37 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 111.833 0.308 . . . . 0.0 111.833 -171.105 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 791' ' ' LEU . . . . . 0.514 HD21 ' HA ' ' A' ' 791' ' ' LEU . 0.2 OUTLIER -65.4 -47.47 69.44 Favored Pre-proline 0 CA--C 1.538 0.503 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -176.81 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 792' ' ' PRO . . . . . 0.48 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 9.2 Cg_endo -58.35 -32.01 95.15 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 121.254 1.302 . . . . 0.0 112.03 174.013 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 793' ' ' ALA . . . . . 0.46 ' HB1' ' O ' ' A' ' 789' ' ' HIS . . . -70.45 -37.0 74.26 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 120.83 0.347 . . . . 0.0 110.749 177.222 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 794' ' ' LEU . . . . . 0.417 HD12 ' CH2' ' A' ' 781' ' ' TRP . 0.1 OUTLIER -61.51 -42.26 98.55 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.021 176.016 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 795' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.66 -42.56 93.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.395 178.354 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -64.76 -37.64 88.27 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.002 178.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.3 -26.5 63.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.393 179.075 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -69.12 -36.45 73.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.35 0.595 . . . . 0.0 109.915 177.137 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -77.34 -18.53 57.35 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.195 177.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 2.9 tp . . . . . 0 N--CA 1.465 0.296 0 C-N-CA 124.244 1.018 . . . . 0.0 112.904 175.455 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 12.1 t0 . . . . . 0 N--CA 1.453 -0.315 0 CA-C-O 121.084 0.469 . . . . 0.0 110.353 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 17.5 ttm -109.8 108.25 18.51 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.734 178.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 826' ' ' MET . . . . . 0.465 ' HB2' ' HE1' ' A' ' 826' ' ' MET . 0.5 OUTLIER -95.72 108.79 21.13 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.19 0.519 . . . . 0.0 110.139 -179.346 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 827' ' ' ILE . . . . . 0.442 HG22 HD23 ' A' ' 873' ' ' LEU . 1.6 mt -110.32 125.65 67.57 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.299 179.112 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 828' ' ' LEU . . . . . 0.442 HD22 ' HB3' ' A' ' 852' ' ' LYS . 1.7 tm? -94.9 123.09 38.17 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.859 -178.126 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -117.93 118.03 56.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.05 0.452 . . . . 0.0 110.651 179.704 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 830' ' ' VAL . . . . . 0.506 HG12 ' HB1' ' A' ' 854' ' ' ALA . 0.0 OUTLIER -119.52 84.92 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.498 178.497 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 831' ' ' ASP . . . . . 0.9 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 27.1 t0 -95.28 120.62 35.82 Favored 'General case' 0 CA--C 1.515 -0.39 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 -179.685 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 832' ' ' ASP . . . . . 0.473 ' OD2' ' HB2' ' A' ' 877' ' ' ASN . 0.0 OUTLIER -52.69 -27.49 17.68 Favored 'General case' 0 CA--C 1.537 0.466 0 O-C-N 123.482 0.489 . . . . 0.0 112.187 -177.582 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 833' ' ' HIS . . . . . 0.422 ' HA ' ' HD2' ' A' ' 834' ' ' PRO . 0.5 OUTLIER -98.43 109.56 53.09 Favored Pre-proline 0 C--N 1.325 -0.471 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 -177.99 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 834' ' ' PRO . . . . . 0.422 ' HD2' ' HA ' ' A' ' 833' ' ' HIS . 9.5 Cg_endo -51.59 -44.18 45.77 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 123.443 2.762 . . . . 0.0 113.445 -175.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 835' ' ' ILE . . . . . 0.46 HD13 ' HA ' ' A' ' 835' ' ' ILE . 0.2 OUTLIER -68.32 -39.17 80.56 Favored 'Isoleucine or valine' 0 C--O 1.237 0.415 0 CA-C-O 120.754 0.311 . . . . 0.0 110.972 -177.222 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 836' ' ' ASN . . . . . 0.563 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 1.5 t30 -73.55 -39.83 64.42 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 179.618 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 837' ' ' ARG . . . . . 0.9 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 1.5 ttt180 -53.85 -42.62 68.74 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.171 176.473 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.56 -43.52 89.6 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.839 178.841 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.38 -48.17 71.0 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.143 -172.834 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 840' ' ' LEU . . . . . 0.563 ' HG ' ' O ' ' A' ' 836' ' ' ASN . 0.3 OUTLIER -74.38 -27.27 60.58 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.502 -0.479 . . . . 0.0 111.016 -179.072 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 841' ' ' ALA . . . . . 0.49 ' HB1' ' O ' ' A' ' 837' ' ' ARG . . . -68.88 -29.9 68.29 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.138 0.494 . . . . 0.0 109.848 175.364 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -64.77 -42.55 95.02 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.729 174.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 843' ' ' GLN . . . . . 0.558 ' HG2' HD23 ' A' ' 929' ' ' LEU . 41.5 mt-30 -62.75 -45.49 92.47 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.267 175.859 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 844' ' ' LEU . . . . . 0.428 HD12 HD12 ' A' ' 932' ' ' ILE . 0.1 OUTLIER -58.24 -46.16 86.43 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.244 179.008 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -64.15 -39.75 97.43 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 121.09 -0.576 . . . . 0.0 112.365 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 5.8 m -67.26 -23.44 65.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.884 0.373 . . . . 0.0 110.959 179.101 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 81.4 mt -75.13 -21.43 58.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.927 0.394 . . . . 0.0 110.455 177.445 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 106.62 3.7 37.28 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.618 177.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 39.2 m-85 -95.55 140.4 30.45 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.936 0.398 . . . . 0.0 110.753 -178.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 5.3 mp0 -76.43 115.66 16.38 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.066 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -107.97 135.51 49.23 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.774 -175.32 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 852' ' ' LYS . . . . . 0.442 ' HB3' HD22 ' A' ' 828' ' ' LEU . 0.0 OUTLIER -107.17 110.74 22.89 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 173.463 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 853' ' ' THR . . . . . 0.569 HG23 ' HG3' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -90.69 121.55 32.69 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.991 -0.55 . . . . 0.0 112.479 -171.563 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 854' ' ' ALA . . . . . 0.506 ' HB1' HG12 ' A' ' 830' ' ' VAL . . . -147.97 171.27 16.07 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.062 174.688 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 13.9 p-10 -144.95 75.8 1.46 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.754 0.788 . . . . 0.0 111.258 178.142 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 856' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -171.41 136.1 0.98 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.49 177.323 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -66.69 -41.44 93.83 Favored Glycine 0 N--CA 1.448 -0.512 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.895 -178.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 1.5 t -74.29 -36.24 42.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.645 0.26 . . . . 0.0 111.285 -177.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -63.18 -23.95 67.66 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.847 0.356 . . . . 0.0 111.196 -179.194 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -61.82 -35.61 78.73 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.151 0.5 . . . . 0.0 110.347 176.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 861' ' ' LEU . . . . . 0.649 HD12 ' HB3' ' A' ' 889' ' ' ARG . 0.3 OUTLIER -75.05 -35.8 61.87 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.478 177.074 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -63.01 -49.32 75.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.528 179.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 863' ' ' VAL . . . . . 0.471 HG13 HD13 ' A' ' 869' ' ' ILE . 6.5 p -66.13 -31.3 53.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.941 178.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 864' ' ' LEU . . . . . 0.833 ' HG ' HD13 ' A' ' 895' ' ' LEU . 0.7 OUTLIER -59.55 -40.77 88.37 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.061 0.458 . . . . 0.0 110.327 175.041 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 1.5 m -79.27 -30.22 42.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.99 -179.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.44 -60.53 2.37 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.309 0.576 . . . . 0.0 110.773 178.489 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 867' ' ' ASN . . . . . 0.484 ' HB3' ' H ' ' A' ' 868' ' ' HIS . 1.4 t-20 -104.95 -119.44 0.22 Allowed 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 177.914 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 868' ' ' HIS . . . . . 0.484 ' H ' ' HB3' ' A' ' 867' ' ' ASN . 0.1 OUTLIER -163.8 -45.58 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 110.499 -0.186 . . . . 0.0 110.499 173.183 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 869' ' ' ILE . . . . . 0.471 HD13 HG13 ' A' ' 863' ' ' VAL . 2.7 mp 73.32 146.93 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 O-C-N 123.613 0.571 . . . . 0.0 111.293 174.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 870' ' ' ASP . . . . . 0.452 ' N ' HG21 ' A' ' 869' ' ' ILE . 65.2 m-20 -85.54 -49.97 7.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.204 0.526 . . . . 0.0 110.672 -179.491 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 871' ' ' ILE . . . . . 0.678 HG12 ' HD2' ' A' ' 939' ' ' TYR . 0.8 OUTLIER -135.42 133.64 52.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.936 -0.575 . . . . 0.0 109.905 -179.729 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 872' ' ' VAL . . . . . 0.574 HG23 HD11 ' A' ' 897' ' ' LEU . 64.6 t -115.87 127.94 73.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.592 -178.315 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 873' ' ' LEU . . . . . 0.486 ' HB3' HD13 ' A' ' 900' ' ' ILE . 0.6 OUTLIER -120.14 115.07 22.93 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.144 0.497 . . . . 0.0 110.196 175.298 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -100.19 125.93 46.4 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.162 179.364 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 875' ' ' ASP . . . . . 0.718 ' HB3' ' HA ' ' A' ' 831' ' ' ASP . 1.2 t70 -109.6 123.89 50.22 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.336 0.588 . . . . 0.0 111.012 -179.291 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 876' ' ' VAL . . . . . 0.47 HG21 HG21 ' A' ' 903' ' ' THR . 0.1 OUTLIER -116.29 94.56 3.18 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.285 177.827 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 877' ' ' ASN . . . . . 0.736 ' HA ' ' HB3' ' A' ' 904' ' ' ALA . 68.6 m-80 -63.11 -27.18 69.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.792 174.28 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.533 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.447 174.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 -0.131 0 N-CA-C 112.017 -0.433 . . . . 0.0 112.017 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -160.78 -49.01 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -61.6 -46.48 89.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.877 179.436 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 886' ' ' LEU . . . . . 0.571 HD11 HD13 ' A' ' 890' ' ' ILE . 0.0 OUTLIER -66.93 -43.9 82.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.72 -178.031 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.23 -47.2 83.5 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.242 -179.021 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -59.41 -44.21 92.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.11 -179.314 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 889' ' ' ARG . . . . . 0.649 ' HB3' HD12 ' A' ' 861' ' ' LEU . 0.1 OUTLIER -70.13 -38.28 75.52 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.298 -177.518 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 890' ' ' ILE . . . . . 0.571 HD13 HD11 ' A' ' 886' ' ' LEU . 9.8 mt -59.63 -49.21 84.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.041 0.448 . . . . 0.0 110.985 -179.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 891' ' ' ARG . . . . . . . . . . . . . 35.9 ptt85 -75.69 -23.67 56.18 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.102 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.25 -44.66 94.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.158 176.854 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.15 -31.06 64.04 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.943 174.55 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 90.7 66.64 1.18 Allowed Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.25 177.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 895' ' ' LEU . . . . . 0.833 HD13 ' HG ' ' A' ' 864' ' ' LEU . 0.1 OUTLIER -65.78 111.54 3.29 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 110.016 -0.365 . . . . 0.0 110.016 177.889 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.63 -11.99 54.86 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.755 -175.668 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 897' ' ' LEU . . . . . 0.574 HD13 HD23 ' A' ' 864' ' ' LEU . 0.0 OUTLIER -92.64 148.03 35.37 Favored Pre-proline 0 C--N 1.323 -0.548 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.403 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -60.08 128.62 27.11 Favored 'Trans proline' 0 C--O 1.239 0.552 0 C-N-CA 122.844 2.363 . . . . 0.0 112.731 -177.274 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 899' ' ' VAL . . . . . 0.688 HG23 HD22 ' A' ' 895' ' ' LEU . 1.8 t -111.56 129.55 66.73 Favored 'Isoleucine or valine' 0 C--O 1.236 0.387 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.922 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 900' ' ' ILE . . . . . 0.504 HG12 ' CE2' ' A' ' 939' ' ' TYR . 0.0 OUTLIER -107.57 111.31 35.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.096 176.978 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -97.0 105.97 3.28 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.14 -177.201 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 902' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -93.32 130.41 42.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 177.611 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 903' ' ' THR . . . . . 0.47 HG21 HG21 ' A' ' 876' ' ' VAL . 0.2 OUTLIER -123.46 138.36 54.6 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.199 -178.431 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 904' ' ' ALA . . . . . 0.81 ' HA ' ' HB2' ' A' ' 925' ' ' LYS . . . -79.08 117.26 19.97 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.973 176.799 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 61.73 54.93 2.81 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-O 121.327 0.584 . . . . 0.0 110.323 -178.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 906' ' ' ALA . . . . . 0.447 ' HB1' ' HB ' ' A' ' 903' ' ' THR . . . -69.94 85.23 0.51 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.465 178.732 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -83.91 -41.1 17.75 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.891 -178.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -127.7 4.02 6.1 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-O 121.412 0.625 . . . . 0.0 110.472 -178.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -69.7 -17.01 63.44 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.794 -173.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 910' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.11 -37.8 84.51 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.14 0.495 . . . . 0.0 109.921 176.393 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.07 -34.42 66.24 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.806 177.186 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 6.4 mm100 -65.06 -36.82 85.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.483 177.036 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -62.34 -41.45 98.59 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.454 177.182 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 58.8 m -70.89 -31.15 67.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.748 178.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 915' ' ' LEU . . . . . 0.414 ' HA ' HD12 ' A' ' 915' ' ' LEU . 2.9 tp -70.67 -52.12 23.2 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.065 -179.881 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -74.18 -44.76 52.2 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.336 -177.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 51.22 46.6 26.22 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.336 -175.546 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -115.89 24.86 9.86 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.785 -177.127 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 919' ' ' MET . . . . . 0.668 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -141.15 -94.71 0.14 Allowed 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.955 -0.298 . . . . 0.0 110.878 -177.876 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 920' ' ' ASP . . . . . 0.48 ' H ' ' CG ' ' A' ' 919' ' ' MET . 29.7 t70 171.42 -57.2 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 123.934 0.894 . . . . 0.0 108.656 176.176 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -133.17 163.13 29.96 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.517 176.046 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 922' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -123.94 136.63 54.45 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.412 176.466 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 923' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -123.45 173.45 8.0 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.554 -179.094 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 924' ' ' SER . . . . . 0.804 ' HB2' ' HD2' ' A' ' 926' ' ' PRO . 0.4 OUTLIER -95.11 158.77 15.32 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.336 179.709 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 925' ' ' LYS . . . . . 0.81 ' HB2' ' HA ' ' A' ' 904' ' ' ALA . 0.0 OUTLIER -60.34 -46.95 97.64 Favored Pre-proline 0 CA--C 1.538 0.516 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.544 173.537 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 926' ' ' PRO . . . . . 0.804 ' HD2' ' HB2' ' A' ' 924' ' ' SER . 52.8 Cg_exo -58.05 88.82 0.05 OUTLIER 'Trans proline' 0 C--N 1.36 1.142 0 C-N-CA 122.161 1.907 . . . . 0.0 112.552 174.122 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 12.6 t -128.56 114.62 34.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.225 177.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.74 -177.08 3.37 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.83 -179.088 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 929' ' ' LEU . . . . . 0.558 HD23 ' HG2' ' A' ' 843' ' ' GLN . 1.0 OUTLIER -54.07 -45.75 71.81 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 111.917 0.339 . . . . 0.0 111.917 -175.994 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.98 -36.19 81.62 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.131 0.491 . . . . 0.0 110.669 -177.499 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 69.2 t -76.01 -43.0 38.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.588 -175.249 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 932' ' ' ILE . . . . . 0.428 HD12 HD12 ' A' ' 844' ' ' LEU . 15.4 tt -63.01 -38.95 83.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 178.524 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 2.2 tmmt? -65.12 -48.42 73.68 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.407 178.179 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -59.26 -49.33 78.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.328 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 17.6 m -64.92 -44.02 90.91 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.526 -178.394 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 936' ' ' LEU . . . . . 0.425 HD21 ' HG ' ' A' ' 844' ' ' LEU . 0.8 OUTLIER -62.62 -43.33 99.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.452 179.7 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 937' ' ' THR . . . . . 0.419 ' O ' ' HG2' ' A' ' 941' ' ' GLU . 27.5 m -68.34 -36.25 78.97 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.208 -179.776 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 3.5 tp -64.55 -35.42 80.93 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.956 0.408 . . . . 0.0 110.748 178.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 939' ' ' TYR . . . . . 0.678 ' HD2' HG12 ' A' ' 871' ' ' ILE . 1.1 m-85 -79.17 -36.6 40.06 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.732 178.72 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -64.91 -41.6 95.44 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.928 179.211 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 941' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 937' ' ' THR . 9.7 pt-20 -69.06 -36.07 77.26 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.159 -0.312 . . . . 0.0 110.159 177.518 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 942' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -49.17 78.48 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.801 179.093 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 30.9 m -72.38 -30.61 35.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 C-N-CA 120.821 -0.351 . . . . 0.0 110.717 179.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 1.9 ttt-85 -63.56 -50.34 69.89 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.895 179.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.07 -19.89 61.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.856 0.36 . . . . 0.0 111.278 -178.141 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 17.6 m -81.37 -24.84 36.76 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.061 0.457 . . . . 0.0 110.416 175.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -84.05 -53.51 5.49 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.2 0.524 . . . . 0.0 110.443 178.502 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.565 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.659 -174.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.467 0.378 0 CA-C-O 121.1 0.476 . . . . 0.0 110.995 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . -173.31 19.51 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.951 -0.643 . . . . 0.0 112.159 -179.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 8.6 mmtm -121.45 145.59 47.77 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 178.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 708' ' ' ARG . . . . . 0.517 ' HG2' HG11 ' A' ' 732' ' ' VAL . 24.3 mtm180 -102.13 161.77 13.43 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.372 0.605 . . . . 0.0 110.685 -178.549 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 1.6 m -135.77 110.5 8.68 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.241 -0.891 . . . . 0.0 108.822 170.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 710' ' ' TRP . . . . . 0.498 ' CZ3' ' HB ' ' A' ' 734' ' ' THR . 97.2 m95 -90.53 103.77 16.43 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.951 -175.489 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 711' ' ' LEU . . . . . 0.507 ' O ' ' HG ' ' A' ' 711' ' ' LEU . 0.8 OUTLIER -102.3 120.48 40.56 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 121.596 0.713 . . . . 0.0 110.655 -177.969 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 712' ' ' ALA . . . . . 0.402 ' HB1' HG22 ' A' ' 749' ' ' THR . . . -104.29 43.46 1.1 Allowed 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.355 -0.839 . . . . 0.0 108.926 175.018 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 713' ' ' VAL . . . . . 0.735 ' HA ' ' CB ' ' A' ' 750' ' ' ASP . 16.4 t -101.42 124.18 54.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.426 -177.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 5.5 mtm-85 -108.43 0.57 21.12 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.404 0.621 . . . . 0.0 110.115 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -82.09 111.11 17.93 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.436 173.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -54.46 -55.03 33.09 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -171.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 717' ' ' SER . . . . . 0.403 ' O ' ' HB2' ' A' ' 721' ' ' PHE . 0.3 OUTLIER -60.4 -36.97 79.37 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.174 0.511 . . . . 0.0 110.926 -178.66 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 718' ' ' LEU . . . . . 0.699 HD23 HG11 ' A' ' 713' ' ' VAL . 0.9 OUTLIER -73.97 -49.81 22.82 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.206 -177.547 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 719' ' ' CYS . . . . . 0.438 ' O ' ' HB3' ' A' ' 723' ' ' GLU . 19.7 p -67.7 -44.09 78.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.622 -176.393 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.6 -43.65 98.47 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.101 -179.035 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 721' ' ' PHE . . . . . 0.403 ' HB2' ' O ' ' A' ' 717' ' ' SER . 0.8 OUTLIER -58.62 -55.97 28.2 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.911 0.386 . . . . 0.0 111.058 -179.806 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.36 -44.81 93.74 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.127 -177.214 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 723' ' ' GLU . . . . . 0.581 ' HA ' HG13 ' A' ' 733' ' ' VAL . 0.4 OUTLIER -60.68 -48.26 82.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.288 -176.247 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 724' ' ' THR . . . . . . . . . . . . . 8.3 m -63.48 -36.99 85.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.995 0.426 . . . . 0.0 111.087 -177.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 725' ' ' SER . . . . . 0.42 ' HA ' ' HD3' ' A' ' 728' ' ' ARG . 12.4 m -70.09 -37.11 75.32 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.203 -179.921 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 726' ' ' LEU . . . . . . . . . . . . . 20.9 mt -75.15 -43.94 49.6 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.239 -177.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -69.04 -10.63 58.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.133 0.492 . . . . 0.0 111.029 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 728' ' ' ARG . . . . . 0.42 ' HD3' ' HA ' ' A' ' 725' ' ' SER . 0.0 OUTLIER -67.84 -33.05 74.02 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.303 176.6 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.31 5.94 49.81 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.655 -176.152 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 730' ' ' GLY . . . . . . . . . . . . . . . 86.98 14.66 64.27 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.439 -0.886 . . . . 0.0 112.422 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 731' ' ' ILE . . . . . . . . . . . . . 14.9 mm -86.63 129.41 38.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 174.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 732' ' ' VAL . . . . . 0.517 HG11 ' HG2' ' A' ' 708' ' ' ARG . 1.4 p -83.97 103.94 11.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.636 0.731 . . . . 0.0 110.441 -177.426 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 733' ' ' VAL . . . . . 0.581 HG13 ' HA ' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -80.71 115.41 23.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.358 178.543 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 734' ' ' THR . . . . . 0.498 ' HB ' ' CZ3' ' A' ' 710' ' ' TRP . 0.2 OUTLIER -122.9 131.22 53.64 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.431 -177.605 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.27 122.53 17.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.304 -179.06 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 736' ' ' TYR . . . . . 0.453 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 21.8 t80 -86.57 98.0 10.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.157 0.504 . . . . 0.0 110.919 -178.572 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -95.71 -28.64 14.69 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.382 174.359 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 161.2 52.96 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.512 0 N-CA-C 110.774 -0.93 . . . . 0.0 110.774 179.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 8.4 mp0 -101.75 -171.32 1.96 Allowed 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -171.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 740' ' ' GLU . . . . . 0.49 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 1.0 OUTLIER -69.5 134.68 88.61 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.799 -176.719 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 741' ' ' PRO . . . . . 0.49 ' HD3' ' HA ' ' A' ' 740' ' ' GLU . 3.9 Cg_endo -88.42 137.41 3.58 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 123.478 2.785 . . . . 0.0 111.614 174.017 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 742' ' ' THR . . . . . 0.748 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.2 OUTLIER -131.55 140.21 37.67 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-O 120.777 0.322 . . . . 0.0 111.082 -179.362 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 743' ' ' PRO . . . . . 0.748 ' HD2' HG22 ' A' ' 742' ' ' THR . 38.3 Cg_endo -66.13 -11.19 30.11 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 123.364 2.71 . . . . 0.0 113.254 -177.401 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -108.95 2.71 21.58 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.05 0.453 . . . . 0.0 110.399 178.328 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 745' ' ' ASP . . . . . 0.428 ' CG ' ' HB2' ' A' ' 708' ' ' ARG . 56.5 m-20 -109.63 152.04 26.06 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.45 -175.625 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 29.2 m -120.25 147.02 24.23 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.082 -178.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 747' ' ' LEU . . . . . 0.465 HD22 ' O ' ' A' ' 710' ' ' TRP . 0.3 OUTLIER -105.05 108.72 20.38 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.112 177.153 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 19.8 mt -94.56 106.54 18.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 N-CA-C 108.82 -0.808 . . . . 0.0 108.82 173.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 749' ' ' THR . . . . . 0.402 HG22 ' HB1' ' A' ' 712' ' ' ALA . 0.0 OUTLIER -100.94 153.76 19.24 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 116.056 -0.52 . . . . 0.0 112.23 -170.842 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 750' ' ' ASP . . . . . 0.735 ' CB ' ' HA ' ' A' ' 713' ' ' VAL . 9.3 t0 -113.27 113.41 25.25 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 175.361 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 751' ' ' GLU . . . . . 0.554 ' HG3' ' H ' ' A' ' 752' ' ' VAL . 3.1 tp10 68.15 -173.71 0.19 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.274 179.754 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 752' ' ' VAL . . . . . 0.554 ' H ' ' HG3' ' A' ' 751' ' ' GLU . 0.9 OUTLIER -61.0 127.17 20.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.5 178.092 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 8.8 p -114.93 -12.91 11.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.896 179.256 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 6.6 m 55.53 53.43 9.72 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.404 -178.193 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.03 167.96 28.6 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.407 178.612 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 756' ' ' LYS . . . . . 0.456 ' O ' ' HB3' ' A' ' 757' ' ' TRP . 6.1 tptm -111.3 -40.16 4.49 Favored 'General case' 0 C--N 1.322 -0.587 0 O-C-N 123.118 0.261 . . . . 0.0 110.705 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 757' ' ' TRP . . . . . 0.456 ' HB3' ' O ' ' A' ' 756' ' ' LYS . 5.5 t-105 73.11 134.86 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.294 0 O-C-N 124.094 0.871 . . . . 0.0 111.005 179.024 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -114.0 115.4 27.55 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.065 178.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 759' ' ' GLY . . . . . . . . . . . . . . . -177.25 -139.65 3.37 Favored Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.826 -0.702 . . . . 0.0 111.813 -178.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 8.2 ttt180 -79.22 -54.5 5.91 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.885 0.374 . . . . 0.0 110.08 177.025 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -162.69 163.95 26.71 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.583 179.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 762' ' ' VAL . . . . . 0.431 HG22 ' HB3' ' A' ' 747' ' ' LEU . 2.5 p -131.88 126.43 56.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.233 -0.44 . . . . 0.0 109.996 176.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 1.9 t -119.97 109.59 26.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.953 -178.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 764' ' ' THR . . . . . 0.439 ' O ' ' HA ' ' A' ' 782' ' ' VAL . 42.5 m -104.35 121.29 43.05 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.169 0.509 . . . . 0.0 112.072 -174.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 765' ' ' PHE . . . . . 0.532 ' CE1' HD21 ' A' ' 791' ' ' LEU . 29.9 m-85 -75.98 150.21 37.47 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 171.772 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -132.75 137.8 46.97 Favored 'General case' 0 C--N 1.318 -0.803 0 C-N-CA 120.923 -0.311 . . . . 0.0 110.591 179.65 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 767' ' ' ARG . . . . . 0.488 ' HB2' ' OE1' ' A' ' 751' ' ' GLU . 6.6 mmm-85 -117.78 43.73 2.33 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.162 0.506 . . . . 0.0 109.732 175.786 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 70.69 12.0 7.24 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 114.976 -1.011 . . . . 0.0 112.331 176.671 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . 0.514 ' HB2' ' CD ' ' A' ' 751' ' ' GLU . 41.1 m80 -102.8 60.66 0.8 Allowed 'General case' 0 C--N 1.328 -0.345 0 O-C-N 122.219 -0.301 . . . . 0.0 110.391 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 49.6 mt 73.11 130.45 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.101 -178.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -92.91 145.25 17.51 Favored Glycine 0 N--CA 1.444 -0.81 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.973 -179.037 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 772' ' ' ILE . . . . . 0.933 HG13 ' HD2' ' A' ' 773' ' ' PRO . 1.0 OUTLIER -89.31 161.9 38.69 Favored Pre-proline 0 C--N 1.323 -0.563 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 174.658 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 773' ' ' PRO . . . . . 0.933 ' HD2' HG13 ' A' ' 772' ' ' ILE . 10.3 Cg_endo -54.37 125.39 18.76 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.512 2.141 . . . . 0.0 112.581 177.021 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . 0.492 ' HB3' HG23 ' A' ' 782' ' ' VAL . 0.8 OUTLIER -93.29 -151.0 0.29 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.162 178.486 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 775' ' ' GLU . . . . . 0.535 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 2.8 mp0 -68.68 50.76 0.07 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.85 0.833 . . . . 0.0 112.947 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 776' ' ' LYS . . . . . 0.426 ' H ' ' C ' ' A' ' 774' ' ' LEU . 0.0 OUTLIER -103.88 2.12 32.23 Favored 'General case' 0 C--N 1.308 -1.207 0 N-CA-C 107.152 -1.425 . . . . 0.0 107.152 168.342 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 777' ' ' ALA . . . . . 0.46 ' HB1' ' CD ' ' A' ' 778' ' ' PRO . . . -136.51 170.36 11.08 Favored Pre-proline 0 N--CA 1.447 -0.62 0 CA-C-N 113.816 -1.538 . . . . 0.0 109.003 -179.181 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 778' ' ' PRO . . . . . 0.46 ' CD ' ' HB1' ' A' ' 777' ' ' ALA . 31.1 Cg_exo -59.6 -26.94 83.69 Favored 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 122.943 2.429 . . . . 0.0 115.707 -169.011 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . -155.47 32.28 0.64 Allowed Glycine 0 C--N 1.331 0.266 0 C-N-CA 119.777 -1.201 . . . . 0.0 112.671 -174.39 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 780' ' ' GLU . . . . . 0.535 ' O ' ' HG3' ' A' ' 775' ' ' GLU . 10.9 mp0 -103.62 130.04 51.01 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 -177.592 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 22.9 m95 -134.94 151.64 51.03 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.655 -0.248 . . . . 0.0 110.438 -176.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . 0.492 HG23 ' HB3' ' A' ' 774' ' ' LEU . 35.2 m -139.33 157.72 27.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.377 173.643 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 783' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 -167.3 121.63 1.01 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.97 0.414 . . . . 0.0 110.633 173.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -90.37 101.38 14.11 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.476 176.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -157.84 179.39 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.937 179.48 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -108.12 31.81 5.26 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.013 179.682 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 63.6 71.74 0.6 Allowed Pre-proline 0 C--O 1.232 0.141 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.8 178.032 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 788' ' ' PRO . . . . . 0.537 ' HB2' ' H ' ' A' ' 789' ' ' HIS . 5.9 Cg_exo -79.95 -119.25 0.01 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 123.033 2.489 . . . . 0.0 110.885 172.455 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 789' ' ' HIS . . . . . 0.538 ' HA ' ' HG2' ' A' ' 792' ' ' PRO . 1.0 OUTLIER -130.77 12.57 5.3 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.037 -0.665 . . . . 0.0 111.835 175.993 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 790' ' ' GLU . . . . . 0.442 ' H ' ' HG3' ' A' ' 790' ' ' GLU . 0.0 OUTLIER -83.95 -54.02 5.16 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.103 -179.275 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 791' ' ' LEU . . . . . 0.532 HD21 ' CE1' ' A' ' 765' ' ' PHE . 0.3 OUTLIER -63.31 -47.38 84.58 Favored Pre-proline 0 CA--C 1.535 0.396 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 179.32 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 792' ' ' PRO . . . . . 0.538 ' HG2' ' HA ' ' A' ' 789' ' ' HIS . 9.4 Cg_endo -55.81 -29.95 74.34 Favored 'Trans proline' 0 C--N 1.357 0.975 0 C-N-CA 121.775 1.65 . . . . 0.0 112.19 175.102 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -69.24 -41.23 77.27 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-O 120.881 0.372 . . . . 0.0 110.317 176.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.71 -43.33 97.96 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.825 176.23 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 795' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -63.34 -45.07 92.94 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.782 178.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -63.4 -37.38 87.06 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.227 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.91 -34.66 71.76 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.455 -0.338 . . . . 0.0 110.372 178.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -62.47 -42.37 95.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.585 179.661 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -88.15 4.63 44.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.766 0.317 . . . . 0.0 110.913 179.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 40.1 mt . . . . . 0 C--O 1.233 0.191 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.843 178.148 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 10.5 t0 . . . . . 0 C--O 1.234 0.273 0 CA-C-O 121.133 0.492 . . . . 0.0 110.805 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -98.12 101.13 12.52 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.346 177.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 826' ' ' MET . . . . . 0.417 ' HB2' ' HE3' ' A' ' 826' ' ' MET . 2.6 tpp -104.76 116.54 32.19 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.84 -178.047 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 827' ' ' ILE . . . . . 0.655 ' HB ' HD23 ' A' ' 844' ' ' LEU . 14.4 mm -114.44 137.19 48.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.309 -179.536 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 828' ' ' LEU . . . . . 0.632 HD12 HG22 ' A' ' 872' ' ' VAL . 0.4 OUTLIER -98.24 131.84 44.24 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.709 -179.479 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 829' ' ' VAL . . . . . 0.763 HG22 HD13 ' A' ' 840' ' ' LEU . 0.2 OUTLIER -122.1 104.09 14.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 174.919 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 830' ' ' VAL . . . . . 0.457 HG21 HD22 ' A' ' 828' ' ' LEU . 0.1 OUTLIER -120.67 100.57 9.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.196 -177.838 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 831' ' ' ASP . . . . . 0.8 ' HB2' ' HB3' ' A' ' 875' ' ' ASP . 0.2 OUTLIER -117.63 154.4 31.64 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.36 -177.173 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -94.01 -16.42 23.91 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -173.411 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 833' ' ' HIS . . . . . 0.416 ' HB2' ' HB2' ' A' ' 877' ' ' ASN . 1.1 m170 -124.5 98.87 37.05 Favored Pre-proline 0 C--N 1.328 -0.354 0 O-C-N 122.068 -0.395 . . . . 0.0 111.196 -178.427 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_exo -30.64 -39.34 0.06 OUTLIER 'Trans proline' 0 C--N 1.353 0.793 1 C-N-CA 126.032 4.488 . . . . 0.0 116.871 -168.654 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 835' ' ' ILE . . . . . 0.521 ' O ' ' HG3' ' A' ' 838' ' ' ARG . 8.2 tp -59.38 -41.57 84.78 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-N 117.846 0.293 . . . . 0.0 111.689 -176.625 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 836' ' ' ASN . . . . . 0.573 ' HA ' ' HB2' ' A' ' 839' ' ' LEU . 0.8 OUTLIER -79.79 -31.95 40.8 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 -178.802 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 837' ' ' ARG . . . . . 0.505 ' O ' ' HB1' ' A' ' 841' ' ' ALA . 0.7 OUTLIER -52.73 -48.01 66.98 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.4 176.217 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 838' ' ' ARG . . . . . 0.521 ' HG3' ' O ' ' A' ' 835' ' ' ILE . 0.0 OUTLIER -73.99 -28.72 61.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.737 177.609 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 839' ' ' LEU . . . . . 0.573 ' HB2' ' HA ' ' A' ' 836' ' ' ASN . 0.2 OUTLIER -62.35 -53.92 47.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.728 -0.215 . . . . 0.0 111.442 -178.342 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 840' ' ' LEU . . . . . 0.763 HD13 HG22 ' A' ' 829' ' ' VAL . 0.0 OUTLIER -74.21 -29.55 61.78 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.393 -0.523 . . . . 0.0 110.731 -179.502 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 841' ' ' ALA . . . . . 0.505 ' HB1' ' O ' ' A' ' 837' ' ' ARG . . . -64.49 -38.65 91.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.233 0.539 . . . . 0.0 110.509 177.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -61.6 -49.53 76.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.408 -0.814 . . . . 0.0 109.941 176.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 843' ' ' GLN . . . . . 0.874 ' HG3' HD21 ' A' ' 929' ' ' LEU . 0.0 OUTLIER -58.99 -46.46 88.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.84 -179.811 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 844' ' ' LEU . . . . . 0.655 HD23 ' HB ' ' A' ' 827' ' ' ILE . 0.0 OUTLIER -60.07 -39.87 87.55 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.635 178.073 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -61.71 -39.29 97.22 Favored Glycine 0 N--CA 1.448 -0.506 0 CA-C-N 115.697 -0.683 . . . . 0.0 112.317 176.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.24 -30.49 66.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.972 0.415 . . . . 0.0 110.485 179.769 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 29.3 mt -73.98 -21.25 60.07 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.812 178.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 86.86 38.28 8.1 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 121.087 -0.578 . . . . 0.0 112.962 175.675 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 75.0 m-85 -118.2 150.54 39.23 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 178.263 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -72.25 109.67 6.15 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 179.344 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 851' ' ' CYS . . . . . 0.606 ' HB3' HD21 ' A' ' 844' ' ' LEU . 0.0 OUTLIER -102.15 112.07 24.6 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.241 -174.61 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 852' ' ' LYS . . . . . 0.419 ' HG3' ' HZ3' ' A' ' 852' ' ' LYS . 0.7 OUTLIER -86.99 108.9 19.04 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 176.079 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 853' ' ' THR . . . . . 0.411 HG23 ' HG2' ' A' ' 837' ' ' ARG . 0.3 OUTLIER -104.1 123.43 47.24 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.015 0.436 . . . . 0.0 111.89 -171.355 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 854' ' ' ALA . . . . . . . . . . . . . . . -140.16 146.9 39.38 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.474 176.62 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 855' ' ' ASN . . . . . 0.418 ' HA ' ' O ' ' A' ' 831' ' ' ASP . 6.1 t-20 -114.76 76.47 0.99 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.109 0.48 . . . . 0.0 110.479 179.629 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 856' ' ' ASP . . . . . . . . . . . . . 8.8 t0 178.95 167.97 0.93 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.154 178.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -91.25 -53.39 2.18 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 121.21 -0.519 . . . . 0.0 111.831 178.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 6.6 m -58.23 -32.12 43.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.73 0.3 . . . . 0.0 111.707 -179.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -68.23 -20.1 64.79 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.41 -177.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -67.39 -39.9 85.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.171 0.51 . . . . 0.0 110.059 176.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 861' ' ' LEU . . . . . 0.534 HD12 ' HG ' ' A' ' 893' ' ' LEU . 0.2 OUTLIER -74.31 -37.37 63.64 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.126 176.784 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -65.37 -43.26 91.36 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.137 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 863' ' ' VAL . . . . . 0.644 ' HA ' ' HB2' ' A' ' 866' ' ' LYS . 9.3 p -71.88 -31.54 41.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.739 -0.209 . . . . 0.0 110.662 179.229 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 864' ' ' LEU . . . . . 0.405 ' HA ' HD23 ' A' ' 864' ' ' LEU . 0.2 OUTLIER -57.92 -36.06 71.95 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.175 0.512 . . . . 0.0 109.886 173.546 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 3.6 m -87.13 -16.7 34.67 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.718 178.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 866' ' ' LYS . . . . . 0.644 ' HB2' ' HA ' ' A' ' 863' ' ' VAL . 17.8 mttt -70.76 -55.42 8.65 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.39 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -143.67 -174.81 4.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.197 179.225 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -98.03 125.31 42.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.076 0.465 . . . . 0.0 111.354 -177.064 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 869' ' ' ILE . . . . . 0.627 HG21 ' HB2' ' A' ' 828' ' ' LEU . 3.4 mp -122.27 148.54 25.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.825 179.288 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -94.58 -58.79 2.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.782 0.325 . . . . 0.0 111.314 -176.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 871' ' ' ILE . . . . . 0.621 HG13 ' HG2' ' A' ' 898' ' ' PRO . 0.9 OUTLIER -116.27 135.72 55.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 179.227 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 872' ' ' VAL . . . . . 0.632 HG22 HD12 ' A' ' 828' ' ' LEU . 97.3 t -119.08 125.26 74.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.802 -178.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 873' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -109.79 116.0 30.87 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.908 0.385 . . . . 0.0 109.979 174.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -104.11 112.57 25.62 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 177.825 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 875' ' ' ASP . . . . . 0.8 ' HB3' ' HB2' ' A' ' 831' ' ' ASP . 58.6 t0 -109.52 124.54 51.26 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.576 -175.144 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -124.75 133.86 68.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.024 0.44 . . . . 0.0 110.721 -177.767 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 877' ' ' ASN . . . . . 0.484 ' HA ' ' HD2' ' A' ' 925' ' ' LYS . 0.1 OUTLIER -88.38 -18.32 28.65 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.067 176.886 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 28.1 mmt . . . . . 0 C--N 1.321 -0.665 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.85 179.12 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.223 -0.566 0 N-CA-C 113.025 -0.03 . . . . 0.0 113.025 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 22.2 t80 -118.16 -50.37 2.47 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 173.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 885' ' ' ARG . . . . . 0.405 ' O ' ' HB2' ' A' ' 889' ' ' ARG . 0.0 OUTLIER -64.53 -34.44 78.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.438 179.067 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -62.54 -52.76 62.17 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 116.253 -0.43 . . . . 0.0 109.848 177.19 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 887' ' ' THR . . . . . 0.525 HG21 ' HE2' ' A' ' 919' ' ' MET . 0.0 OUTLIER -60.67 -42.79 97.79 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.171 0.51 . . . . 0.0 111.094 -178.849 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 888' ' ' GLN . . . . . 0.406 ' OE1' ' HA ' ' A' ' 888' ' ' GLN . 2.5 tp-100 -62.66 -42.81 99.82 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.892 178.592 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 889' ' ' ARG . . . . . 0.505 ' HD3' ' HA ' ' A' ' 889' ' ' ARG . 0.0 OUTLIER -71.82 -44.18 64.34 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.546 -176.32 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 890' ' ' ILE . . . . . 0.45 HG23 ' N ' ' A' ' 891' ' ' ARG . 3.3 tt -67.08 -37.54 79.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.826 -0.17 . . . . 0.0 111.449 -176.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 891' ' ' ARG . . . . . 0.79 ' HA ' ' HB2' ' A' ' 895' ' ' LEU . 5.6 ptm180 -72.01 -35.49 69.45 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.808 -0.357 . . . . 0.0 110.493 178.602 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -73.24 -22.71 60.36 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.994 -179.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 893' ' ' LEU . . . . . 0.534 ' HG ' HD12 ' A' ' 861' ' ' LEU . 0.1 OUTLIER -82.53 0.94 40.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.131 -178.538 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 101.11 51.45 1.15 Allowed Glycine 0 N--CA 1.448 -0.511 0 CA-C-N 115.712 -0.677 . . . . 0.0 112.484 176.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 895' ' ' LEU . . . . . 0.79 ' HB2' ' HA ' ' A' ' 891' ' ' ARG . 0.4 OUTLIER -72.91 114.21 10.81 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.975 0.417 . . . . 0.0 110.34 178.435 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -120.66 -12.74 8.83 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.075 -179.789 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 897' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -100.08 153.5 37.73 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.474 -175.877 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 898' ' ' PRO . . . . . 0.621 ' HG2' HG13 ' A' ' 871' ' ' ILE . 55.1 Cg_endo -71.12 126.56 12.54 Favored 'Trans proline' 0 C--O 1.239 0.527 0 C-N-CA 122.592 2.195 . . . . 0.0 112.697 -178.913 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 899' ' ' VAL . . . . . 0.734 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 97.7 t -112.4 119.38 60.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.117 177.305 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 900' ' ' ILE . . . . . . . . . . . . . 5.5 mt -95.8 115.58 35.3 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.977 179.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -95.06 93.79 1.66 Allowed Glycine 0 N--CA 1.444 -0.796 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.666 -174.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 902' ' ' VAL . . . . . 0.597 ' O ' ' HA ' ' A' ' 875' ' ' ASP . 1.3 t -76.8 125.24 36.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 175.584 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -139.35 149.24 43.93 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.233 0.539 . . . . 0.0 111.134 -179.019 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -71.13 113.67 8.41 Favored 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 168.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -52.43 102.64 0.05 Allowed 'General case' 0 C--O 1.234 0.246 0 O-C-N 123.463 0.477 . . . . 0.0 110.531 -176.161 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -102.53 -77.68 0.55 Allowed 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.824 -174.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 5.7 mt -147.9 -86.97 0.09 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.847 0.356 . . . . 0.0 111.748 -176.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 908' ' ' ALA . . . . . 0.4 ' O ' ' HG2' ' A' ' 912' ' ' GLN . . . -102.0 24.88 9.4 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -170.073 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -56.73 -33.46 66.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.97 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 910' ' ' GLU . . . . . 0.503 ' H ' ' HG3' ' A' ' 910' ' ' GLU . 0.0 OUTLIER -63.21 -50.89 68.46 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.667 179.14 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -58.21 -47.73 82.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.822 178.215 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 912' ' ' GLN . . . . . 0.4 ' HG2' ' O ' ' A' ' 908' ' ' ALA . 10.7 mm100 -61.14 -45.73 93.46 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.227 -178.211 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 913' ' ' ARG . . . . . 0.596 ' HA ' ' HE3' ' A' ' 919' ' ' MET . 0.0 OUTLIER -55.78 -44.35 77.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.225 -178.729 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 10.8 m -73.83 -34.04 64.38 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.161 -178.37 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 2.8 tp -70.31 -40.47 74.21 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.796 0.331 . . . . 0.0 111.4 -178.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -77.95 -44.5 26.64 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.122 179.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 50.45 45.1 26.76 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.8 -0.637 . . . . 0.0 111.278 -177.635 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -116.42 24.68 9.65 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.814 -0.708 . . . . 0.0 111.948 -179.011 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 919' ' ' MET . . . . . 0.734 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -137.0 -100.44 0.2 Allowed 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 179.555 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 920' ' ' ASP . . . . . 0.426 ' H ' ' HB2' ' A' ' 919' ' ' MET . 15.4 t70 171.46 -64.96 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.45 175.358 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -121.59 175.34 6.27 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.649 -177.532 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 922' ' ' CYS . . . . . 0.471 ' SG ' ' HD2' ' A' ' 913' ' ' ARG . 0.4 OUTLIER -137.14 135.26 37.22 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.325 176.78 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 923' ' ' LEU . . . . . 0.506 HD13 HG21 ' A' ' 935' ' ' THR . 13.7 mt -120.67 167.62 12.25 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.284 -179.029 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -93.43 135.01 35.09 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 174.748 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 925' ' ' LYS . . . . . 0.531 ' HZ2' ' CG ' ' A' ' 875' ' ' ASP . 0.1 OUTLIER -49.16 -44.17 71.76 Favored Pre-proline 0 CA--C 1.539 0.555 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -177.647 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -66.01 75.85 0.33 Allowed 'Trans proline' 0 C--N 1.356 0.935 0 C-N-CA 122.03 1.82 . . . . 0.0 112.402 174.215 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -87.96 159.43 3.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.395 179.495 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 928' ' ' THR . . . . . 0.459 ' O ' ' HB ' ' A' ' 932' ' ' ILE . 0.0 OUTLIER -131.97 172.9 11.77 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.639 -179.623 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 929' ' ' LEU . . . . . 0.874 HD21 ' HG3' ' A' ' 843' ' ' GLN . 1.3 tm? -61.67 -48.25 81.68 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.695 0.283 . . . . 0.0 111.699 -176.201 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -78.01 -32.0 50.89 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.864 -0.334 . . . . 0.0 111.327 -175.264 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -74.74 -36.19 39.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 C-N-CA 120.964 -0.295 . . . . 0.0 110.667 179.48 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 932' ' ' ILE . . . . . 0.576 HG21 ' HB3' ' A' ' 843' ' ' GLN . 0.4 OUTLIER -69.03 -34.73 65.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 174.611 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.9 -46.01 91.23 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.991 -0.55 . . . . 0.0 109.876 174.508 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -54.81 -58.27 8.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.766 177.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 935' ' ' THR . . . . . 0.506 HG21 HD13 ' A' ' 923' ' ' LEU . 1.9 m -57.55 -51.46 69.39 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.96 -178.363 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 936' ' ' LEU . . . . . . . . . . . . . 1.8 tp -61.68 -45.72 92.79 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.513 -177.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 41.3 m -67.4 -36.31 81.05 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.377 -178.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 938' ' ' LEU . . . . . 0.44 ' O ' ' HG3' ' A' ' 941' ' ' GLU . 3.6 tp -71.43 -36.64 71.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.158 0.504 . . . . 0.0 111.307 -178.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 939' ' ' TYR . . . . . 0.683 ' HA ' ' HB2' ' A' ' 942' ' ' ARG . 40.0 m-85 -86.49 -25.63 25.03 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 121.877 -0.514 . . . . 0.0 111.521 -178.076 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -67.53 -39.82 85.04 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.947 0.403 . . . . 0.0 110.282 173.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 941' ' ' GLU . . . . . 0.44 ' HG3' ' O ' ' A' ' 938' ' ' LEU . 0.2 OUTLIER -72.53 -27.91 62.53 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 174.647 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 942' ' ' ARG . . . . . 0.683 ' HB2' ' HA ' ' A' ' 939' ' ' TYR . 0.0 OUTLIER -60.5 -49.42 77.63 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.881 -179.578 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 6.5 m -72.46 -31.87 39.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.711 178.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.61 -36.17 82.94 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.226 -179.404 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.58 -23.51 29.61 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.596 0.236 . . . . 0.0 111.067 179.393 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 51.0 m -72.66 -39.03 67.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.129 0.49 . . . . 0.0 109.963 177.004 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 2.3 mtp180 -84.35 -30.05 25.8 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.579 177.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.466 -175.256 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.32 0 CA-C-O 121.075 0.464 . . . . 0.0 109.933 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 119.31 20.72 3.9 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.269 -178.134 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 707' ' ' LYS . . . . . 0.654 ' HB2' HG12 ' A' ' 731' ' ' ILE . 15.0 mmtt -81.79 165.38 20.95 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 177.67 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 708' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -121.01 130.51 53.82 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -172.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -118.02 111.71 19.29 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.345 177.074 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 710' ' ' TRP . . . . . 0.437 ' O ' HD23 ' A' ' 747' ' ' LEU . 98.3 m95 -97.24 112.08 24.04 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 175.337 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 711' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -121.87 131.64 54.14 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.16 0.505 . . . . 0.0 111.285 -174.741 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -125.23 57.57 1.3 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.598 179.152 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 713' ' ' VAL . . . . . 0.797 ' HA ' ' HB2' ' A' ' 750' ' ' ASP . 12.5 t -103.97 125.15 58.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.566 -177.004 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 714' ' ' ARG . . . . . 0.47 ' NH2' ' HG3' ' A' ' 751' ' ' GLU . 18.9 mtm180 -82.66 -38.38 23.54 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.029 0.442 . . . . 0.0 109.883 179.262 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -65.83 102.75 0.8 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.74 176.03 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 716' ' ' ALA . . . . . 0.495 ' HA ' ' HB3' ' A' ' 719' ' ' CYS . . . -63.63 -26.32 68.62 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.071 -174.856 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 4.3 m -65.01 -46.22 82.3 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.118 0.485 . . . . 0.0 109.913 176.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 718' ' ' LEU . . . . . 0.548 HD12 ' HA ' ' A' ' 786' ' ' ALA . 0.9 OUTLIER -74.14 -39.57 63.2 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.543 178.385 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 719' ' ' CYS . . . . . 0.633 ' HB2' ' HB ' ' A' ' 713' ' ' VAL . 0.7 OUTLIER -59.59 -51.56 69.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.7 179.683 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 720' ' ' GLN . . . . . 0.776 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -64.99 -33.7 76.67 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.524 -179.383 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -54.73 -55.8 26.07 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.172 0.511 . . . . 0.0 110.145 177.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -68.26 -48.5 64.9 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.177 -177.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 723' ' ' GLU . . . . . 0.776 ' HG2' ' HA ' ' A' ' 720' ' ' GLN . 10.4 pt-20 -60.77 -41.86 96.33 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 111.601 0.222 . . . . 0.0 111.601 -174.495 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 724' ' ' THR . . . . . . . . . . . . . 53.7 m -67.35 -44.37 79.2 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.948 0.404 . . . . 0.0 110.732 -179.239 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 74.0 m -66.57 -39.48 88.51 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.717 -177.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 726' ' ' LEU . . . . . 0.546 HD21 HD11 ' A' ' 731' ' ' ILE . 67.1 mt -74.96 -39.37 61.36 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.264 -178.253 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 1.6 pp0? -72.07 -23.75 61.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.792 -0.185 . . . . 0.0 111.062 -179.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 9.1 ptt85 -66.74 -22.25 66.05 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 121.278 0.561 . . . . 0.0 110.42 177.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 19.9 m -88.01 -78.39 0.32 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.299 179.695 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 730' ' ' GLY . . . . . . . . . . . . . . . 177.76 39.85 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 111.053 -0.819 . . . . 0.0 111.053 179.176 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 731' ' ' ILE . . . . . 0.654 HG12 ' HB2' ' A' ' 707' ' ' LYS . 27.0 mt -119.24 127.98 75.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 115.165 -0.518 . . . . 0.0 110.165 -177.454 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 732' ' ' VAL . . . . . 0.5 HG21 ' O ' ' A' ' 707' ' ' LYS . 10.6 m -81.21 118.45 29.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.339 0.59 . . . . 0.0 110.538 179.311 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 733' ' ' VAL . . . . . 0.432 HG13 ' HB2' ' A' ' 723' ' ' GLU . 21.9 t -89.71 125.04 42.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.628 -178.105 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 734' ' ' THR . . . . . 0.425 ' HB ' ' CZ3' ' A' ' 710' ' ' TRP . 0.3 OUTLIER -133.11 136.26 45.72 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.438 0.637 . . . . 0.0 110.571 -178.898 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.29 113.56 3.68 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.759 -1.11 . . . . 0.0 111.075 178.145 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -80.09 78.95 6.7 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.455 0.645 . . . . 0.0 109.605 176.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -78.36 -28.78 47.17 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.031 179.694 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 164.89 55.08 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.53 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 179.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 17.3 mp0 -96.63 -171.41 2.26 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.851 0.358 . . . . 0.0 111.331 -174.058 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -98.94 147.37 33.12 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.776 -176.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 741' ' ' PRO . . . . . 0.625 ' HA ' ' CZ3' ' A' ' 757' ' ' TRP . 73.0 Cg_endo -78.43 131.1 10.35 Favored 'Trans proline' 0 N--CA 1.463 -0.314 0 C-N-CA 122.825 2.35 . . . . 0.0 113.132 179.266 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 742' ' ' THR . . . . . 0.664 HG23 ' HD2' ' A' ' 743' ' ' PRO . 0.2 OUTLIER -118.21 135.39 23.49 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.394 176.411 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 743' ' ' PRO . . . . . 0.855 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 19.6 Cg_endo -60.7 -18.15 53.8 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 123.149 2.566 . . . . 0.0 113.152 -177.64 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -105.89 10.52 32.43 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.55 -0.296 . . . . 0.0 110.608 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -118.74 156.31 29.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.203 -174.342 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 1.5 m -122.29 147.67 26.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.277 -178.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 747' ' ' LEU . . . . . 0.437 HD23 ' O ' ' A' ' 710' ' ' TRP . 0.3 OUTLIER -118.13 134.65 54.8 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.97 178.944 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 748' ' ' ILE . . . . . 0.403 HG21 ' HB ' ' A' ' 763' ' ' VAL . 0.0 OUTLIER -127.58 107.79 17.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 172.846 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 749' ' ' THR . . . . . 0.563 HG22 ' HA ' ' A' ' 764' ' ' THR . 1.4 t -109.07 146.04 34.66 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.467 0.651 . . . . 0.0 112.016 -172.629 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 750' ' ' ASP . . . . . 0.797 ' HB2' ' HA ' ' A' ' 713' ' ' VAL . 59.8 t0 -91.88 108.56 20.01 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.968 -1.015 . . . . 0.0 109.442 175.569 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 751' ' ' GLU . . . . . 0.47 ' HG3' ' NH2' ' A' ' 714' ' ' ARG . 3.1 mm-40 63.47 -159.74 0.31 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.865 -174.858 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 752' ' ' VAL . . . . . . . . . . . . . 3.8 t -86.58 119.78 35.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.02 0.438 . . . . 0.0 112.099 -170.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 3.4 m -107.51 -3.31 10.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.462 172.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 13.0 m 53.88 55.02 8.93 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.61 -179.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.48 137.62 52.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.541 -179.335 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 756' ' ' LYS . . . . . 0.453 ' HZ2' ' CD ' ' A' ' 780' ' ' GLU . 20.7 tptt -100.4 87.48 3.41 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.346 0.593 . . . . 0.0 109.674 176.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 757' ' ' TRP . . . . . 0.625 ' CZ3' ' HA ' ' A' ' 741' ' ' PRO . 76.1 t-105 -67.93 106.03 2.19 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.631 -178.747 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.95 87.83 6.36 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 173.64 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 759' ' ' GLY . . . . . 0.855 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -159.18 -139.58 2.71 Favored Glycine 0 N--CA 1.444 -0.811 0 C-N-CA 120.512 -0.852 . . . . 0.0 112.377 -178.159 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -71.18 -55.64 7.73 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.989 -0.284 . . . . 0.0 110.573 178.6 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -170.59 150.69 3.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.874 179.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 762' ' ' VAL . . . . . 0.512 HG13 ' HB3' ' A' ' 757' ' ' TRP . 4.5 p -130.23 127.44 63.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.248 175.446 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 763' ' ' VAL . . . . . 0.566 HG11 HD23 ' A' ' 791' ' ' LEU . 85.6 t -112.46 128.65 69.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.515 178.455 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 764' ' ' THR . . . . . 0.563 ' HA ' HG22 ' A' ' 749' ' ' THR . 35.5 m -109.17 118.27 36.31 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.105 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 765' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -84.51 107.29 16.67 Favored 'General case' 0 C--O 1.223 -0.313 0 N-CA-C 109.813 -0.439 . . . . 0.0 109.813 177.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.06 134.31 36.61 Favored 'General case' 0 C--N 1.317 -0.848 0 C-N-CA 120.844 -0.343 . . . . 0.0 110.196 -175.474 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.79 -65.35 1.07 Allowed 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.803 -0.359 . . . . 0.0 111.312 -179.632 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 3.7 mtp85 -143.67 -4.82 0.84 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -176.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 2.3 m170 -84.17 -67.74 0.77 Allowed 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.294 -0.562 . . . . 0.0 110.863 -178.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 770' ' ' ILE . . . . . 0.516 HG21 ' N ' ' A' ' 771' ' ' GLY . 25.4 mt 68.65 144.6 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 CA-C-O 121.202 0.525 . . . . 0.0 111.395 -179.447 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 771' ' ' GLY . . . . . 0.516 ' N ' HG21 ' A' ' 770' ' ' ILE . . . 158.88 -32.2 0.47 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.825 -0.703 . . . . 0.0 111.624 -178.297 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 772' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -82.09 154.24 69.73 Favored Pre-proline 0 C--N 1.324 -0.531 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 176.136 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 773' ' ' PRO . . . . . 0.476 ' HB2' ' H ' ' A' ' 774' ' ' LEU . 12.7 Cg_exo -70.58 -119.88 0.01 OUTLIER 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.792 2.328 . . . . 0.0 112.913 -179.732 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . 0.917 ' HA ' HG11 ' A' ' 782' ' ' VAL . 1.1 pt? 178.25 -167.04 0.06 Allowed 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 122.676 0.39 . . . . 0.0 110.105 -177.606 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 775' ' ' GLU . . . . . 0.708 ' HG3' ' HA ' ' A' ' 781' ' ' TRP . 2.4 mp0 -63.03 68.87 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 121.603 0.716 . . . . 0.0 112.631 174.472 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -127.82 6.61 6.11 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 114.642 -1.163 . . . . 0.0 108.214 171.712 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -145.42 144.3 22.61 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 114.314 -1.312 . . . . 0.0 108.946 179.233 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -60.62 100.57 0.16 Allowed 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 122.496 2.131 . . . . 0.0 112.97 -177.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 779' ' ' GLY . . . . . 0.467 ' O ' HG11 ' A' ' 762' ' ' VAL . . . 116.75 -3.92 19.36 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.996 176.436 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 780' ' ' GLU . . . . . 0.616 ' O ' ' HG3' ' A' ' 775' ' ' GLU . 10.2 tt0 -103.71 123.67 47.45 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 -177.296 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 781' ' ' TRP . . . . . 0.708 ' HA ' ' HG3' ' A' ' 775' ' ' GLU . 23.2 m95 -134.76 137.41 43.41 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 -179.606 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . 0.917 HG11 ' HA ' ' A' ' 774' ' ' LEU . 3.6 m -136.28 151.65 28.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 120.775 0.322 . . . . 0.0 110.29 173.075 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 783' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -167.5 129.18 1.56 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.477 -0.328 . . . . 0.0 110.492 178.858 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.61 101.92 11.11 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 174.255 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 785' ' ' VAL . . . . . 0.691 HG11 ' H ' ' A' ' 787' ' ' ALA . 1.8 p -170.91 168.15 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.202 -175.802 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 786' ' ' ALA . . . . . 0.548 ' HA ' HD12 ' A' ' 718' ' ' LEU . . . -108.58 27.78 9.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.754 0.311 . . . . 0.0 110.781 -179.677 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 787' ' ' ALA . . . . . 0.691 ' H ' HG11 ' A' ' 785' ' ' VAL . . . 49.12 57.27 18.35 Favored Pre-proline 0 N--CA 1.47 0.527 0 CA-C-N 115.209 -0.905 . . . . 0.0 112.905 178.877 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 788' ' ' PRO . . . . . 0.51 ' HD3' ' N ' ' A' ' 787' ' ' ALA . 2.7 Cg_exo -76.35 -42.26 0.39 Allowed 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 122.285 1.99 . . . . 0.0 113.414 -178.049 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 4.9 p-80 -151.64 -14.62 0.2 Allowed 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 -170.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 790' ' ' GLU . . . . . 0.438 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -112.75 -41.92 3.71 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -169.393 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 791' ' ' LEU . . . . . 0.566 HD23 HG11 ' A' ' 763' ' ' VAL . 0.3 OUTLIER -67.89 -50.42 33.04 Favored Pre-proline 0 C--N 1.325 -0.487 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.035 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 792' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -63.9 -26.73 66.94 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 121.3 1.333 . . . . 0.0 111.411 179.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -75.0 -39.11 61.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.33 176.359 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 794' ' ' LEU . . . . . 0.432 HD21 ' HA ' ' A' ' 794' ' ' LEU . 1.1 tm? -62.66 -41.07 98.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.76 176.382 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 795' ' ' LEU . . . . . 0.522 HD13 HD11 ' A' ' 726' ' ' LEU . 0.2 OUTLIER -60.26 -45.53 92.96 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.454 177.624 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -63.54 -38.72 92.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.925 178.456 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 797' ' ' ARG . . . . . 0.483 ' HA ' HD11 ' A' ' 800' ' ' LEU . 0.0 OUTLIER -67.18 -32.71 73.98 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.9 0.381 . . . . 0.0 110.526 178.959 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -70.77 -28.04 32.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.063 0.459 . . . . 0.0 110.694 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 799' ' ' TYR . . . . . 0.513 ' CE2' ' HB3' ' A' ' 707' ' ' LYS . 0.2 OUTLIER -104.26 9.32 36.06 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.171 176.882 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 800' ' ' LEU . . . . . 0.483 HD11 ' HA ' ' A' ' 797' ' ' ARG . 3.9 mt . . . . . 0 C--N 1.326 -0.415 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 177.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 4.7 t0 . . . . . 0 N--CA 1.457 -0.118 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 825' ' ' MET . . . . . 0.431 ' HB3' ' HE1' ' A' ' 849' ' ' TYR . 0.0 OUTLIER -93.28 129.92 39.18 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.02 179.508 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 826' ' ' MET . . . . . 0.498 ' HG3' ' O ' ' A' ' 868' ' ' HIS . 0.0 OUTLIER -124.54 139.25 54.06 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.561 0.696 . . . . 0.0 112.14 -174.777 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 827' ' ' ILE . . . . . 0.537 HG23 ' HB ' ' A' ' 871' ' ' ILE . 3.5 mm -121.25 137.43 54.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.051 -0.977 . . . . 0.0 109.534 177.894 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 13.5 tp -98.4 122.47 41.62 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 179.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 829' ' ' VAL . . . . . 0.418 HG11 HD11 ' A' ' 840' ' ' LEU . 0.0 OUTLIER -112.49 113.57 44.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 120.867 0.365 . . . . 0.0 110.424 -179.277 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 830' ' ' VAL . . . . . 0.499 ' HA ' ' O ' ' A' ' 854' ' ' ALA . 2.9 t -118.21 86.37 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.713 -177.247 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 831' ' ' ASP . . . . . 0.787 ' HA ' ' HB2' ' A' ' 875' ' ' ASP . 13.8 t70 -93.39 154.83 17.73 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.143 0.497 . . . . 0.0 111.475 -173.35 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 832' ' ' ASP . . . . . 1.051 ' HB3' ' HB ' ' A' ' 876' ' ' VAL . 0.0 OUTLIER -60.75 -33.67 73.28 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.818 -177.238 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 833' ' ' HIS . . . . . 0.634 ' HB2' ' ND2' ' A' ' 836' ' ' ASN . 34.8 m170 -136.4 138.61 27.36 Favored Pre-proline 0 N--CA 1.463 0.186 0 CA-C-O 120.517 0.198 . . . . 0.0 110.519 -178.822 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 834' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 833' ' ' HIS . 52.1 Cg_exo -56.12 -25.6 55.69 Favored 'Trans proline' 0 CA--C 1.532 0.415 0 C-N-CA 123.115 2.543 . . . . 0.0 113.511 -178.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -69.68 -48.18 66.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.946 0.403 . . . . 0.0 111.058 -179.092 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 836' ' ' ASN . . . . . 0.634 ' ND2' ' HB2' ' A' ' 833' ' ' HIS . 0.1 OUTLIER -74.35 -33.3 63.08 Favored 'General case' 0 CA--C 1.515 -0.396 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 178.508 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 837' ' ' ARG . . . . . 0.598 ' HA ' HD13 ' A' ' 840' ' ' LEU . 6.5 ttp180 -53.45 -43.2 67.89 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.193 175.042 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.75 -30.32 67.89 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.665 178.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.98 -49.13 66.36 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.312 178.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 840' ' ' LEU . . . . . 0.598 HD13 ' HA ' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -69.05 -32.94 72.79 Favored 'General case' 0 CA--C 1.521 -0.146 0 C-N-CA 120.704 -0.399 . . . . 0.0 110.139 178.216 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 841' ' ' ALA . . . . . 0.437 ' HB2' ' O ' ' A' ' 837' ' ' ARG . . . -64.97 -32.05 73.59 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.009 177.117 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.24 -42.62 88.35 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.04 0.447 . . . . 0.0 109.829 176.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 843' ' ' GLN . . . . . 0.575 ' HG3' HD23 ' A' ' 929' ' ' LEU . 0.0 OUTLIER -65.24 -46.88 78.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.842 178.868 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 844' ' ' LEU . . . . . 0.64 HD22 HD22 ' A' ' 936' ' ' LEU . 0.1 OUTLIER -59.18 -40.95 87.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.331 177.783 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -70.2 -27.39 72.92 Favored Glycine 0 N--CA 1.453 -0.205 0 C-N-CA 121.306 -0.473 . . . . 0.0 112.537 -179.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 18.4 m -79.34 -23.69 43.25 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.059 0.457 . . . . 0.0 110.449 177.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.04 -22.49 42.32 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.266 177.116 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 84.48 58.31 2.19 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.894 -0.669 . . . . 0.0 112.116 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 849' ' ' TYR . . . . . 0.431 ' HE1' ' HB3' ' A' ' 825' ' ' MET . 2.4 m-85 -132.75 147.26 52.32 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 29.1 mm-40 -72.99 115.39 12.24 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 176.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 851' ' ' CYS . . . . . 0.457 ' SG ' ' HB3' ' A' ' 844' ' ' LEU . 0.0 OUTLIER -109.48 136.08 49.45 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.986 0.422 . . . . 0.0 111.029 -176.277 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.3 116.45 31.03 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 173.757 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 853' ' ' THR . . . . . 0.473 ' HB ' ' CZ ' ' A' ' 837' ' ' ARG . 0.2 OUTLIER -91.02 134.11 34.76 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -171.464 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 854' ' ' ALA . . . . . 0.499 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -151.47 164.55 36.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.935 175.128 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 855' ' ' ASN . . . . . 0.536 ' O ' ' HB3' ' A' ' 856' ' ' ASP . 0.2 OUTLIER -153.5 74.02 0.99 Allowed 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.74 0.305 . . . . 0.0 110.978 176.63 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 856' ' ' ASP . . . . . 0.536 ' HB3' ' O ' ' A' ' 855' ' ' ASN . 4.3 p-10 163.82 173.65 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 124.28 1.032 . . . . 0.0 109.712 178.647 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -87.04 -44.2 5.75 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.732 -0.747 . . . . 0.0 113.898 -175.094 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 858' ' ' VAL . . . . . 0.454 ' H ' HG22 ' A' ' 858' ' ' VAL . 0.0 OUTLIER -67.5 -38.21 80.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 112.011 0.374 . . . . 0.0 112.011 -174.324 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -67.89 -37.28 81.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.914 0.388 . . . . 0.0 110.622 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 860' ' ' ALA . . . . . 0.418 ' O ' HG11 ' A' ' 863' ' ' VAL . . . -61.63 -38.83 89.1 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.417 177.577 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 861' ' ' LEU . . . . . 0.49 HD11 ' HB3' ' A' ' 889' ' ' ARG . 0.1 OUTLIER -74.73 -31.31 61.8 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.957 178.036 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -64.68 -49.75 69.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.301 177.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 863' ' ' VAL . . . . . 0.566 HG12 HD12 ' A' ' 869' ' ' ILE . 7.9 p -66.99 -31.2 52.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.428 177.638 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 864' ' ' LEU . . . . . 0.502 HD21 ' HA ' ' A' ' 864' ' ' LEU . 0.7 OUTLIER -65.63 -33.86 76.87 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.824 175.683 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 27.2 m -65.9 -37.79 87.04 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.072 0.463 . . . . 0.0 109.861 178.164 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.05 -28.7 68.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.721 174.016 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 7.2 t30 56.12 73.0 0.46 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 114.575 -1.193 . . . . 0.0 111.976 176.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 868' ' ' HIS . . . . . 0.498 ' O ' ' HG3' ' A' ' 826' ' ' MET . 64.7 m-70 -135.14 46.24 2.43 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 174.558 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 869' ' ' ILE . . . . . 0.566 HD12 HG12 ' A' ' 863' ' ' VAL . 2.0 mp -142.2 145.79 23.35 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.132 -0.94 . . . . 0.0 109.835 -177.896 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 870' ' ' ASP . . . . . 0.439 ' N ' HG22 ' A' ' 869' ' ' ILE . 0.4 OUTLIER -101.43 -52.42 3.24 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.88 0.372 . . . . 0.0 110.426 177.173 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 871' ' ' ILE . . . . . 0.537 ' HB ' HG23 ' A' ' 827' ' ' ILE . 38.4 mm -115.42 129.49 71.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.139 179.029 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 872' ' ' VAL . . . . . 0.897 HG22 HD11 ' A' ' 897' ' ' LEU . 9.7 t -106.53 124.39 62.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 120.728 0.299 . . . . 0.0 110.697 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 873' ' ' LEU . . . . . 0.421 ' HA ' ' O ' ' A' ' 900' ' ' ILE . 52.1 mt -109.96 132.34 54.25 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.141 -0.481 . . . . 0.0 109.719 174.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -120.8 95.2 4.61 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.065 0.459 . . . . 0.0 110.011 178.01 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 875' ' ' ASP . . . . . 0.787 ' HB2' ' HA ' ' A' ' 831' ' ' ASP . 0.9 OUTLIER -88.66 105.63 17.8 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.978 -179.512 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 876' ' ' VAL . . . . . 1.051 ' HB ' ' HB3' ' A' ' 832' ' ' ASP . 2.9 t 50.92 65.56 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.558 0.694 . . . . 0.0 111.519 -179.372 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -90.48 33.17 0.91 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.827 176.392 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 878' ' ' MET . . . . . 0.461 ' HE1' ' HB2' ' A' ' 878' ' ' MET . 4.7 tpp . . . . . 0 C--N 1.325 -0.498 0 CA-C-N 115.162 -0.927 . . . . 0.0 109.473 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.51 -0.273 0 N-CA-C 111.39 -0.684 . . . . 0.0 111.39 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 6.5 p90 -80.31 -18.84 48.04 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.296 -0.452 . . . . 0.0 110.687 -171.566 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.89 -32.12 73.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.857 0.36 . . . . 0.0 110.344 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -72.62 -50.73 23.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.15 179.807 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 887' ' ' THR . . . . . 0.613 ' HB ' ' HB3' ' A' ' 916' ' ' GLU . 0.0 OUTLIER -63.28 -40.6 97.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.139 -179.144 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 40.0 tp60 -65.31 -42.77 92.68 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.331 178.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 889' ' ' ARG . . . . . 0.49 ' HB3' HD11 ' A' ' 861' ' ' LEU . 0.7 OUTLIER -64.86 -45.75 84.75 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.992 -178.401 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 890' ' ' ILE . . . . . 0.465 HD12 ' HG ' ' A' ' 864' ' ' LEU . 1.1 tt -69.05 -34.15 62.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.62 0.247 . . . . 0.0 111.017 -177.882 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 891' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.17 -23.07 57.68 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.905 0.383 . . . . 0.0 110.475 178.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 -77.84 -52.21 9.25 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.456 176.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.82 -60.53 3.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.852 -175.116 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 171.3 77.99 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.712 0 C-N-CA 120.394 -0.908 . . . . 0.0 112.02 -176.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 895' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -92.27 110.28 21.67 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.023 0.44 . . . . 0.0 110.071 178.843 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -123.25 -26.5 4.29 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.617 178.08 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 897' ' ' LEU . . . . . 0.897 HD11 HG22 ' A' ' 872' ' ' VAL . 2.5 pt? -97.52 151.9 37.89 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.349 -177.35 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -66.91 128.55 18.98 Favored 'Trans proline' 0 C--O 1.239 0.555 0 C-N-CA 122.763 2.309 . . . . 0.0 112.732 -177.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 899' ' ' VAL . . . . . 0.629 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 58.7 t -105.9 109.37 27.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.225 176.748 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 900' ' ' ILE . . . . . 0.421 ' O ' ' HA ' ' A' ' 873' ' ' LEU . 3.6 mp -101.01 114.39 39.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 178.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -112.57 116.47 4.05 Favored Glycine 0 N--CA 1.442 -0.916 0 C-N-CA 120.448 -0.882 . . . . 0.0 112.599 -174.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 902' ' ' VAL . . . . . 0.691 HG22 ' HA ' ' A' ' 925' ' ' LYS . 0.8 OUTLIER -89.55 138.71 18.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 108.76 -0.829 . . . . 0.0 108.76 176.031 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -138.27 160.5 39.3 Favored 'General case' 0 C--N 1.319 -0.739 0 O-C-N 121.957 -0.464 . . . . 0.0 111.686 -176.597 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -85.4 105.85 16.33 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.327 174.319 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 905' ' ' ASN . . . . . 0.444 ' HB3' ' H ' ' A' ' 906' ' ' ALA . 11.8 t-20 62.29 -96.41 0.06 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.778 -174.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 906' ' ' ALA . . . . . 0.486 ' O ' ' HG3' ' A' ' 909' ' ' GLU . . . 53.22 55.61 8.57 Favored 'General case' 0 N--CA 1.462 0.141 0 O-C-N 123.487 0.492 . . . . 0.0 111.05 -179.413 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 907' ' ' LEU . . . . . 0.529 ' O ' ' HB1' ' A' ' 908' ' ' ALA . 2.1 tp -49.31 143.1 6.65 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.394 -179.281 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 908' ' ' ALA . . . . . 0.529 ' HB1' ' O ' ' A' ' 907' ' ' LEU . . . 76.5 39.38 0.26 Allowed 'General case' 0 N--CA 1.465 0.315 0 O-C-N 124.33 1.018 . . . . 0.0 109.685 -173.898 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 909' ' ' GLU . . . . . 0.486 ' HG3' ' O ' ' A' ' 906' ' ' ALA . 1.0 OUTLIER -57.79 -45.41 86.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.951 -178.307 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 910' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.42 -44.17 88.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.586 179.077 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.54 -33.95 76.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.847 -178.469 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.17 -57.9 8.99 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.327 177.396 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.83 -33.46 71.79 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.37 -176.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 77.0 m -76.24 -33.53 59.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.116 179.398 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 4.6 tp -70.8 -47.75 57.85 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.868 0.365 . . . . 0.0 110.63 179.372 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 916' ' ' GLU . . . . . 0.613 ' HB3' ' HB ' ' A' ' 887' ' ' THR . 28.5 mt-10 -69.87 -27.51 64.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.155 -178.225 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.59 35.63 15.18 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.294 178.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -140.77 24.71 2.59 Favored Glycine 0 C--O 1.226 -0.351 0 C-N-CA 120.517 -0.849 . . . . 0.0 112.488 -179.002 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 919' ' ' MET . . . . . 0.629 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -125.29 -119.29 0.27 Allowed 'General case' 0 C--N 1.323 -0.577 0 O-C-N 122.812 -0.228 . . . . 0.0 110.686 -177.233 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 920' ' ' ASP . . . . . 0.403 ' H ' ' HB3' ' A' ' 919' ' ' MET . 20.1 t70 173.29 -68.28 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 123.683 0.793 . . . . 0.0 109.429 174.252 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 25.5 m -128.67 137.73 51.79 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.065 -177.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 922' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -103.42 129.89 50.63 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.54 -179.666 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 923' ' ' LEU . . . . . 0.404 HD22 ' HA ' ' A' ' 923' ' ' LEU . 14.3 mt -126.11 178.0 6.04 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.126 -179.763 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -108.27 148.04 30.57 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 176.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 925' ' ' LYS . . . . . 0.691 ' HA ' HG22 ' A' ' 902' ' ' VAL . 0.8 OUTLIER -67.16 -48.76 47.69 Favored Pre-proline 0 CA--C 1.533 0.316 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.298 177.881 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 926' ' ' PRO . . . . . 0.448 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 56.2 Cg_endo -71.58 64.88 3.01 Favored 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 121.914 1.743 . . . . 0.0 111.789 172.831 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -105.9 149.17 9.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.603 -178.801 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.91 153.9 40.8 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.89 179.688 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 929' ' ' LEU . . . . . 0.575 HD23 ' HG3' ' A' ' 843' ' ' GLN . 1.1 tm? -59.95 -31.78 70.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.005 -176.898 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -71.26 -26.53 62.93 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.971 -178.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 21.3 t -78.54 -44.98 26.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.839 -0.164 . . . . 0.0 111.314 -178.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 932' ' ' ILE . . . . . 0.419 HG21 ' O ' ' A' ' 929' ' ' LEU . 0.0 OUTLIER -60.61 -41.86 89.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 174.775 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -44.72 96.18 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.651 176.402 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 934' ' ' GLN . . . . . 0.538 ' O ' ' HB2' ' A' ' 938' ' ' LEU . 0.7 OUTLIER -58.16 -53.09 62.25 Favored 'General case' 0 C--O 1.222 -0.39 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.05 179.888 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 4.0 m -61.46 -43.23 99.24 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.812 0.339 . . . . 0.0 111.309 -177.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 936' ' ' LEU . . . . . 0.64 HD22 HD22 ' A' ' 844' ' ' LEU . 0.0 OUTLIER -64.55 -51.32 63.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.954 -179.178 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 24.0 m -66.61 -39.38 88.34 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.381 -176.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 938' ' ' LEU . . . . . 0.538 ' HB2' ' O ' ' A' ' 934' ' ' GLN . 0.3 OUTLIER -61.94 -47.46 84.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.813 -179.277 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -76.68 -32.78 58.14 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.002 -177.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -61.85 -49.38 76.48 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.86 0.362 . . . . 0.0 110.564 177.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 941' ' ' GLU . . . . . 0.586 ' O ' ' HB3' ' A' ' 945' ' ' LYS . 7.9 pt-20 -67.08 -30.71 70.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.36 179.29 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 942' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.71 -49.27 54.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.565 -178.443 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 18.5 m -70.38 -34.13 56.83 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 CA-C-O 121.263 0.554 . . . . 0.0 110.282 -178.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.56 -18.62 61.61 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.287 176.457 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 945' ' ' LYS . . . . . 0.586 ' HB3' ' O ' ' A' ' 941' ' ' GLU . 0.0 OUTLIER -85.17 -23.37 28.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.727 179.31 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -74.06 -39.74 63.28 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.971 0.415 . . . . 0.0 110.137 173.683 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 6.8 mtt180 -72.8 -50.01 26.97 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.202 176.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 21.6 t0 . . . . . 0 C--N 1.321 -0.655 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.977 -179.975 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.465 0.297 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 94.18 -11.19 70.93 Favored Glycine 0 C--N 1.33 0.238 0 CA-C-N 115.416 -0.811 . . . . 0.0 114.187 166.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 707' ' ' LYS . . . . . 0.46 ' O ' HG21 ' A' ' 732' ' ' VAL . 0.1 OUTLIER -81.85 142.16 32.78 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 117.377 0.589 . . . . 0.0 111.196 -176.968 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 708' ' ' ARG . . . . . 0.521 ' HG2' HG22 ' A' ' 732' ' ' VAL . 0.0 OUTLIER -95.18 143.1 26.88 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.164 178.87 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -117.82 119.06 33.73 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 174.78 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 710' ' ' TRP . . . . . . . . . . . . . 77.4 m95 -91.56 115.7 28.26 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 711' ' ' LEU . . . . . 0.43 HD11 ' HB2' ' A' ' 719' ' ' CYS . 0.7 OUTLIER -119.74 129.72 54.64 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.476 0.655 . . . . 0.0 110.945 -178.576 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -126.43 56.88 1.44 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.019 175.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 713' ' ' VAL . . . . . 0.76 HG12 ' HB3' ' A' ' 750' ' ' ASP . 24.0 t -107.23 118.3 54.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 115.031 -0.986 . . . . 0.0 109.713 179.158 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.46 -3.17 58.5 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.402 0.62 . . . . 0.0 110.005 -179.425 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 715' ' ' ASN . . . . . 0.588 ' HB3' ' HB2' ' A' ' 718' ' ' LEU . 1.8 m-80 -86.74 103.13 14.89 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.507 -0.769 . . . . 0.0 109.553 175.687 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 716' ' ' ALA . . . . . 0.527 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -54.6 -46.78 73.87 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -172.346 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.2 -39.42 93.95 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.141 0.496 . . . . 0.0 110.714 -179.756 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 718' ' ' LEU . . . . . 0.595 HD22 ' HB2' ' A' ' 787' ' ' ALA . 0.2 OUTLIER -69.5 -50.06 48.82 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.089 -178.911 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 719' ' ' CYS . . . . . 0.7 ' HB3' ' HB ' ' A' ' 713' ' ' VAL . 31.9 p -67.61 -39.51 84.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.687 -176.411 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 720' ' ' GLN . . . . . 0.427 ' HA ' ' OE1' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -59.59 -43.98 93.51 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.335 178.277 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -59.33 -49.6 77.19 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.831 0.348 . . . . 0.0 110.998 -178.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 722' ' ' LEU . . . . . 0.408 HD23 ' HG3' ' A' ' 792' ' ' PRO . 4.8 mt -65.83 -45.34 82.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.785 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 723' ' ' GLU . . . . . 0.583 ' HG2' ' N ' ' A' ' 724' ' ' THR . 0.0 OUTLIER -57.82 -49.19 77.47 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.822 -177.204 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 724' ' ' THR . . . . . 0.583 ' N ' ' HG2' ' A' ' 723' ' ' GLU . 6.1 m -67.15 -36.77 82.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.304 -174.616 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 27.7 m -69.91 -35.95 74.98 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.02 0.438 . . . . 0.0 111.022 179.544 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 726' ' ' LEU . . . . . 0.561 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 29.4 mt -75.74 -44.16 43.18 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.305 -177.845 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.65 -25.88 65.05 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.888 0.375 . . . . 0.0 110.394 177.649 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 728' ' ' ARG . . . . . 0.578 ' HB2' ' O ' ' A' ' 724' ' ' THR . 0.0 OUTLIER -65.74 -33.57 76.17 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.582 175.57 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 19.0 m -85.4 -56.7 3.39 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.002 -177.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 730' ' ' GLY . . . . . . . . . . . . . . . 155.42 28.2 0.03 OUTLIER Glycine 0 N--CA 1.453 -0.172 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.617 -179.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 731' ' ' ILE . . . . . 0.561 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 11.1 mm -113.66 129.73 68.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 178.549 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 732' ' ' VAL . . . . . 0.521 HG22 ' HG2' ' A' ' 708' ' ' ARG . 3.9 m -85.62 114.83 26.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.445 0.641 . . . . 0.0 110.707 -179.203 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 733' ' ' VAL . . . . . 0.451 ' H ' HG22 ' A' ' 733' ' ' VAL . 0.0 OUTLIER -78.19 115.22 19.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.661 -177.637 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -121.92 126.37 48.49 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.434 179.705 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.41 127.84 34.14 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.911 177.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -73.59 90.79 1.8 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.303 0.573 . . . . 0.0 110.037 177.641 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -73.53 -73.75 0.2 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.085 176.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -168.74 63.56 0.19 Allowed Glycine 0 N--CA 1.449 -0.494 0 N-CA-C 111.078 -0.809 . . . . 0.0 111.078 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -103.67 155.2 18.75 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.62 0.248 . . . . 0.0 110.632 -175.403 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 740' ' ' GLU . . . . . 0.42 ' CD ' ' H ' ' A' ' 740' ' ' GLU . 1.5 pm0 -71.47 129.58 88.59 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 116.112 -0.494 . . . . 0.0 109.708 177.53 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 741' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -57.64 122.81 12.39 Favored 'Trans proline' 0 C--O 1.233 0.244 0 C-N-CA 122.938 2.425 . . . . 0.0 112.912 -175.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 742' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -93.78 129.23 38.77 Favored Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.146 176.717 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 743' ' ' PRO . . . . . 0.595 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 41.2 Cg_endo -67.22 -5.73 14.48 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 123.087 2.525 . . . . 0.0 113.328 -175.324 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -112.57 4.98 17.63 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.662 0.268 . . . . 0.0 110.62 176.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -112.6 157.99 20.53 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.167 0.508 . . . . 0.0 110.849 -175.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 746' ' ' VAL . . . . . 0.754 HG21 HD12 ' A' ' 795' ' ' LEU . 10.2 m -120.57 147.76 24.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.601 -178.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 747' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -119.78 107.82 13.65 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.098 178.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 748' ' ' ILE . . . . . 0.437 HD13 ' HG ' ' A' ' 795' ' ' LEU . 6.7 mt -94.66 108.44 20.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 176.202 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 749' ' ' THR . . . . . 0.411 HG22 HG12 ' A' ' 753' ' ' VAL . 4.8 t -121.36 165.52 15.41 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.655 -0.248 . . . . 0.0 110.63 -176.154 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 750' ' ' ASP . . . . . 0.76 ' HB3' HG12 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -122.93 148.22 45.71 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.032 0.444 . . . . 0.0 111.306 179.357 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 61.2 -119.64 0.77 Allowed 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.064 -177.032 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 752' ' ' VAL . . . . . . . . . . . . . 29.9 t -125.51 93.8 2.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.041 0.448 . . . . 0.0 111.002 -175.542 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 753' ' ' VAL . . . . . 0.411 HG12 HG22 ' A' ' 749' ' ' THR . 9.8 p -74.74 -21.96 17.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.868 178.162 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 55.42 53.95 9.19 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.108 -179.025 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.25 134.33 32.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.847 -177.622 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -90.25 85.9 6.36 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 175.558 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 77.1 t-105 -68.97 94.47 0.64 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.901 179.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 61.2 mt-30 -82.61 67.59 8.72 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.298 0.57 . . . . 0.0 109.964 176.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 759' ' ' GLY . . . . . 0.595 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -128.91 -136.9 4.22 Favored Glycine 0 N--CA 1.44 -1.071 0 CA-C-N 115.64 -0.709 . . . . 0.0 112.188 -178.44 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 7.5 ttm-85 -86.43 -47.84 8.96 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.818 0.342 . . . . 0.0 110.456 178.1 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 761' ' ' ALA . . . . . 0.411 ' O ' ' HA ' ' A' ' 746' ' ' VAL . . . -164.66 138.42 5.08 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.921 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 2.4 p -113.92 130.53 67.92 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 172.44 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 763' ' ' VAL . . . . . 0.442 HG12 HD11 ' A' ' 791' ' ' LEU . 0.7 OUTLIER -115.65 113.13 42.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-O 120.971 0.415 . . . . 0.0 110.5 -178.032 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 764' ' ' THR . . . . . 0.466 HG21 HG13 ' A' ' 772' ' ' ILE . 44.5 m -102.66 112.78 25.71 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.983 -175.509 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 765' ' ' PHE . . . . . 0.721 ' HE1' HG23 ' A' ' 785' ' ' VAL . 6.2 m-85 -88.58 105.72 17.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.818 174.706 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.23 134.02 37.13 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.691 0.281 . . . . 0.0 110.949 -173.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 767' ' ' ARG . . . . . 0.411 ' HA ' ' HD3' ' A' ' 767' ' ' ARG . 0.1 OUTLIER -112.66 -64.52 1.29 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.114 -178.092 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.15 -31.97 3.52 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.783 0.325 . . . . 0.0 111.395 -176.152 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 9.6 t-80 -115.31 133.5 55.97 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.182 0.515 . . . . 0.0 110.779 -177.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 770' ' ' ILE . . . . . 0.521 HG23 ' H ' ' A' ' 771' ' ' GLY . 2.0 mt -106.07 158.77 6.28 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.459 176.322 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 771' ' ' GLY . . . . . 0.521 ' H ' HG23 ' A' ' 770' ' ' ILE . . . -175.78 -37.76 0.05 OUTLIER Glycine 0 CA--C 1.507 -0.468 0 N-CA-C 110.806 -0.918 . . . . 0.0 110.806 -178.823 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 772' ' ' ILE . . . . . 0.768 HG21 ' HD2' ' A' ' 773' ' ' PRO . 1.6 mm -83.8 133.92 45.36 Favored Pre-proline 0 C--N 1.324 -0.52 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 172.835 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 773' ' ' PRO . . . . . 0.768 ' HD2' HG21 ' A' ' 772' ' ' ILE . 23.6 Cg_endo -62.41 -92.86 0.0 OUTLIER 'Trans proline' 0 CA--C 1.535 0.531 0 C-N-CA 122.93 2.42 . . . . 0.0 113.75 -175.633 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . 0.711 ' HA ' HG12 ' A' ' 782' ' ' VAL . 1.3 pt? 165.98 -171.8 0.01 OUTLIER 'General case' 0 C--O 1.234 0.268 0 C-N-CA 123.147 0.579 . . . . 0.0 110.218 -174.569 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 775' ' ' GLU . . . . . 0.587 ' HG3' ' HA ' ' A' ' 781' ' ' TRP . 1.5 mp0 -62.07 69.18 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 O-C-N 123.834 0.709 . . . . 0.0 112.036 172.806 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 18.7 pttt -128.79 7.87 5.7 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 172.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 777' ' ' ALA . . . . . 0.41 ' HA ' ' HD3' ' A' ' 778' ' ' PRO . . . -145.07 149.37 41.84 Favored Pre-proline 0 N--CA 1.449 -0.515 0 CA-C-N 114.348 -1.296 . . . . 0.0 109.122 -179.157 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 778' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 777' ' ' ALA . 24.7 Cg_exo -64.16 93.92 0.19 Allowed 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.72 2.28 . . . . 0.0 112.407 -179.452 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 112.15 19.62 7.1 Favored Glycine 0 C--O 1.228 -0.255 0 C-N-CA 120.923 -0.656 . . . . 0.0 113.2 176.794 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 780' ' ' GLU . . . . . 0.522 ' O ' ' HA ' ' A' ' 775' ' ' GLU . 0.1 OUTLIER -119.73 124.88 47.29 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 177.593 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 781' ' ' TRP . . . . . 0.62 ' HZ3' HD13 ' A' ' 794' ' ' LEU . 17.0 m95 -137.24 136.02 37.73 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 -176.556 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . 0.711 HG12 ' HA ' ' A' ' 774' ' ' LEU . 32.6 m -129.69 155.67 41.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.981 0.419 . . . . 0.0 110.875 176.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 783' ' ' HIS . . . . . 0.53 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.2 OUTLIER -161.18 126.92 3.77 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.931 176.189 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -96.67 99.48 11.09 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 120.874 0.369 . . . . 0.0 110.03 177.703 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 785' ' ' VAL . . . . . 0.721 HG23 ' HE1' ' A' ' 765' ' ' PHE . 0.0 OUTLIER -171.24 -170.52 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.225 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -179.747 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 786' ' ' ALA . . . . . 0.471 ' HA ' HD11 ' A' ' 718' ' ' LEU . . . -123.67 56.72 1.2 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.733 0.301 . . . . 0.0 110.824 178.111 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 787' ' ' ALA . . . . . 0.595 ' HB2' HD22 ' A' ' 718' ' ' LEU . . . 53.57 63.23 8.31 Favored Pre-proline 0 N--CA 1.467 0.382 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.34 178.717 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 788' ' ' PRO . . . . . 0.616 ' HD2' ' OE1' ' A' ' 790' ' ' GLU . 5.2 Cg_exo -76.01 43.27 1.1 Allowed 'Trans proline' 0 CA--C 1.534 0.498 0 C-N-CA 123.086 2.524 . . . . 0.0 113.292 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 69.71 -0.02 2.82 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 171.0 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 790' ' ' GLU . . . . . 0.616 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -94.55 -46.08 7.13 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 121.882 -0.511 . . . . 0.0 111.305 -177.447 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 791' ' ' LEU . . . . . 0.493 HD13 ' CZ ' ' A' ' 765' ' ' PHE . 0.2 OUTLIER -58.82 -45.05 99.64 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -179.926 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 792' ' ' PRO . . . . . 0.408 ' HG3' HD23 ' A' ' 722' ' ' LEU . 51.7 Cg_exo -54.17 -31.87 67.7 Favored 'Trans proline' 0 C--N 1.356 0.941 0 C-N-CA 121.717 1.611 . . . . 0.0 111.974 175.917 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -70.44 -44.37 67.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.774 179.006 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 794' ' ' LEU . . . . . 0.62 HD13 ' HZ3' ' A' ' 781' ' ' TRP . 0.3 OUTLIER -71.55 -28.76 64.09 Favored 'General case' 0 C--O 1.219 -0.51 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.732 179.784 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 795' ' ' LEU . . . . . 0.754 HD12 HG21 ' A' ' 746' ' ' VAL . 0.1 OUTLIER -62.99 -39.42 94.69 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.116 0.484 . . . . 0.0 110.072 177.037 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -62.94 -48.85 77.13 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.262 177.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 797' ' ' ARG . . . . . 0.636 ' HA ' HD21 ' A' ' 800' ' ' LEU . 8.8 ptp180 -71.45 -32.99 68.95 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.684 -177.541 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 798' ' ' ILE . . . . . 0.425 ' HB ' ' O ' ' A' ' 794' ' ' LEU . 0.1 OUTLIER -60.95 -34.01 57.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.622 0.249 . . . . 0.0 111.061 175.569 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 799' ' ' TYR . . . . . 0.436 ' HD1' ' HA ' ' A' ' 799' ' ' TYR . 0.5 OUTLIER -83.19 -61.48 1.84 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.658 -0.246 . . . . 0.0 110.424 177.631 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 800' ' ' LEU . . . . . 0.636 HD21 ' HA ' ' A' ' 797' ' ' ARG . 0.2 OUTLIER . . . . . 0 N--CA 1.468 0.436 0 O-C-N 123.666 0.604 . . . . 0.0 112.122 178.661 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 824' ' ' ASP . . . . . 0.445 ' HB3' ' H ' ' A' ' 825' ' ' MET . 19.2 t0 . . . . . 0 CA--C 1.53 0.193 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 825' ' ' MET . . . . . 0.555 ' O ' ' HB2' ' A' ' 850' ' ' GLN . 0.0 OUTLIER -115.76 139.0 50.58 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.915 -175.551 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 826' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -105.39 123.13 47.36 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.041 -176.496 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 827' ' ' ILE . . . . . . . . . . . . . 1.2 mm -119.87 124.28 72.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.699 177.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 828' ' ' LEU . . . . . 0.58 HD11 HG12 ' A' ' 863' ' ' VAL . 3.1 tp -109.01 123.31 48.92 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.648 0.261 . . . . 0.0 110.699 -178.229 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 27.0 m -105.43 128.36 59.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.822 177.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 830' ' ' VAL . . . . . 0.5 ' HA ' ' O ' ' A' ' 854' ' ' ALA . 0.2 OUTLIER -126.09 87.48 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 116.771 -0.195 . . . . 0.0 111.047 -177.775 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 831' ' ' ASP . . . . . 0.573 ' HA ' ' O ' ' A' ' 875' ' ' ASP . 9.9 t70 -107.67 137.97 44.73 Favored 'General case' 0 CA--C 1.515 -0.397 0 C-N-CA 120.631 -0.428 . . . . 0.0 110.388 -178.893 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.38 -31.2 72.29 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.125 -178.307 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 833' ' ' HIS . . . . . 0.401 ' HA ' ' HD3' ' A' ' 834' ' ' PRO . 0.2 OUTLIER -108.81 128.77 24.9 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-O 120.781 0.324 . . . . 0.0 111.697 -173.549 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 834' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 833' ' ' HIS . 67.6 Cg_exo -53.81 -45.26 42.3 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 123.51 2.807 . . . . 0.0 113.584 -178.711 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 835' ' ' ILE . . . . . 0.433 ' HA ' ' HD2' ' A' ' 838' ' ' ARG . 1.1 pt -65.35 -37.17 79.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 121.074 0.464 . . . . 0.0 110.778 -179.29 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 836' ' ' ASN . . . . . 0.405 ' N ' HG13 ' A' ' 835' ' ' ILE . 3.0 t30 -72.06 -45.47 60.61 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.692 179.563 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 837' ' ' ARG . . . . . 0.485 ' HA ' HD13 ' A' ' 840' ' ' LEU . 19.2 ttp180 -53.73 -47.73 70.32 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.377 -0.828 . . . . 0.0 111.07 177.386 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 838' ' ' ARG . . . . . 0.433 ' HD2' ' HA ' ' A' ' 835' ' ' ILE . 0.0 OUTLIER -66.01 -29.6 70.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.806 -179.827 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.92 -51.4 62.06 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.727 179.475 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 840' ' ' LEU . . . . . 0.485 HD13 ' HA ' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -72.32 -29.6 63.99 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.673 0.273 . . . . 0.0 110.873 -179.859 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -66.65 -31.14 71.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.045 0.45 . . . . 0.0 110.442 176.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -68.5 -44.16 75.29 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.806 175.05 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 843' ' ' GLN . . . . . 0.592 ' HG3' HD23 ' A' ' 929' ' ' LEU . 0.0 OUTLIER -60.39 -52.42 65.32 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.861 178.929 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 844' ' ' LEU . . . . . 0.496 ' HG ' HD22 ' A' ' 847' ' ' LEU . 0.2 OUTLIER -61.63 -31.62 71.72 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.91 177.555 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -65.36 -33.63 87.17 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 121.122 -0.561 . . . . 0.0 112.364 177.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.29 -22.85 51.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.963 0.411 . . . . 0.0 110.291 175.721 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 847' ' ' LEU . . . . . 0.496 HD22 ' HG ' ' A' ' 844' ' ' LEU . 1.0 OUTLIER -72.98 -44.33 61.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.06 177.478 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 100.19 25.48 8.88 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.54 -0.838 . . . . 0.0 113.912 172.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 6.0 m-30 -103.68 169.12 8.71 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 117.254 0.527 . . . . 0.0 109.865 176.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 850' ' ' GLN . . . . . 0.555 ' HB2' ' O ' ' A' ' 825' ' ' MET . 2.2 mt-30 -69.1 111.33 5.0 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 110.368 -0.234 . . . . 0.0 110.368 -178.577 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -98.63 112.94 24.84 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.055 0.455 . . . . 0.0 111.409 -175.092 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 852' ' ' LYS . . . . . 0.577 ' HB3' HD13 ' A' ' 828' ' ' LEU . 0.2 OUTLIER -101.56 110.48 22.48 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 173.851 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.26 117.6 29.78 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.666 -175.868 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 854' ' ' ALA . . . . . 0.5 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -136.83 162.28 33.65 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.626 178.796 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 26.7 p-10 -153.01 75.53 1.09 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.095 0.474 . . . . 0.0 111.689 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 856' ' ' ASP . . . . . . . . . . . . . 27.9 t70 173.1 150.94 0.07 Allowed 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.176 176.159 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -72.33 -47.85 27.28 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 121.183 -0.532 . . . . 0.0 112.656 -179.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -73.16 -34.14 43.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.027 0.442 . . . . 0.0 110.232 -177.099 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -61.49 -35.14 76.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.793 176.005 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -66.28 -39.5 89.43 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.681 177.573 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 861' ' ' LEU . . . . . 0.538 HD12 ' HB3' ' A' ' 889' ' ' ARG . 1.9 mt -67.17 -40.92 86.66 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.156 0.503 . . . . 0.0 110.337 177.348 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -63.0 -45.72 91.06 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.522 178.692 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 863' ' ' VAL . . . . . 0.58 HG12 HD11 ' A' ' 828' ' ' LEU . 0.3 OUTLIER -66.36 -31.99 56.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.918 179.913 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 864' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.6 -35.75 80.55 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.913 0.387 . . . . 0.0 110.084 175.851 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 2.2 m -74.4 -37.97 63.24 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.438 178.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -65.03 -54.03 36.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.164 -179.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -144.17 143.19 30.98 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.505 -179.416 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -73.5 140.56 46.48 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.962 -179.742 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 869' ' ' ILE . . . . . 0.416 HG21 ' N ' ' A' ' 870' ' ' ASP . 1.9 mp -120.55 134.05 65.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.023 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 870' ' ' ASP . . . . . 0.416 ' N ' HG21 ' A' ' 869' ' ' ILE . 8.9 m-20 -74.88 -55.46 5.78 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.039 0.447 . . . . 0.0 110.617 -177.769 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 871' ' ' ILE . . . . . 0.66 HD12 ' HB3' ' A' ' 939' ' ' TYR . 28.4 mm -117.2 120.83 66.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.157 -177.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 872' ' ' VAL . . . . . 0.45 ' H ' HG21 ' A' ' 872' ' ' VAL . 0.0 OUTLIER -105.82 125.56 61.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.821 -178.055 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 873' ' ' LEU . . . . . . . . . . . . . 26.5 mt -110.95 108.77 18.64 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 177.01 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 2.1 m -94.39 96.72 9.71 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 177.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 875' ' ' ASP . . . . . 0.573 ' O ' ' HA ' ' A' ' 831' ' ' ASP . 3.1 m-20 -93.03 104.41 16.63 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.822 0.82 . . . . 0.0 110.78 -173.762 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 876' ' ' VAL . . . . . 0.474 ' HB ' HG22 ' A' ' 903' ' ' THR . 0.2 OUTLIER -104.65 89.07 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.752 -178.244 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -68.54 -43.45 76.67 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 174.683 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 10.6 ptm . . . . . 0 N--CA 1.452 -0.346 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.496 173.022 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.866 0 N-CA-C 111.951 -0.46 . . . . 0.0 111.951 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -149.17 -36.99 0.17 Allowed 'General case' 0 C--O 1.235 0.312 0 CA-C-O 120.47 0.176 . . . . 0.0 111.462 -179.727 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -68.44 -46.24 70.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.495 -176.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -55.89 -49.78 72.48 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.394 177.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.1 -45.35 87.36 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.437 -177.884 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -64.67 -49.99 68.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.929 179.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 889' ' ' ARG . . . . . 0.538 ' HB3' HD12 ' A' ' 861' ' ' LEU . 0.0 OUTLIER -64.15 -41.16 97.29 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.853 -174.659 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 890' ' ' ILE . . . . . 0.563 HG23 ' N ' ' A' ' 891' ' ' ARG . 0.9 OUTLIER -68.5 -40.41 82.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 111.511 0.189 . . . . 0.0 111.511 -176.646 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 891' ' ' ARG . . . . . 0.563 ' N ' HG23 ' A' ' 890' ' ' ILE . 0.4 OUTLIER -75.31 -24.38 57.44 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.068 0.461 . . . . 0.0 110.425 178.988 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -73.36 -54.79 7.48 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.795 178.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -67.2 -50.85 59.37 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.306 -174.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 166.46 82.96 0.05 OUTLIER Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 119.775 -1.202 . . . . 0.0 112.887 -178.223 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 895' ' ' LEU . . . . . 0.495 HD13 HG12 ' A' ' 890' ' ' ILE . 4.6 tp -89.93 109.33 20.36 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 175.462 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.16 6.26 5.9 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.054 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 897' ' ' LEU . . . . . 0.417 HD11 HG23 ' A' ' 872' ' ' VAL . 0.0 OUTLIER -123.81 141.22 36.22 Favored Pre-proline 0 C--N 1.325 -0.461 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 179.89 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -61.8 114.67 2.38 Favored 'Trans proline' 0 C--O 1.236 0.422 0 C-N-CA 122.799 2.333 . . . . 0.0 112.847 -176.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 899' ' ' VAL . . . . . 0.646 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 27.1 t -98.64 113.4 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-O 121.361 0.601 . . . . 0.0 110.257 177.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 900' ' ' ILE . . . . . 0.413 HG13 ' OG ' ' A' ' 921' ' ' SER . 1.7 mp -85.63 112.5 22.45 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.688 176.648 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -89.87 104.33 3.11 Favored Glycine 0 N--CA 1.443 -0.878 0 C-N-CA 120.595 -0.812 . . . . 0.0 111.464 177.486 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 902' ' ' VAL . . . . . 0.531 ' HA ' ' O ' ' A' ' 923' ' ' LEU . 0.2 OUTLIER -110.59 103.34 15.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.632 0.729 . . . . 0.0 109.663 179.537 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 903' ' ' THR . . . . . 0.474 HG22 ' HB ' ' A' ' 876' ' ' VAL . 0.2 OUTLIER -108.64 149.13 29.37 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.356 -174.44 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -94.76 135.87 35.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.668 175.336 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 61.28 -156.77 0.34 Allowed 'General case' 0 C--N 1.33 -0.268 0 O-C-N 123.676 0.61 . . . . 0.0 110.247 -176.328 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . 68.92 -71.84 0.11 Allowed 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.39 0.676 . . . . 0.0 111.959 176.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 97.6 mt 68.92 176.33 0.27 Allowed 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 123.203 0.601 . . . . 0.0 111.069 -179.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . 65.49 30.36 10.78 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.518 0.675 . . . . 0.0 109.759 -173.189 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -67.65 -18.02 64.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.842 -1.072 . . . . 0.0 111.546 -174.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 910' ' ' GLU . . . . . 0.434 ' HA ' ' SG ' ' A' ' 922' ' ' CYS . 0.4 OUTLIER -66.13 -42.02 89.69 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.956 0.408 . . . . 0.0 109.963 176.431 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.3 -34.05 65.53 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.043 178.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -66.1 -43.33 87.57 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.859 178.365 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 913' ' ' ARG . . . . . 0.448 ' HA ' ' SD ' ' A' ' 919' ' ' MET . 0.0 OUTLIER -63.12 -35.67 81.05 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.71 179.649 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 82.6 m -71.8 -37.23 70.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.902 0.382 . . . . 0.0 110.349 176.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.53 -51.76 66.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.168 -179.252 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -77.5 -33.0 54.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.299 -177.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.21 48.84 22.29 Favored 'General case' 0 N--CA 1.464 0.266 0 O-C-N 123.675 0.61 . . . . 0.0 111.433 -177.402 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -140.15 25.02 2.66 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.295 -178.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 919' ' ' MET . . . . . 0.646 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -129.72 -111.66 0.26 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.623 0.249 . . . . 0.0 110.757 -177.473 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 920' ' ' ASP . . . . . . . . . . . . . 10.8 t70 169.33 -60.13 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 123.986 0.914 . . . . 0.0 109.034 177.375 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 921' ' ' SER . . . . . 0.413 ' OG ' HG13 ' A' ' 900' ' ' ILE . 0.0 OUTLIER -123.17 170.08 10.6 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.808 178.363 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 922' ' ' CYS . . . . . 0.434 ' SG ' ' HA ' ' A' ' 910' ' ' GLU . 0.8 OUTLIER -144.64 130.39 19.15 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.7 0.286 . . . . 0.0 110.804 -179.34 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 923' ' ' LEU . . . . . 0.531 ' O ' ' HA ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -139.04 165.62 26.67 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 177.327 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -87.43 147.9 25.22 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.004 177.804 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 925' ' ' LYS . . . . . 0.477 ' HA ' ' CG2' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -47.56 -38.81 18.1 Favored Pre-proline 0 CA--C 1.539 0.545 0 N-CA-C 114.02 1.118 . . . . 0.0 114.02 -179.008 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -58.66 77.28 0.04 OUTLIER 'Trans proline' 0 C--N 1.358 1.066 0 C-N-CA 122.039 1.826 . . . . 0.0 112.777 170.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 927' ' ' VAL . . . . . 0.425 HG12 HG11 ' A' ' 931' ' ' VAL . 88.9 t -107.76 97.05 5.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.872 178.202 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.87 170.26 14.07 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.436 -179.674 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 929' ' ' LEU . . . . . 0.592 HD23 ' HG3' ' A' ' 843' ' ' GLN . 0.7 OUTLIER -52.29 -45.84 65.65 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.139 -0.482 . . . . 0.0 112.06 -177.314 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 930' ' ' ASP . . . . . 0.43 ' HA ' ' HE3' ' A' ' 933' ' ' LYS . 0.5 OUTLIER -69.89 -33.6 72.43 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.764 -0.375 . . . . 0.0 110.437 -177.738 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 931' ' ' VAL . . . . . 0.425 HG11 HG12 ' A' ' 927' ' ' VAL . 43.1 t -66.48 -52.12 49.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.768 -179.875 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 932' ' ' ILE . . . . . . . . . . . . . 3.8 tt -65.15 -36.4 77.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.92 0.391 . . . . 0.0 110.582 -179.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 933' ' ' LYS . . . . . 0.43 ' HE3' ' HA ' ' A' ' 930' ' ' ASP . 0.3 OUTLIER -68.2 -47.6 67.46 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.139 -179.398 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 934' ' ' GLN . . . . . 0.538 ' HG3' ' N ' ' A' ' 935' ' ' THR . 0.4 OUTLIER -68.34 -36.52 79.37 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.694 -0.23 . . . . 0.0 111.231 -177.551 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 935' ' ' THR . . . . . 0.538 ' N ' ' HG3' ' A' ' 934' ' ' GLN . 22.9 m -67.34 -43.89 80.45 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.896 0.379 . . . . 0.0 110.531 178.534 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 936' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.5 -47.5 81.45 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.639 179.073 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 34.2 m -62.92 -42.12 99.69 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.004 -179.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 938' ' ' LEU . . . . . 0.457 ' HB2' ' O ' ' A' ' 934' ' ' GLN . 0.6 OUTLIER -60.39 -45.24 94.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.022 179.505 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 939' ' ' TYR . . . . . 0.66 ' HB3' HD12 ' A' ' 871' ' ' ILE . 7.9 m-85 -78.63 -27.33 45.38 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.699 -175.295 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -64.3 -43.61 94.18 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.382 0.611 . . . . 0.0 110.089 174.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 941' ' ' GLU . . . . . 0.419 ' HG3' ' N ' ' A' ' 942' ' ' ARG . 0.0 OUTLIER -73.63 -29.67 62.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.109 177.152 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 942' ' ' ARG . . . . . 0.429 HH11 ' HD3' ' A' ' 942' ' ' ARG . 0.2 OUTLIER -65.9 -47.09 75.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.137 179.973 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 27.5 m -68.17 -29.83 45.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.893 0.378 . . . . 0.0 110.439 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.4 -31.39 71.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.583 174.453 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 20.4 mmtm -70.06 -36.37 74.93 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.071 178.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.96 -45.12 12.49 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.409 -176.223 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.88 -52.59 12.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.28 -177.893 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 3.0 t70 . . . . . 0 C--N 1.326 -0.425 0 CA-C-O 120.71 0.291 . . . . 0.0 110.842 -175.795 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 705' ' ' SER . . . . . 0.743 ' HA ' ' O ' ' A' ' 730' ' ' GLY . 0.9 OUTLIER . . . . . 0 N--CA 1.45 -0.447 0 CA-C-O 121.309 0.576 . . . . 0.0 110.619 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 154.71 -19.77 0.59 Allowed Glycine 0 N--CA 1.448 -0.513 0 N-CA-C 111.033 -0.827 . . . . 0.0 111.033 -175.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 707' ' ' LYS . . . . . 0.436 ' O ' HG13 ' A' ' 732' ' ' VAL . 4.1 mmtt -77.48 130.99 37.72 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 174.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 708' ' ' ARG . . . . . . . . . . . . . 5.9 mtm-85 -95.64 139.55 31.73 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.235 0.54 . . . . 0.0 111.86 -171.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 709' ' ' CYS . . . . . 0.812 ' HG ' ' HH ' ' A' ' 799' ' ' TYR . 0.0 OUTLIER -122.39 116.58 24.26 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.612 174.897 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 710' ' ' TRP . . . . . 0.692 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 93.0 m95 -99.65 118.55 36.43 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.721 0.295 . . . . 0.0 110.298 -177.296 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 711' ' ' LEU . . . . . 0.535 HD21 ' C ' ' A' ' 710' ' ' TRP . 5.2 mt -111.25 118.15 35.13 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.836 0.351 . . . . 0.0 111.424 -176.038 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 712' ' ' ALA . . . . . 0.537 ' HB2' ' HB ' ' A' ' 749' ' ' THR . . . -108.08 44.53 1.1 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.573 0.701 . . . . 0.0 109.382 174.769 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 713' ' ' VAL . . . . . 0.713 HG13 ' HB3' ' A' ' 750' ' ' ASP . 16.3 t -100.29 124.84 54.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.583 -177.655 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 2.1 mtp180 -88.73 -21.02 24.07 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 177.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -71.39 102.4 2.62 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.876 174.665 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 716' ' ' ALA . . . . . 0.537 ' O ' ' HB2' ' A' ' 720' ' ' GLN . . . -59.95 -35.93 75.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.333 -177.21 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.44 -46.35 88.92 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.134 0.492 . . . . 0.0 110.549 178.615 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 718' ' ' LEU . . . . . 0.53 ' HB3' HG11 ' A' ' 713' ' ' VAL . 0.3 OUTLIER -69.38 -48.98 59.52 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.84 -179.76 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 719' ' ' CYS . . . . . 0.64 ' HB2' ' HB ' ' A' ' 713' ' ' VAL . 12.2 t -60.92 -51.77 67.85 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.702 -177.354 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 720' ' ' GLN . . . . . 0.754 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 1.2 mt-30 -63.03 -36.28 83.05 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.767 -176.713 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -59.48 -52.89 63.63 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.169 0.509 . . . . 0.0 110.4 179.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 722' ' ' LEU . . . . . 0.503 HD23 HD13 ' A' ' 791' ' ' LEU . 48.9 mt -66.9 -48.25 69.3 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.316 -178.034 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 723' ' ' GLU . . . . . 0.754 ' HG2' ' HA ' ' A' ' 720' ' ' GLN . 1.4 pt-20 -60.94 -44.76 96.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.825 -173.684 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 724' ' ' THR . . . . . 0.62 ' N ' ' HG3' ' A' ' 723' ' ' GLU . 16.0 m -64.75 -43.3 93.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.79 0.329 . . . . 0.0 110.775 -179.394 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 18.5 m -63.73 -40.16 96.05 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.342 179.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 726' ' ' LEU . . . . . 0.446 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 11.0 mt -71.95 -37.96 69.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.842 0.354 . . . . 0.0 111.211 -179.041 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -66.17 -15.25 62.98 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.862 0.363 . . . . 0.0 111.319 179.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.44 -16.12 60.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.096 0.474 . . . . 0.0 110.612 176.906 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -104.39 -1.08 27.34 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.157 0.503 . . . . 0.0 110.783 177.435 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 730' ' ' GLY . . . . . 0.743 ' O ' ' HA ' ' A' ' 705' ' ' SER . . . 98.13 -0.63 58.88 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.52 179.23 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 731' ' ' ILE . . . . . 0.446 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 36.6 mm -66.22 120.05 12.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 120.683 0.278 . . . . 0.0 110.402 -178.539 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 732' ' ' VAL . . . . . 0.436 HG13 ' O ' ' A' ' 707' ' ' LYS . 1.5 p -78.22 98.14 2.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 122.028 0.918 . . . . 0.0 110.06 -179.384 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 733' ' ' VAL . . . . . 0.494 HG12 ' HB2' ' A' ' 723' ' ' GLU . 82.8 t -81.96 119.95 32.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 114.915 -1.039 . . . . 0.0 110.601 179.746 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.33 125.46 44.39 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.945 177.603 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -59.74 114.42 2.76 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.646 177.334 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 736' ' ' TYR . . . . . 0.692 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 65.1 t80 -72.19 95.31 1.65 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.96 -179.871 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 737' ' ' GLU . . . . . 0.444 ' H ' ' HG3' ' A' ' 737' ' ' GLU . 0.0 OUTLIER -92.86 -52.83 4.42 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.139 0.495 . . . . 0.0 109.912 176.82 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -165.62 68.53 0.2 Allowed Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 111.083 -0.807 . . . . 0.0 111.083 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 15.7 mp0 -117.12 179.71 3.95 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.778 0.323 . . . . 0.0 110.581 -175.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -98.91 142.99 25.56 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.479 -179.123 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 741' ' ' PRO . . . . . 0.569 ' HB2' ' O ' ' A' ' 758' ' ' GLN . 71.8 Cg_endo -79.27 147.5 20.55 Favored 'Trans proline' 0 CA--C 1.532 0.414 0 C-N-CA 122.865 2.377 . . . . 0.0 113.446 -177.911 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 742' ' ' THR . . . . . 0.74 HG21 ' HD2' ' A' ' 743' ' ' PRO . 0.1 OUTLIER -132.61 144.24 52.11 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.597 179.122 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 743' ' ' PRO . . . . . 0.786 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 28.7 Cg_endo -62.5 -12.6 28.69 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 123.573 2.849 . . . . 0.0 113.777 -175.13 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 31.8 tp10 -98.08 -9.99 25.02 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.061 0.457 . . . . 0.0 110.792 179.39 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -106.65 158.47 16.93 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.321 -167.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 746' ' ' VAL . . . . . 0.404 HG23 ' N ' ' A' ' 747' ' ' LEU . 6.4 p -126.64 138.56 54.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.731 -179.053 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 747' ' ' LEU . . . . . 0.478 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 0.0 OUTLIER -103.79 103.35 13.22 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.916 177.167 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 27.5 mt -94.93 107.64 19.75 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 175.377 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 749' ' ' THR . . . . . 0.537 ' HB ' ' HB2' ' A' ' 712' ' ' ALA . 1.9 t -119.92 148.19 43.81 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.611 -174.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 750' ' ' ASP . . . . . 0.713 ' HB3' HG13 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -109.54 126.32 53.44 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 176.421 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 751' ' ' GLU . . . . . 0.483 ' HB2' ' O ' ' A' ' 750' ' ' ASP . 3.6 mm-40 74.5 173.93 0.27 Allowed 'General case' 0 C--O 1.235 0.325 0 CA-C-N 114.684 -1.143 . . . . 0.0 110.372 -170.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 752' ' ' VAL . . . . . 0.564 HG11 HG13 ' A' ' 772' ' ' ILE . 27.7 t -81.31 102.82 7.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.243 -176.208 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 7.1 p -80.7 -1.21 4.67 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.09 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 40.7 m 58.88 40.3 22.86 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.404 178.618 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -130.14 153.87 48.08 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.579 178.28 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 756' ' ' LYS . . . . . 0.539 ' O ' ' HD2' ' A' ' 756' ' ' LYS . 0.0 OUTLIER -95.78 -49.26 5.42 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 123.071 0.232 . . . . 0.0 111.136 -178.079 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 757' ' ' TRP . . . . . 0.478 ' CD2' ' HB2' ' A' ' 747' ' ' LEU . 71.4 t-105 76.88 139.47 0.07 Allowed 'General case' 0 N--CA 1.467 0.402 0 O-C-N 123.88 0.737 . . . . 0.0 110.634 179.486 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 758' ' ' GLN . . . . . 0.569 ' O ' ' HB2' ' A' ' 741' ' ' PRO . 0.0 OUTLIER -128.37 105.02 8.05 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.81 178.341 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 759' ' ' GLY . . . . . 0.786 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -178.03 -140.77 3.93 Favored Glycine 0 N--CA 1.44 -1.085 0 C-N-CA 119.733 -1.222 . . . . 0.0 112.824 -178.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 7.2 ttm105 -67.19 -52.76 37.36 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.927 0.394 . . . . 0.0 110.086 -179.219 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -170.44 165.32 8.63 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.53 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 2.2 p -131.66 120.52 45.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.845 174.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 57.9 t -104.92 104.03 16.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 116.165 -0.471 . . . . 0.0 109.929 -178.436 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 764' ' ' THR . . . . . 0.759 HG23 HD13 ' A' ' 772' ' ' ILE . 38.5 m -103.18 117.5 34.67 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.415 -177.816 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 765' ' ' PHE . . . . . 0.598 ' HZ ' ' HG ' ' A' ' 791' ' ' LEU . 75.9 m-85 -81.84 133.3 35.31 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.046 176.477 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -95.93 136.43 36.38 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 -179.032 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 767' ' ' ARG . . . . . 0.447 ' HB3' ' HD2' ' A' ' 768' ' ' ARG . 0.0 OUTLIER -136.92 -73.04 0.43 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.722 0.296 . . . . 0.0 110.953 -178.253 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 768' ' ' ARG . . . . . 0.447 ' HD2' ' HB3' ' A' ' 767' ' ' ARG . 0.0 OUTLIER -112.25 -35.28 5.66 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.028 -176.396 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 74.3 m80 -100.33 136.94 39.45 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.308 -178.298 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 2.6 mt -129.92 127.74 64.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.955 -179.199 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . 148.72 26.1 0.07 OUTLIER Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.317 -0.944 . . . . 0.0 112.972 179.293 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 772' ' ' ILE . . . . . 0.759 HD13 HG23 ' A' ' 764' ' ' THR . 0.0 OUTLIER -104.56 146.49 32.72 Favored Pre-proline 0 C--N 1.324 -0.5 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 176.912 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 773' ' ' PRO . . . . . 0.479 ' HD2' HG12 ' A' ' 772' ' ' ILE . 26.4 Cg_endo -61.73 125.76 17.42 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.615 2.21 . . . . 0.0 112.82 -178.398 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . 0.565 ' HA ' HG12 ' A' ' 782' ' ' VAL . 0.4 OUTLIER -98.13 -162.14 0.93 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.893 176.666 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 775' ' ' GLU . . . . . 0.596 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 2.4 mp0 -67.62 59.6 0.06 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 122.099 0.952 . . . . 0.0 112.691 177.903 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 776' ' ' LYS . . . . . 0.51 ' HE3' HD22 ' A' ' 774' ' ' LEU . 14.5 ptpt -128.19 10.9 6.39 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 167.908 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 777' ' ' ALA . . . . . 0.579 ' HB3' ' HD2' ' A' ' 778' ' ' PRO . . . -133.79 164.63 42.61 Favored Pre-proline 0 N--CA 1.446 -0.645 0 CA-C-N 113.741 -1.572 . . . . 0.0 108.692 178.485 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 778' ' ' PRO . . . . . 0.579 ' HD2' ' HB3' ' A' ' 777' ' ' ALA . 14.2 Cg_endo -55.44 -24.35 43.22 Favored 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 123.591 2.861 . . . . 0.0 115.64 -169.756 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . -158.49 27.62 0.42 Allowed Glycine 0 CA--C 1.507 -0.407 0 C-N-CA 119.804 -1.189 . . . . 0.0 112.316 -174.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 780' ' ' GLU . . . . . 0.596 ' O ' ' HG3' ' A' ' 775' ' ' GLU . 13.8 mp0 -103.67 129.13 50.95 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -175.384 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 14.3 m95 -133.01 140.6 47.83 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 -177.561 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . 0.565 HG12 ' HA ' ' A' ' 774' ' ' LEU . 4.4 m -135.7 148.71 28.03 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.319 0 CA-C-O 120.53 0.205 . . . . 0.0 110.637 174.008 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 783' ' ' HIS . . . . . 0.546 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.1 OUTLIER -169.98 148.72 3.5 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.793 0.33 . . . . 0.0 110.978 177.771 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -105.48 102.32 11.8 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.078 175.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 1.4 p -171.03 160.02 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 -179.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -94.63 25.01 4.22 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.787 0.327 . . . . 0.0 111.289 -178.574 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 52.43 64.47 7.41 Favored Pre-proline 0 CA--C 1.535 0.378 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.972 -179.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 788' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -65.43 -50.68 1.78 Allowed 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.55 2.166 . . . . 0.0 111.947 -178.113 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 789' ' ' HIS . . . . . 0.403 ' O ' ' HB1' ' A' ' 793' ' ' ALA . 0.0 OUTLIER -161.98 -30.84 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.06 -179.685 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 790' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.57 -45.17 95.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.914 -0.584 . . . . 0.0 112.14 -178.183 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 791' ' ' LEU . . . . . 0.598 ' HG ' ' HZ ' ' A' ' 765' ' ' PHE . 0.3 OUTLIER -66.41 -53.66 29.2 Favored Pre-proline 0 CA--C 1.534 0.363 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -177.469 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 792' ' ' PRO . . . . . 0.409 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 9.7 Cg_endo -56.97 -34.58 97.76 Favored 'Trans proline' 0 C--N 1.357 0.98 0 C-N-CA 121.441 1.427 . . . . 0.0 112.17 176.187 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 793' ' ' ALA . . . . . 0.403 ' HB1' ' O ' ' A' ' 789' ' ' HIS . . . -64.05 -44.79 91.39 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.76 0.314 . . . . 0.0 110.624 176.408 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 794' ' ' LEU . . . . . 0.611 ' HA ' ' HD3' ' A' ' 797' ' ' ARG . 1.3 tm? -58.97 -49.13 79.05 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.16 178.678 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 795' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -65.42 -41.24 93.76 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.336 -176.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -60.12 -50.36 74.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.286 -179.521 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 797' ' ' ARG . . . . . 0.611 ' HD3' ' HA ' ' A' ' 794' ' ' LEU . 0.0 OUTLIER -71.82 -25.4 61.97 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.583 -177.423 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 798' ' ' ILE . . . . . 0.493 HD12 HD13 ' A' ' 794' ' ' LEU . 0.0 OUTLIER -73.93 -23.73 19.1 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 CA-C-O 120.942 0.401 . . . . 0.0 111.29 178.436 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 799' ' ' TYR . . . . . 0.812 ' HH ' ' HG ' ' A' ' 709' ' ' CYS . 5.7 m-85 -80.26 -19.3 47.1 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.787 177.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 5.3 mt . . . . . 0 C--O 1.234 0.265 0 O-C-N 124.291 0.995 . . . . 0.0 112.011 177.955 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 824' ' ' ASP . . . . . 0.431 ' HB3' ' H ' ' A' ' 825' ' ' MET . 13.9 t0 . . . . . 0 C--O 1.231 0.129 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 825' ' ' MET . . . . . 0.456 ' HB2' ' HE3' ' A' ' 825' ' ' MET . 35.9 ttm -96.32 137.62 35.13 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.715 -175.863 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 826' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.66 120.23 37.38 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.886 -177.713 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 827' ' ' ILE . . . . . 0.73 HD12 ' HB ' ' A' ' 871' ' ' ILE . 13.0 mm -107.59 125.21 63.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.5 176.213 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 828' ' ' LEU . . . . . 0.488 HD12 HG11 ' A' ' 863' ' ' VAL . 6.7 tp -98.66 130.11 45.16 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.883 0.373 . . . . 0.0 110.613 -177.529 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 829' ' ' VAL . . . . . 0.767 HG23 HD13 ' A' ' 840' ' ' LEU . 0.2 OUTLIER -118.92 117.08 53.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.852 179.117 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 830' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -112.54 99.36 8.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 115.617 -0.719 . . . . 0.0 109.521 178.021 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 831' ' ' ASP . . . . . 0.642 ' HB3' ' HG3' ' A' ' 837' ' ' ARG . 0.2 OUTLIER -117.29 146.98 42.97 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.834 0.349 . . . . 0.0 110.385 -178.609 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 832' ' ' ASP . . . . . 0.463 ' HB3' HG13 ' A' ' 876' ' ' VAL . 0.0 OUTLIER -91.75 -14.29 30.18 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.272 -172.449 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 2.5 m80 -124.98 98.42 36.35 Favored Pre-proline 0 C--N 1.327 -0.408 0 C-N-CA 120.881 -0.328 . . . . 0.0 111.346 -176.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 834' ' ' PRO . . . . . 0.56 ' HA ' ' HD3' ' A' ' 837' ' ' ARG . 15.1 Cg_exo -31.37 -41.98 0.11 Allowed 'Trans proline' 0 C--N 1.352 0.744 1 C-N-CA 125.899 4.399 . . . . 0.0 117.0 -169.29 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -58.94 -35.38 56.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.824 0.345 . . . . 0.0 111.569 -177.469 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 836' ' ' ASN . . . . . 0.586 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 62.1 m-80 -72.32 -38.84 68.57 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 -179.002 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 837' ' ' ARG . . . . . 0.642 ' HG3' ' HB3' ' A' ' 831' ' ' ASP . 0.0 OUTLIER -51.72 -45.33 63.56 Favored 'General case' 0 C--O 1.224 -0.263 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.112 177.002 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 838' ' ' ARG . . . . . 0.488 ' HD3' ' N ' ' A' ' 839' ' ' LEU . 0.0 OUTLIER -59.09 -50.39 74.26 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.248 176.843 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 839' ' ' LEU . . . . . 0.488 ' N ' ' HD3' ' A' ' 838' ' ' ARG . 0.1 OUTLIER -62.99 -52.87 61.32 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.706 -0.679 . . . . 0.0 112.551 -170.045 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 840' ' ' LEU . . . . . 0.767 HD13 HG23 ' A' ' 829' ' ' VAL . 0.0 OUTLIER -72.24 -33.11 67.28 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 120.293 -0.563 . . . . 0.0 110.964 -176.703 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -67.54 -39.3 85.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.933 0.397 . . . . 0.0 110.37 179.412 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.97 -41.18 97.63 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.089 177.396 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 843' ' ' GLN . . . . . 0.889 ' HG2' HD21 ' A' ' 929' ' ' LEU . 11.4 mt-30 -58.62 -48.05 82.3 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.214 175.672 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 844' ' ' LEU . . . . . 0.644 ' HG ' HD23 ' A' ' 936' ' ' LEU . 0.1 OUTLIER -59.81 -34.69 73.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.751 -0.658 . . . . 0.0 111.038 177.495 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -65.2 -40.2 96.6 Favored Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.89 -0.596 . . . . 0.0 112.411 178.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.81 -25.02 64.46 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.884 0.373 . . . . 0.0 110.574 178.416 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.18 -27.51 61.68 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.145 0.498 . . . . 0.0 110.196 176.06 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 94.39 25.46 16.1 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.755 -0.736 . . . . 0.0 113.16 175.206 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -115.91 161.98 18.01 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.986 0.393 . . . . 0.0 110.654 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.55 131.0 37.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.321 -177.545 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -116.63 142.99 46.18 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.665 -178.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.11 109.84 13.4 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 175.603 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 853' ' ' THR . . . . . 0.678 HG23 HG13 ' A' ' 829' ' ' VAL . 0.0 OUTLIER -94.21 133.99 37.15 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.945 0.402 . . . . 0.0 111.395 -175.988 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 854' ' ' ALA . . . . . . . . . . . . . . . -146.79 177.15 9.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.783 178.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 855' ' ' ASN . . . . . 0.575 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 42.5 t30 -154.58 80.72 1.1 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.349 177.754 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 856' ' ' ASP . . . . . 0.575 ' HB2' ' O ' ' A' ' 855' ' ' ASN . 2.1 t0 164.85 145.27 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.538 0 O-C-N 123.979 0.799 . . . . 0.0 110.151 177.285 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -73.59 -42.33 40.54 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.179 179.617 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 3.6 m -69.41 -31.34 49.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.778 0.323 . . . . 0.0 111.015 -178.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -73.96 -37.19 64.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.847 0.356 . . . . 0.0 110.539 179.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -61.1 -36.64 80.24 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.09 175.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 861' ' ' LEU . . . . . 0.594 HD11 ' HB3' ' A' ' 889' ' ' ARG . 6.8 mt -68.41 -43.46 77.14 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.574 176.763 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 32.5 t30 -58.69 -50.28 74.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.817 179.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 863' ' ' VAL . . . . . 0.488 HG11 HD12 ' A' ' 828' ' ' LEU . 1.6 p -64.4 -30.99 51.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.987 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 864' ' ' LEU . . . . . 0.493 ' HA ' HD13 ' A' ' 869' ' ' ILE . 0.7 OUTLIER -63.24 -38.02 89.53 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.002 0.429 . . . . 0.0 110.973 177.307 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -83.34 -18.89 37.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.909 0.385 . . . . 0.0 111.03 -177.45 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 11.6 tptp -87.54 -46.54 9.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.121 -178.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -130.9 165.49 22.96 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.874 -174.529 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 53.5 t60 -87.66 128.77 35.28 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.929 0.395 . . . . 0.0 110.695 -179.01 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 869' ' ' ILE . . . . . 0.493 HD13 ' HA ' ' A' ' 864' ' ' LEU . 4.4 mt -117.31 136.68 53.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.389 174.738 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 870' ' ' ASP . . . . . 0.401 ' OD2' ' HG3' ' A' ' 825' ' ' MET . 23.0 m-20 -88.53 -48.72 7.38 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.814 0.34 . . . . 0.0 110.856 -177.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 871' ' ' ILE . . . . . 0.73 ' HB ' HD12 ' A' ' 827' ' ' ILE . 6.6 mm -128.4 137.26 57.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.316 -179.127 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 872' ' ' VAL . . . . . 0.476 ' N ' HG22 ' A' ' 871' ' ' ILE . 0.0 OUTLIER -110.4 117.9 55.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.66 0.267 . . . . 0.0 111.173 -179.36 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 873' ' ' LEU . . . . . 0.413 HD13 ' HB ' ' A' ' 829' ' ' VAL . 0.3 OUTLIER -105.09 113.0 26.33 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 175.192 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -104.71 96.85 6.85 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 177.671 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 875' ' ' ASP . . . . . 0.639 ' O ' ' HA ' ' A' ' 831' ' ' ASP . 52.8 t0 -104.83 106.95 17.66 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.395 0.617 . . . . 0.0 110.395 -174.876 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 876' ' ' VAL . . . . . 0.463 HG13 ' HB3' ' A' ' 832' ' ' ASP . 0.0 OUTLIER -124.56 134.66 66.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.302 -176.273 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -72.1 -50.39 28.5 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 173.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 3.2 ptm . . . . . 0 C--N 1.325 -0.479 0 CA-C-N 115.315 -0.857 . . . . 0.0 108.805 174.414 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.722 0 N-CA-C 111.264 -0.735 . . . . 0.0 111.264 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 30.7 t80 -122.68 -44.34 2.22 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.082 0.468 . . . . 0.0 110.423 -177.015 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.46 -38.51 80.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.074 -177.793 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.33 -48.89 73.85 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.62 -178.48 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.53 -42.68 98.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.442 -178.704 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.16 -48.52 81.19 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.37 178.562 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 889' ' ' ARG . . . . . 0.594 ' HB3' HD11 ' A' ' 861' ' ' LEU . 0.0 OUTLIER -63.15 -41.87 99.35 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.768 -176.651 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 890' ' ' ILE . . . . . 0.57 ' HA ' HD22 ' A' ' 861' ' ' LEU . 8.1 mm -58.8 -52.81 55.74 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 121.131 0.491 . . . . 0.0 111.023 -178.888 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 891' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -71.48 -22.72 61.77 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.795 -179.1 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.31 -45.85 78.91 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.832 0.349 . . . . 0.0 110.41 177.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -67.82 -43.8 78.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.301 178.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 125.41 81.5 0.44 Allowed Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 120.219 -0.991 . . . . 0.0 112.567 178.133 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 895' ' ' LEU . . . . . 0.615 ' HG ' ' O ' ' A' ' 895' ' ' LEU . 0.3 OUTLIER -70.33 120.67 16.34 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.244 0.545 . . . . 0.0 110.211 178.452 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -113.97 8.86 17.29 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.601 0.715 . . . . 0.0 110.895 179.22 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 897' ' ' LEU . . . . . 0.484 HD23 ' O ' ' A' ' 869' ' ' ILE . 0.0 OUTLIER -130.43 137.85 31.74 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.541 -176.481 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -58.97 120.38 8.21 Favored 'Trans proline' 0 C--O 1.236 0.406 0 C-N-CA 122.656 2.237 . . . . 0.0 112.104 -178.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 899' ' ' VAL . . . . . 0.695 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 7.4 t -95.36 127.71 47.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.096 0.474 . . . . 0.0 110.629 -179.118 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 900' ' ' ILE . . . . . . . . . . . . . 4.5 mt -107.95 109.6 28.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.851 176.215 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 901' ' ' GLY . . . . . 0.45 ' HA3' ' SD ' ' A' ' 919' ' ' MET . . . -92.95 97.82 2.31 Favored Glycine 0 N--CA 1.444 -0.812 0 CA-C-N 115.865 -0.607 . . . . 0.0 112.319 -178.124 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 902' ' ' VAL . . . . . 0.92 ' HB ' ' HB3' ' A' ' 923' ' ' LEU . 0.2 OUTLIER -94.07 119.77 42.47 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.218 0.532 . . . . 0.0 109.797 175.981 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 903' ' ' THR . . . . . 0.484 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.3 OUTLIER -125.68 154.68 42.02 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.562 -179.098 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -88.22 102.56 14.93 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.636 -0.426 . . . . 0.0 110.685 178.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 14.2 t30 40.65 67.55 0.5 Allowed 'General case' 0 N--CA 1.47 0.574 0 O-C-N 124.135 0.897 . . . . 0.0 112.168 176.64 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -72.83 -53.36 11.68 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.035 -177.088 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 167.52 -53.68 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 -176.937 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -163.87 86.6 0.49 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.379 -1.282 . . . . 0.0 109.164 178.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -55.15 -36.46 65.84 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.576 -176.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 910' ' ' GLU . . . . . 0.573 ' HG2' ' N ' ' A' ' 911' ' ' LYS . 8.0 pm0 -68.43 -40.48 81.16 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.661 -179.684 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 911' ' ' LYS . . . . . 0.573 ' N ' ' HG2' ' A' ' 910' ' ' GLU . 7.2 tttt -71.07 -35.11 71.76 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.127 -178.884 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 912' ' ' GLN . . . . . 0.564 ' O ' ' HG3' ' A' ' 916' ' ' GLU . 5.0 tp60 -60.03 -48.05 83.32 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.765 175.191 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 913' ' ' ARG . . . . . 0.562 ' HA ' ' OE2' ' A' ' 916' ' ' GLU . 0.0 OUTLIER -59.75 -34.78 73.4 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.123 179.017 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 66.3 m -70.71 -33.91 71.36 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.906 0.384 . . . . 0.0 110.607 177.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.71 -52.87 15.57 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.559 -178.968 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 916' ' ' GLU . . . . . 0.564 ' HG3' ' O ' ' A' ' 912' ' ' GLN . 1.2 pp20? -78.17 -46.73 19.77 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.215 -176.135 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 1.4 m 51.16 43.94 28.94 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.727 -175.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -122.86 -32.55 0.92 Allowed Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.024 179.238 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 919' ' ' MET . . . . . 0.7 ' O ' ' HB2' ' A' ' 920' ' ' ASP . 75.0 mtm -72.58 -91.01 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 176.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 920' ' ' ASP . . . . . 0.7 ' HB2' ' O ' ' A' ' 919' ' ' MET . 14.8 t0 149.31 -49.09 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.923 1.289 . . . . 0.0 110.43 172.682 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -113.62 148.8 35.59 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.832 0.349 . . . . 0.0 110.69 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 922' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -117.26 141.96 47.65 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.056 178.842 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 923' ' ' LEU . . . . . 0.92 ' HB3' ' HB ' ' A' ' 902' ' ' VAL . 0.3 OUTLIER -148.4 167.68 24.62 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.843 0.354 . . . . 0.0 110.553 -179.401 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 924' ' ' SER . . . . . 0.484 ' HA ' ' O ' ' A' ' 903' ' ' THR . 3.9 m -115.88 150.0 37.76 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.997 175.498 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 925' ' ' LYS . . . . . 0.506 ' N ' ' HD2' ' A' ' 926' ' ' PRO . 1.4 tttp -51.62 -43.72 88.23 Favored Pre-proline 0 CA--C 1.54 0.595 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 926' ' ' PRO . . . . . 0.506 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 42.7 Cg_endo -69.01 63.24 1.36 Allowed 'Trans proline' 0 C--N 1.357 1.003 0 C-N-CA 121.987 1.792 . . . . 0.0 113.073 174.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 3.4 p -92.97 147.19 5.56 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.807 175.482 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -103.56 167.54 9.73 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.011 -177.593 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 929' ' ' LEU . . . . . 0.889 HD21 ' HG2' ' A' ' 843' ' ' GLN . 1.6 tm? -63.84 -35.8 81.81 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.152 179.04 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.28 -47.44 79.53 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.256 0.551 . . . . 0.0 110.359 -179.198 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 82.3 t -67.49 -44.94 86.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.924 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 932' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -62.43 -36.18 73.49 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-O 120.569 0.223 . . . . 0.0 110.426 -179.702 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 1.6 ttmt -68.28 -47.87 66.51 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.409 179.227 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.91 -43.02 95.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.907 179.425 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 17.8 m -65.45 -50.08 66.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.214 -178.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 936' ' ' LEU . . . . . 0.644 HD23 ' HG ' ' A' ' 844' ' ' LEU . 0.3 OUTLIER -63.33 -44.38 95.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.943 -178.45 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 36.2 m -62.94 -43.33 99.09 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.814 0.34 . . . . 0.0 111.48 -179.198 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 938' ' ' LEU . . . . . 0.451 HD21 ' HA ' ' A' ' 938' ' ' LEU . 0.3 OUTLIER -67.29 -49.36 64.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.954 -179.662 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 939' ' ' TYR . . . . . 0.602 ' HD2' HD13 ' A' ' 871' ' ' ILE . 11.6 m-85 -66.21 -34.65 78.5 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.213 -177.192 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -63.13 -45.57 91.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.794 0.33 . . . . 0.0 111.063 178.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 941' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.81 -34.11 76.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.121 179.266 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 942' ' ' ARG . . . . . 0.58 ' HG3' ' N ' ' A' ' 943' ' ' VAL . 0.0 OUTLIER -63.96 -47.56 79.94 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.967 -178.668 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 943' ' ' VAL . . . . . 0.58 ' N ' ' HG3' ' A' ' 942' ' ' ARG . 15.9 m -73.08 -29.9 30.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.551 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.49 -40.48 95.75 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.011 178.821 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 945' ' ' LYS . . . . . 0.419 ' HG2' ' O ' ' A' ' 942' ' ' ARG . 0.4 OUTLIER -79.63 -20.76 46.0 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 121.098 -0.241 . . . . 0.0 111.473 -179.161 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 16.1 m -72.93 -30.4 63.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.561 0.696 . . . . 0.0 109.797 171.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -82.55 -17.6 44.36 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.08 174.265 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 10.1 t70 . . . . . 0 C--O 1.232 0.146 0 CA-C-N 114.858 -1.065 . . . . 0.0 110.771 -178.609 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 705' ' ' SER . . . . . 0.497 ' HA ' ' O ' ' A' ' 730' ' ' GLY . 0.0 OUTLIER . . . . . 0 N--CA 1.452 -0.357 0 CA-C-O 120.739 0.304 . . . . 0.0 111.033 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 93.42 -19.79 50.42 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.527 179.411 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 707' ' ' LYS . . . . . 0.669 ' NZ ' ' HA ' ' A' ' 745' ' ' ASP . 7.8 tmtm? -84.61 147.98 26.7 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 -179.89 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 708' ' ' ARG . . . . . 0.452 ' HD2' ' CZ2' ' A' ' 710' ' ' TRP . 6.4 mtm-85 -113.22 162.68 15.72 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.612 0.72 . . . . 0.0 111.678 -177.171 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 709' ' ' CYS . . . . . 0.41 ' O ' HD23 ' A' ' 711' ' ' LEU . 1.2 m -132.88 117.89 18.26 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 114.6 -1.182 . . . . 0.0 108.847 168.11 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 710' ' ' TRP . . . . . 0.452 ' CZ2' ' HD2' ' A' ' 708' ' ' ARG . 91.0 m95 -94.04 107.16 19.1 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 711' ' ' LEU . . . . . 0.82 HD21 HG13 ' A' ' 733' ' ' VAL . 0.1 OUTLIER -110.12 128.46 55.46 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.127 0.489 . . . . 0.0 111.124 -176.845 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -119.45 44.19 2.43 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.21 175.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 713' ' ' VAL . . . . . 0.905 ' HA ' ' HB2' ' A' ' 750' ' ' ASP . 43.6 t -99.42 123.52 52.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.431 -178.387 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 714' ' ' ARG . . . . . 0.727 HH12 ' HG3' ' A' ' 751' ' ' GLU . 0.0 OUTLIER -78.46 -35.98 45.94 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 177.836 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 13.7 m-80 -59.92 109.95 1.06 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.382 -0.827 . . . . 0.0 110.715 -176.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -58.91 -43.67 91.09 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.491 -176.343 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.28 -42.81 96.21 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.229 0.538 . . . . 0.0 110.73 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 718' ' ' LEU . . . . . 0.513 HD23 HD13 ' A' ' 722' ' ' LEU . 0.2 OUTLIER -72.05 -49.71 34.42 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.121 -177.858 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 719' ' ' CYS . . . . . 0.8 ' SG ' ' HB ' ' A' ' 713' ' ' VAL . 0.1 OUTLIER -62.67 -50.35 71.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.089 -178.251 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -59.09 -44.15 91.89 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.668 -177.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -61.39 -52.13 65.88 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.799 0.333 . . . . 0.0 110.993 -178.158 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 722' ' ' LEU . . . . . 0.513 HD13 HD23 ' A' ' 718' ' ' LEU . 14.7 mt -62.73 -45.1 94.27 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.653 -178.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 723' ' ' GLU . . . . . 0.461 ' HA ' HG23 ' A' ' 733' ' ' VAL . 0.8 OUTLIER -59.08 -46.47 88.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.865 -179.045 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 724' ' ' THR . . . . . . . . . . . . . 57.6 m -61.63 -41.73 97.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.892 0.377 . . . . 0.0 111.043 -178.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 14.1 m -67.22 -39.49 86.25 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.067 -0.515 . . . . 0.0 112.167 -175.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 726' ' ' LEU . . . . . 0.405 ' CD2' HD11 ' A' ' 731' ' ' ILE . 0.2 OUTLIER -82.31 -33.68 28.91 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.916 -0.313 . . . . 0.0 111.326 -178.881 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 727' ' ' GLN . . . . . 0.409 HE21 ' HB3' ' A' ' 727' ' ' GLN . 0.8 OUTLIER -72.95 -13.24 61.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.02 0.438 . . . . 0.0 110.413 177.28 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.84 -19.3 63.97 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.618 176.487 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 729' ' ' SER . . . . . 0.507 ' HB2' ' H ' ' A' ' 730' ' ' GLY . 0.0 OUTLIER -98.11 -96.26 0.22 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.339 177.748 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 730' ' ' GLY . . . . . 0.507 ' H ' ' HB2' ' A' ' 729' ' ' SER . . . -159.1 21.64 0.29 Allowed Glycine 0 N--CA 1.45 -0.416 0 N-CA-C 111.016 -0.834 . . . . 0.0 111.016 178.264 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 731' ' ' ILE . . . . . 0.523 HD12 ' HD2' ' A' ' 707' ' ' LYS . 2.5 mt -89.76 132.25 34.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 -177.283 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 732' ' ' VAL . . . . . 0.549 HG13 ' O ' ' A' ' 707' ' ' LYS . 1.5 p -87.13 108.59 18.27 Favored 'Isoleucine or valine' 0 C--O 1.238 0.488 0 CA-C-O 121.826 0.822 . . . . 0.0 111.335 -176.784 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 733' ' ' VAL . . . . . 0.82 HG13 HD21 ' A' ' 711' ' ' LEU . 2.2 t -75.41 117.33 19.59 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.0 -1.0 . . . . 0.0 109.85 176.661 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.01 126.28 41.03 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.637 -179.085 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -56.89 130.63 46.69 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.802 177.551 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -72.42 77.86 1.03 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.394 0.616 . . . . 0.0 110.443 178.192 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.41 -13.1 61.74 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.639 177.375 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 109.1 39.5 1.67 Allowed Glycine 0 N--CA 1.447 -0.574 0 N-CA-C 111.06 -0.816 . . . . 0.0 111.06 -174.531 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -85.81 -167.15 1.75 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.47 -0.365 . . . . 0.0 110.784 -177.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -67.78 122.0 81.78 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.341 -177.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 741' ' ' PRO . . . . . 0.439 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 29.4 Cg_endo -65.22 122.9 10.77 Favored 'Trans proline' 0 N--CA 1.463 -0.315 0 C-N-CA 122.371 2.047 . . . . 0.0 111.183 176.765 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 742' ' ' THR . . . . . 0.735 ' HB ' ' HB2' ' A' ' 745' ' ' ASP . 0.1 OUTLIER -104.99 124.88 35.21 Favored Pre-proline 0 C--N 1.322 -0.606 0 CA-C-O 120.948 0.404 . . . . 0.0 111.363 -174.391 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 743' ' ' PRO . . . . . 0.831 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 34.7 Cg_endo -65.47 -12.93 37.25 Favored 'Trans proline' 0 N--CA 1.473 0.267 0 C-N-CA 123.497 2.798 . . . . 0.0 113.693 -175.681 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -108.18 -0.66 20.85 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.553 0.692 . . . . 0.0 110.583 177.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 745' ' ' ASP . . . . . 0.735 ' HB2' ' HB ' ' A' ' 742' ' ' THR . 28.0 m-20 -111.89 165.87 11.7 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.758 -173.927 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 16.6 m -123.46 147.42 27.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.432 -171.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 747' ' ' LEU . . . . . 0.423 ' C ' HD23 ' A' ' 747' ' ' LEU . 0.2 OUTLIER -107.45 99.9 9.38 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.18 178.231 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 5.7 mt -90.62 106.61 17.59 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 174.403 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 749' ' ' THR . . . . . 0.412 HG22 ' HA ' ' A' ' 764' ' ' THR . 8.9 t -117.89 148.13 42.43 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.361 0.6 . . . . 0.0 111.989 -171.522 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 750' ' ' ASP . . . . . 0.905 ' HB2' ' HA ' ' A' ' 713' ' ' VAL . 54.0 t0 -95.86 109.24 21.61 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.089 -0.959 . . . . 0.0 109.033 177.287 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 751' ' ' GLU . . . . . 0.727 ' HG3' HH12 ' A' ' 714' ' ' ARG . 9.2 mt-10 67.66 -150.76 0.17 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.423 -177.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 752' ' ' VAL . . . . . . . . . . . . . 59.0 t -88.03 116.96 30.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.17 0.509 . . . . 0.0 111.815 -172.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 6.1 p -95.97 156.4 3.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.016 171.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.7 41.5 0.57 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.952 0.406 . . . . 0.0 111.887 -176.537 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.77 -170.44 2.9 Favored 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 179.044 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 756' ' ' LYS . . . . . 0.601 ' O ' ' HB2' ' A' ' 757' ' ' TRP . 0.0 OUTLIER -117.22 -77.28 0.57 Allowed 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 170.138 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 757' ' ' TRP . . . . . 0.601 ' HB2' ' O ' ' A' ' 756' ' ' LYS . 10.7 t-105 152.93 109.21 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.41 0 O-C-N 124.76 1.288 . . . . 0.0 110.359 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.81 75.89 4.24 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 171.017 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 759' ' ' GLY . . . . . 0.831 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -158.1 -143.52 3.68 Favored Glycine 0 N--CA 1.444 -0.798 0 CA-C-N 115.681 -0.69 . . . . 0.0 112.381 -175.806 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 760' ' ' ARG . . . . . 0.434 HH11 ' HD3' ' A' ' 760' ' ' ARG . 0.0 OUTLIER -77.63 -55.72 5.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.767 0.283 . . . . 0.0 111.105 -178.051 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -166.51 149.12 6.78 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.746 -179.08 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 762' ' ' VAL . . . . . 0.433 HG13 ' O ' ' A' ' 779' ' ' GLY . 2.5 p -116.64 131.03 70.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 121.006 0.431 . . . . 0.0 110.572 178.641 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 763' ' ' VAL . . . . . 0.596 HG11 HD21 ' A' ' 791' ' ' LEU . 38.9 t -110.54 111.34 35.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.956 -0.565 . . . . 0.0 109.938 179.315 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 764' ' ' THR . . . . . 0.412 ' HA ' HG22 ' A' ' 749' ' ' THR . 1.5 m -103.47 122.18 44.37 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.21 -176.518 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 765' ' ' PHE . . . . . 0.498 ' CZ ' HD22 ' A' ' 791' ' ' LEU . 36.5 m-85 -92.16 123.98 35.91 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 175.386 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 766' ' ' CYS . . . . . 0.478 ' SG ' ' HB ' ' A' ' 782' ' ' VAL . 1.3 m -96.4 132.89 41.47 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.762 0.315 . . . . 0.0 110.814 -176.158 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.83 -57.01 1.35 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.614 179.481 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 2.7 tpm_? -136.15 -43.36 0.64 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.17 0.509 . . . . 0.0 110.288 177.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 10.5 m170 -89.6 110.51 21.37 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.759 179.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 5.1 mt -116.87 83.26 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-O 121.109 0.48 . . . . 0.0 110.003 178.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -125.71 13.18 7.3 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.302 179.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 772' ' ' ILE . . . . . 0.431 ' HA ' ' HD3' ' A' ' 773' ' ' PRO . 42.6 mm -105.36 132.78 20.58 Favored Pre-proline 0 C--N 1.322 -0.6 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 177.868 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 773' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 772' ' ' ILE . 36.0 Cg_exo -61.7 150.41 85.83 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.771 2.314 . . . . 0.0 112.381 178.016 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . 0.576 ' HG ' ' H ' ' A' ' 776' ' ' LYS . 0.5 OUTLIER -97.45 -162.34 0.95 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.602 179.874 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 775' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -62.4 8.31 0.05 Allowed 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 113.307 0.855 . . . . 0.0 113.307 179.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 776' ' ' LYS . . . . . 0.576 ' H ' ' HG ' ' A' ' 774' ' ' LEU . 7.6 ptmt -65.07 -18.26 65.15 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 165.692 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 777' ' ' ALA . . . . . 0.661 ' HB3' ' HB2' ' A' ' 780' ' ' GLU . . . -105.83 161.17 23.63 Favored Pre-proline 0 N--CA 1.451 -0.415 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.79 176.099 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 778' ' ' PRO . . . . . 0.474 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 57.2 Cg_endo -69.77 -9.6 26.5 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.781 2.321 . . . . 0.0 114.47 -172.305 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 779' ' ' GLY . . . . . 0.433 ' O ' HG13 ' A' ' 762' ' ' VAL . . . -156.35 23.54 0.51 Allowed Glycine 0 CA--C 1.505 -0.551 0 C-N-CA 119.838 -1.173 . . . . 0.0 112.603 -175.393 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 780' ' ' GLU . . . . . 0.661 ' HB2' ' HB3' ' A' ' 777' ' ' ALA . 0.4 OUTLIER -114.88 129.2 56.66 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 -178.601 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 18.6 m95 -129.62 139.13 51.51 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 179.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . 0.478 ' HB ' ' SG ' ' A' ' 766' ' ' CYS . 14.7 m -133.45 143.89 37.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 110.17 -0.308 . . . . 0.0 110.17 173.732 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 783' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -166.62 148.03 6.29 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.536 176.319 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -102.57 102.35 12.58 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.38 178.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 785' ' ' VAL . . . . . 0.454 HG23 HD13 ' A' ' 791' ' ' LEU . 0.0 OUTLIER -154.7 162.8 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.587 -0.279 . . . . 0.0 110.252 -179.925 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -100.4 32.23 3.12 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.115 -179.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 787' ' ' ALA . . . . . 0.482 ' HB2' ' HG ' ' A' ' 718' ' ' LEU . . . 56.5 79.15 0.34 Allowed Pre-proline 0 N--CA 1.465 0.291 0 CA-C-N 116.064 -0.516 . . . . 0.0 112.006 178.081 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 788' ' ' PRO . . . . . 0.627 ' HB2' ' OE2' ' A' ' 790' ' ' GLU . 10.2 Cg_endo -88.35 -128.4 0.01 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 122.948 2.432 . . . . 0.0 111.278 175.544 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 789' ' ' HIS . . . . . 0.425 ' H ' ' HB2' ' A' ' 788' ' ' PRO . 14.2 p-80 -114.06 1.09 14.52 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.875 0.369 . . . . 0.0 111.038 -179.18 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 790' ' ' GLU . . . . . 0.627 ' OE2' ' HB2' ' A' ' 788' ' ' PRO . 1.7 pm0 -92.36 -44.51 8.67 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.334 -176.956 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 791' ' ' LEU . . . . . 0.596 HD21 HG11 ' A' ' 763' ' ' VAL . 0.2 OUTLIER -71.18 -42.48 11.91 Favored Pre-proline 0 CA--C 1.535 0.387 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -177.769 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 792' ' ' PRO . . . . . 0.543 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 10.3 Cg_endo -57.83 -29.37 85.82 Favored 'Trans proline' 0 C--N 1.353 0.8 0 C-N-CA 121.261 1.307 . . . . 0.0 111.607 172.048 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -74.34 -34.29 63.37 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.258 175.824 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 794' ' ' LEU . . . . . 0.404 ' HA ' HD22 ' A' ' 794' ' ' LEU . 2.0 tm? -60.31 -43.24 96.5 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.671 174.512 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 795' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.29 -39.77 94.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.566 177.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -63.54 -46.31 86.58 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.788 178.653 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 797' ' ' ARG . . . . . 0.431 ' HG3' ' N ' ' A' ' 798' ' ' ILE . 0.0 OUTLIER -65.51 -34.8 79.12 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.477 -0.328 . . . . 0.0 110.37 179.037 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 798' ' ' ILE . . . . . 0.431 ' N ' ' HG3' ' A' ' 797' ' ' ARG . 0.1 OUTLIER -65.49 -25.92 38.03 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.527 179.878 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.03 -65.36 0.69 Allowed 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.309 -0.405 . . . . 0.0 109.936 175.352 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 800' ' ' LEU . . . . . 0.502 ' HA ' HD22 ' A' ' 800' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.248 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.062 177.444 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 32.6 t70 . . . . . 0 C--O 1.232 0.172 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 1.4 tpp -79.49 90.77 5.09 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 171.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 826' ' ' MET . . . . . 0.427 ' H ' ' HG2' ' A' ' 826' ' ' MET . 0.0 OUTLIER -93.3 105.74 17.78 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.142 -173.938 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 827' ' ' ILE . . . . . . . . . . . . . 6.4 mm -115.12 129.25 71.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.342 178.244 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -94.81 131.9 40.18 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 178.739 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -113.84 95.89 4.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 176.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 830' ' ' VAL . . . . . . . . . . . . . 10.7 t -97.18 88.18 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.147 -179.601 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 831' ' ' ASP . . . . . 0.661 ' OD1' ' HB2' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -104.65 154.61 19.74 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.087 -176.077 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -87.63 -22.82 24.5 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -175.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -130.74 114.17 16.61 Favored Pre-proline 0 N--CA 1.465 0.32 0 O-C-N 121.394 -0.817 . . . . 0.0 111.951 -174.433 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -42.44 -52.93 4.02 Favored 'Trans proline' 0 N--CA 1.479 0.632 0 C-N-CA 124.731 3.621 . . . . 0.0 115.315 -172.134 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 835' ' ' ILE . . . . . 0.413 ' O ' ' HB3' ' A' ' 838' ' ' ARG . 3.6 tp -58.67 -40.02 78.06 Favored 'Isoleucine or valine' 0 C--O 1.24 0.572 0 CA-C-O 121.437 0.637 . . . . 0.0 111.063 -178.149 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 836' ' ' ASN . . . . . 0.468 ' HB3' ' HZ2' ' A' ' 925' ' ' LYS . 3.7 m-20 -70.23 -40.5 74.45 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.608 -179.703 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 837' ' ' ARG . . . . . 0.661 ' HB2' ' OD1' ' A' ' 831' ' ' ASP . 0.0 OUTLIER -54.72 -44.53 73.57 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.55 174.755 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 838' ' ' ARG . . . . . 0.413 ' HB3' ' O ' ' A' ' 835' ' ' ILE . 0.0 OUTLIER -51.54 -46.54 63.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.557 178.766 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.5 -48.06 79.14 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.881 -0.6 . . . . 0.0 112.042 -176.251 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 840' ' ' LEU . . . . . 0.456 HD21 ' NZ ' ' A' ' 925' ' ' LYS . 0.0 OUTLIER -70.87 -37.84 73.08 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 122.037 -0.414 . . . . 0.0 110.928 -178.13 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -66.35 -31.69 72.63 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.241 0.543 . . . . 0.0 110.366 178.343 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -65.39 -42.47 92.6 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.83 175.35 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 843' ' ' GLN . . . . . 0.416 ' HG3' ' HA ' ' A' ' 929' ' ' LEU . 0.0 OUTLIER -64.96 -44.92 87.8 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.33 178.581 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 844' ' ' LEU . . . . . 0.417 ' HA ' HD21 ' A' ' 847' ' ' LEU . 0.0 OUTLIER -60.95 -43.55 98.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.086 178.752 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -64.71 -42.4 97.22 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.913 -0.66 . . . . 0.0 112.282 179.682 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 51.0 m -77.02 -9.58 58.8 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.904 0.383 . . . . 0.0 111.185 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 847' ' ' LEU . . . . . 0.529 HD22 ' HB2' ' A' ' 849' ' ' TYR . 0.0 OUTLIER -87.69 -28.31 21.88 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 175.333 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 106.97 18.32 10.71 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.488 174.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 849' ' ' TYR . . . . . 0.529 ' HB2' HD22 ' A' ' 847' ' ' LEU . 5.5 m-30 -106.38 165.69 11.08 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.94 -0.392 . . . . 0.0 109.94 179.326 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -95.17 117.49 30.32 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.931 0.396 . . . . 0.0 110.343 -178.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -100.59 127.17 47.05 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.276 -176.189 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.64 116.66 32.32 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 172.153 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.71 132.93 35.51 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 -171.883 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 854' ' ' ALA . . . . . . . . . . . . . . . -151.02 147.2 26.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.769 176.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 855' ' ' ASN . . . . . 0.652 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 9.1 t-20 -128.13 73.19 1.45 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.982 176.144 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 856' ' ' ASP . . . . . 0.652 ' HB2' ' O ' ' A' ' 855' ' ' ASN . 2.1 t70 162.18 159.74 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.213 175.865 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -81.66 -30.98 34.32 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.137 178.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 858' ' ' VAL . . . . . 0.435 HG21 ' OD1' ' A' ' 856' ' ' ASP . 3.3 m -73.23 -31.76 35.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.688 0.28 . . . . 0.0 111.074 -178.222 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -67.79 -42.75 81.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.236 0.541 . . . . 0.0 109.973 178.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 860' ' ' ALA . . . . . 0.433 ' O ' ' HB2' ' A' ' 864' ' ' LEU . . . -64.77 -44.69 89.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.641 177.43 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 861' ' ' LEU . . . . . 0.473 HD22 ' HA ' ' A' ' 861' ' ' LEU . 0.1 OUTLIER -61.06 -34.25 74.59 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.717 178.348 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -61.17 -54.57 42.66 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.915 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 14.4 p -71.78 -32.45 44.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.731 0.301 . . . . 0.0 110.824 -177.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 864' ' ' LEU . . . . . 0.433 ' HB2' ' O ' ' A' ' 860' ' ' ALA . 0.2 OUTLIER -63.5 -45.12 92.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.771 178.311 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 15.2 m -71.71 -21.76 61.73 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.801 -179.192 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.28 -69.18 0.37 Allowed 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 173.811 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 867' ' ' ASN . . . . . 0.612 ' O ' ' HB2' ' A' ' 868' ' ' HIS . 2.3 t-20 159.17 127.4 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.609 0 O-C-N 124.274 0.984 . . . . 0.0 110.021 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 868' ' ' HIS . . . . . 0.612 ' HB2' ' O ' ' A' ' 867' ' ' ASN . 14.3 m-70 134.92 171.7 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.005 0 O-C-N 125.202 1.564 . . . . 0.0 110.528 165.667 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 869' ' ' ILE . . . . . 0.584 ' HB ' ' O ' ' A' ' 868' ' ' HIS . 1.5 mp 86.0 129.57 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 O-C-N 124.461 1.1 . . . . 0.0 111.109 174.748 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -112.76 -16.58 12.74 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.435 -178.311 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 871' ' ' ILE . . . . . 0.468 HG22 ' N ' ' A' ' 872' ' ' VAL . 2.1 mt -145.95 137.69 19.69 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 178.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 872' ' ' VAL . . . . . 0.53 ' HB ' HG23 ' A' ' 899' ' ' VAL . 7.2 t -122.39 135.75 61.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.676 0.274 . . . . 0.0 110.962 -177.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 873' ' ' LEU . . . . . 0.448 HD21 ' HB ' ' A' ' 900' ' ' ILE . 10.0 mt -110.88 136.11 50.4 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 173.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -120.66 104.96 10.33 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.26 178.8 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 875' ' ' ASP . . . . . 0.657 ' HB2' ' HA ' ' A' ' 831' ' ' ASP . 0.8 OUTLIER -89.17 105.68 17.94 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.543 -176.825 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 876' ' ' VAL . . . . . 0.401 ' HB ' HG23 ' A' ' 903' ' ' THR . 0.2 OUTLIER -95.95 100.02 10.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.548 -177.145 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 877' ' ' ASN . . . . . 0.624 ' HA ' ' HB1' ' A' ' 904' ' ' ALA . 0.8 OUTLIER -73.11 -43.0 62.33 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.758 176.368 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.577 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.256 174.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.32 0 N-CA-C 112.66 -0.176 . . . . 0.0 112.66 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 23.3 p90 -89.28 -22.4 22.71 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 -178.292 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -61.5 -31.35 71.34 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.752 174.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.92 -53.89 53.14 Favored 'General case' 0 CA--C 1.528 0.127 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.609 179.613 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.49 -36.19 80.62 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.839 -178.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 888' ' ' GLN . . . . . 0.451 ' O ' ' HB2' ' A' ' 892' ' ' GLN . 60.9 mm-40 -61.08 -50.48 73.11 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.004 179.613 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.59 -44.72 95.93 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.485 -177.534 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 890' ' ' ILE . . . . . . . . . . . . . 18.0 mt -69.15 -46.45 77.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.059 -177.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 891' ' ' ARG . . . . . 0.45 ' HD3' ' HA ' ' A' ' 888' ' ' GLN . 2.3 ptm180 -66.96 -23.97 66.01 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.893 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 892' ' ' GLN . . . . . 0.451 ' HB2' ' O ' ' A' ' 888' ' ' GLN . 1.5 tp60 -71.88 -60.34 2.28 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.71 177.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -157.2 48.24 0.43 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.594 -176.349 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 894' ' ' GLY . . . . . 0.44 ' HA3' HD21 ' A' ' 861' ' ' LEU . . . -141.86 0.06 1.57 Allowed Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.35 176.508 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 895' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -108.4 110.74 22.36 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.973 0.416 . . . . 0.0 110.763 -178.312 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -134.54 22.57 3.67 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.563 0.697 . . . . 0.0 109.717 175.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 897' ' ' LEU . . . . . 0.403 ' HB2' ' HD2' ' A' ' 898' ' ' PRO . 0.4 OUTLIER -159.51 164.46 20.44 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.748 -173.666 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 898' ' ' PRO . . . . . 0.403 ' HD2' ' HB2' ' A' ' 897' ' ' LEU . 38.0 Cg_endo -67.07 128.76 19.2 Favored 'Trans proline' 0 C--O 1.241 0.629 0 C-N-CA 122.316 2.011 . . . . 0.0 111.941 176.129 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 899' ' ' VAL . . . . . 0.775 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 69.0 t -115.61 128.31 72.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.143 178.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 900' ' ' ILE . . . . . 0.454 ' HA ' ' O ' ' A' ' 921' ' ' SER . 3.0 mt -108.52 121.91 62.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.008 179.263 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -96.32 126.95 9.0 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 120.686 -0.768 . . . . 0.0 111.907 -178.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 902' ' ' VAL . . . . . 0.506 HG11 ' HA ' ' A' ' 925' ' ' LYS . 1.1 t -104.59 97.56 5.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 177.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 903' ' ' THR . . . . . 0.64 ' HB ' ' HB1' ' A' ' 906' ' ' ALA . 0.0 OUTLIER -90.27 135.95 33.35 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.959 -172.895 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 904' ' ' ALA . . . . . 0.624 ' HB1' ' HA ' ' A' ' 877' ' ' ASN . . . -96.31 115.06 26.83 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.705 178.565 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 60.8 45.62 9.72 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 121.207 0.527 . . . . 0.0 111.238 177.267 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 906' ' ' ALA . . . . . 0.64 ' HB1' ' HB ' ' A' ' 903' ' ' THR . . . -98.27 98.86 10.07 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.046 177.41 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 11.1 tp -45.26 -45.15 11.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.521 176.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -126.39 78.96 1.82 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.019 0.438 . . . . 0.0 110.582 177.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.31 -41.37 98.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.527 -178.868 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 910' ' ' GLU . . . . . 0.511 ' H ' ' HG2' ' A' ' 910' ' ' GLU . 0.1 OUTLIER -64.02 -31.02 72.05 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.091 -179.753 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 12.6 tttt -68.87 -41.64 78.08 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.259 179.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 69.9 tp60 -63.13 -36.24 82.96 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.134 177.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 913' ' ' ARG . . . . . 0.562 ' HB2' ' SG ' ' A' ' 922' ' ' CYS . 3.7 ttp180 -58.66 -46.96 86.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.944 177.814 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 7.4 m -74.94 -26.1 59.36 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.549 -176.171 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 1.2 tp -70.02 -51.74 29.81 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.954 0.407 . . . . 0.0 111.099 179.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -78.52 -42.53 29.24 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.506 -178.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 2.3 m 51.15 47.8 24.2 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.088 0.47 . . . . 0.0 111.573 -176.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -133.06 24.43 3.79 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.013 179.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 919' ' ' MET . . . . . 0.775 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -130.14 -101.45 0.31 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.576 0.226 . . . . 0.0 110.755 -177.198 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 920' ' ' ASP . . . . . 0.405 ' HB2' ' O ' ' A' ' 919' ' ' MET . 10.4 t70 168.2 -64.83 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.993 0.917 . . . . 0.0 108.801 179.83 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 921' ' ' SER . . . . . 0.454 ' O ' ' HA ' ' A' ' 900' ' ' ILE . 70.9 m -139.23 163.11 33.32 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.653 179.018 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 922' ' ' CYS . . . . . 0.562 ' SG ' ' HB2' ' A' ' 913' ' ' ARG . 0.0 OUTLIER -137.6 158.24 44.8 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.03 0.443 . . . . 0.0 111.496 -177.506 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 923' ' ' LEU . . . . . 0.604 HD21 HG23 ' A' ' 935' ' ' THR . 0.0 OUTLIER -146.8 168.35 21.62 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.232 175.218 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 1.4 m -78.37 142.71 37.46 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.064 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 925' ' ' LYS . . . . . 0.506 ' HA ' HG11 ' A' ' 902' ' ' VAL . 0.0 OUTLIER -54.35 -39.95 78.8 Favored Pre-proline 0 CA--C 1.538 0.502 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 179.433 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -62.11 74.03 0.1 OUTLIER 'Trans proline' 0 C--N 1.36 1.162 0 C-N-CA 122.077 1.852 . . . . 0.0 112.194 171.184 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 927' ' ' VAL . . . . . 0.494 HG11 ' HB ' ' A' ' 932' ' ' ILE . 0.5 OUTLIER -98.47 140.17 18.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.968 -176.638 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.07 163.41 12.44 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.554 177.357 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 929' ' ' LEU . . . . . 0.483 HD21 ' HA ' ' A' ' 929' ' ' LEU . 0.0 OUTLIER -56.43 -46.41 80.29 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.355 -177.271 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -67.57 -34.38 76.93 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.028 0.442 . . . . 0.0 110.799 -177.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 62.4 t -69.61 -48.77 63.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.448 -178.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 932' ' ' ILE . . . . . 0.494 ' HB ' HG11 ' A' ' 927' ' ' VAL . 2.0 tp -67.28 -37.36 78.93 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 CA-C-O 120.64 0.257 . . . . 0.0 110.589 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 933' ' ' LYS . . . . . 0.464 ' N ' HG21 ' A' ' 932' ' ' ILE . 0.8 OUTLIER -61.77 -47.64 84.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.169 176.87 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 934' ' ' GLN . . . . . 0.581 ' O ' ' HB2' ' A' ' 938' ' ' LEU . 1.9 tp60 -60.52 -51.08 70.95 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.743 -179.175 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 935' ' ' THR . . . . . 0.604 HG23 HD21 ' A' ' 923' ' ' LEU . 8.6 m -61.87 -47.63 84.16 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.529 -177.874 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 936' ' ' LEU . . . . . 0.497 HD11 ' HA ' ' A' ' 936' ' ' LEU . 0.9 OUTLIER -67.73 -47.84 68.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.385 -176.014 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 67.9 m -67.87 -39.46 83.71 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 111.708 0.262 . . . . 0.0 111.708 -178.181 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 938' ' ' LEU . . . . . 0.581 ' HB2' ' O ' ' A' ' 934' ' ' GLN . 0.2 OUTLIER -62.35 -44.31 96.78 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.987 0.422 . . . . 0.0 110.45 179.101 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -72.79 -30.65 64.26 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.929 -179.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -64.2 -35.82 82.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.857 0.361 . . . . 0.0 110.612 176.2 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 941' ' ' GLU . . . . . 0.414 ' HG3' ' N ' ' A' ' 942' ' ' ARG . 0.0 OUTLIER -78.9 -31.85 45.5 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.474 178.256 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 942' ' ' ARG . . . . . 0.624 ' HG3' ' N ' ' A' ' 943' ' ' VAL . 0.0 OUTLIER -65.59 -46.88 77.69 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 178.133 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 943' ' ' VAL . . . . . 0.624 ' N ' ' HG3' ' A' ' 942' ' ' ARG . 30.7 m -69.65 -28.25 36.76 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.265 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.08 179.503 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.7 -44.23 85.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.252 174.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 5.1 mttt -64.44 -45.06 89.12 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.315 -179.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.75 -35.64 77.35 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.832 0.349 . . . . 0.0 111.456 -178.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 27.4 mtt-85 -71.76 -50.38 30.52 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.861 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 6.7 t70 . . . . . 0 C--N 1.323 -0.549 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.404 -176.035 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 705' ' ' SER . . . . . 0.45 ' HA ' ' O ' ' A' ' 730' ' ' GLY . 0.7 OUTLIER . . . . . 0 N--CA 1.456 -0.143 0 CA-C-O 121.148 0.499 . . . . 0.0 111.825 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . -170.66 25.63 0.1 OUTLIER Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 121.042 -0.599 . . . . 0.0 112.038 176.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 707' ' ' LYS . . . . . 0.522 ' HE3' ' HB3' ' A' ' 744' ' ' GLU . 26.1 mmtm -133.7 137.56 45.35 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 178.014 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 708' ' ' ARG . . . . . 0.73 ' HG2' HG22 ' A' ' 732' ' ' VAL . 6.5 mtp85 -92.11 136.24 33.34 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 121.369 0.604 . . . . 0.0 111.218 -173.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 1.7 t -104.31 109.97 22.02 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 171.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 710' ' ' TRP . . . . . 0.404 ' CZ2' ' HD3' ' A' ' 708' ' ' ARG . 89.2 m95 -90.13 96.23 10.57 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.815 0.817 . . . . 0.0 109.156 -178.526 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 711' ' ' LEU . . . . . . . . . . . . . 1.3 tp -95.64 104.65 16.58 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 114.611 -1.177 . . . . 0.0 111.305 -169.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -103.51 30.92 4.66 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.786 0.803 . . . . 0.0 109.345 174.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 713' ' ' VAL . . . . . 0.524 ' HA ' ' HB3' ' A' ' 750' ' ' ASP . 49.1 t -92.98 115.43 31.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 114.954 -1.021 . . . . 0.0 109.833 178.244 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 32.2 mtp85 -110.1 17.92 20.53 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.678 0.752 . . . . 0.0 110.069 -179.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 715' ' ' ASN . . . . . 0.437 ' H ' HG13 ' A' ' 713' ' ' VAL . 18.8 t-20 -92.05 109.78 21.14 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.026 -0.988 . . . . 0.0 108.845 173.054 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -45.41 -53.49 8.63 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 -172.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.42 -48.59 81.1 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.1 0.476 . . . . 0.0 110.747 -178.56 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 718' ' ' LEU . . . . . 0.792 ' HG ' ' HB3' ' A' ' 787' ' ' ALA . 0.2 OUTLIER -68.76 -48.35 63.94 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.684 -176.292 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 719' ' ' CYS . . . . . 0.455 ' O ' ' HB3' ' A' ' 723' ' ' GLU . 16.3 p -67.29 -46.66 72.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.06 -174.825 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -62.48 -34.56 77.09 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.647 -0.252 . . . . 0.0 110.967 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 721' ' ' PHE . . . . . 0.409 ' HE2' ' HG3' ' A' ' 792' ' ' PRO . 93.7 t80 -65.64 -56.34 12.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.871 0.367 . . . . 0.0 110.366 178.984 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 91.9 mt -61.53 -45.73 92.92 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.237 -177.35 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 723' ' ' GLU . . . . . 0.577 ' HG3' ' N ' ' A' ' 724' ' ' THR . 0.0 OUTLIER -59.78 -42.2 92.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.115 -175.891 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 724' ' ' THR . . . . . 0.577 ' N ' ' HG3' ' A' ' 723' ' ' GLU . 8.6 m -77.43 -41.41 39.95 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.657 0.265 . . . . 0.0 111.499 -177.877 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 25.9 m -65.0 -36.62 85.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.835 0.35 . . . . 0.0 111.297 -178.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 726' ' ' LEU . . . . . 0.494 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 50.9 mt -79.31 -42.72 25.1 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.562 -176.654 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 727' ' ' GLN . . . . . 0.427 ' HG3' ' O ' ' A' ' 724' ' ' THR . 3.5 pp0? -62.69 -19.61 64.05 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 120.676 0.274 . . . . 0.0 111.318 -177.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 8.5 mtp-105 -57.42 -39.87 77.11 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.082 178.401 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -96.31 6.26 49.17 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.056 -177.268 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 730' ' ' GLY . . . . . 0.45 ' O ' ' HA ' ' A' ' 705' ' ' SER . . . 94.26 7.65 60.6 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.556 -0.83 . . . . 0.0 113.09 176.422 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 731' ' ' ILE . . . . . 0.494 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 36.4 mm -67.23 116.4 6.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 176.096 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 732' ' ' VAL . . . . . 0.73 HG22 ' HG2' ' A' ' 708' ' ' ARG . 3.0 m -79.56 90.97 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 121.587 0.708 . . . . 0.0 111.097 -173.488 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 733' ' ' VAL . . . . . 0.519 HG21 ' HA ' ' A' ' 723' ' ' GLU . 21.8 t -72.4 135.71 27.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.097 178.393 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -143.89 127.4 16.94 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.15 -177.42 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.3 114.07 2.25 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.127 178.576 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 43.0 t80 -87.25 100.63 12.83 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.107 0.479 . . . . 0.0 110.601 -178.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -104.62 -11.42 16.94 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.205 177.168 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 139.92 68.56 0.04 OUTLIER Glycine 0 N--CA 1.448 -0.519 0 N-CA-C 111.211 -0.756 . . . . 0.0 111.211 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 739' ' ' GLN . . . . . 0.448 ' HB3' ' H ' ' A' ' 740' ' ' GLU . 14.7 mp0 -110.0 -138.46 0.37 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.885 0.374 . . . . 0.0 111.376 -174.672 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 740' ' ' GLU . . . . . 0.448 ' H ' ' HB3' ' A' ' 739' ' ' GLN . 2.2 tp10 -108.21 133.84 20.39 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.969 -175.032 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 741' ' ' PRO . . . . . 0.624 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 1.1 Cg_endo -83.39 123.54 3.44 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 123.241 2.627 . . . . 0.0 112.324 177.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 742' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.28 132.47 21.07 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.437 176.272 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -66.2 -5.33 12.21 Favored 'Trans proline' 0 N--CA 1.475 0.411 0 C-N-CA 123.151 2.567 . . . . 0.0 113.53 -175.286 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 744' ' ' GLU . . . . . 0.522 ' HB3' ' HE3' ' A' ' 707' ' ' LYS . 5.4 mm-40 -116.38 0.52 12.81 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.837 0.351 . . . . 0.0 110.894 177.622 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 745' ' ' ASP . . . . . 0.436 ' CG ' ' HB2' ' A' ' 708' ' ' ARG . 30.8 m-20 -103.93 165.61 10.93 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.44 -176.328 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 746' ' ' VAL . . . . . 0.478 HG22 HD11 ' A' ' 795' ' ' LEU . 2.6 p -128.35 136.04 61.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.252 0.548 . . . . 0.0 111.603 -174.54 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 747' ' ' LEU . . . . . 0.457 HD13 ' HB2' ' A' ' 757' ' ' TRP . 0.6 OUTLIER -99.72 104.91 16.67 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.866 176.895 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 748' ' ' ILE . . . . . 0.509 HD11 ' HG ' ' A' ' 795' ' ' LEU . 24.9 mt -98.96 109.54 24.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 109.157 -0.682 . . . . 0.0 109.157 174.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 14.7 t -117.43 158.51 24.36 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.205 -174.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 750' ' ' ASP . . . . . 0.524 ' HB3' ' HA ' ' A' ' 713' ' ' VAL . 0.0 OUTLIER -105.33 136.54 44.69 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.69 174.786 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 60.87 -167.45 0.19 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.882 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 752' ' ' VAL . . . . . . . . . . . . . 3.6 t -82.2 91.0 2.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.301 -175.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 4.8 p -78.7 -18.06 13.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.405 175.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 1.4 m 56.25 56.8 5.47 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.358 -179.102 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.6 152.43 50.82 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 176.031 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 756' ' ' LYS . . . . . 0.422 ' HD3' ' HA ' ' A' ' 756' ' ' LYS . 42.4 mmtt -93.93 -43.36 8.59 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.262 -177.912 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 757' ' ' TRP . . . . . 0.624 ' CH2' ' HA ' ' A' ' 741' ' ' PRO . 71.3 t-105 68.75 96.66 0.06 Allowed 'General case' 0 N--CA 1.464 0.265 0 O-C-N 124.019 0.825 . . . . 0.0 111.709 178.506 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -81.04 63.87 5.57 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.293 0.568 . . . . 0.0 110.501 175.622 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 759' ' ' GLY . . . . . . . . . . . . . . . -128.89 -149.77 6.99 Favored Glycine 0 N--CA 1.446 -0.698 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.966 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 2.0 ttt-85 -70.43 -49.36 49.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.782 0.325 . . . . 0.0 110.157 177.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -166.2 153.07 9.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.526 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 762' ' ' VAL . . . . . 0.431 ' HB ' ' HB3' ' A' ' 757' ' ' TRP . 7.7 p -119.03 132.1 69.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 176.626 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 763' ' ' VAL . . . . . 0.635 HG12 HD23 ' A' ' 791' ' ' LEU . 1.4 t -123.02 125.15 71.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 120.832 0.349 . . . . 0.0 110.649 -177.925 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 764' ' ' THR . . . . . 0.902 ' HB ' HG12 ' A' ' 782' ' ' VAL . 86.3 m -111.68 124.33 52.1 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.346 -179.282 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 765' ' ' PHE . . . . . 0.57 ' CD2' HD22 ' A' ' 718' ' ' LEU . 0.7 OUTLIER -95.41 110.32 22.37 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 172.672 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.25 133.1 38.13 Favored 'General case' 0 C--N 1.317 -0.837 0 C-N-CA 120.527 -0.469 . . . . 0.0 109.946 -178.266 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.7 -38.5 3.7 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.296 -179.407 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.67 -35.94 1.44 Allowed 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.288 -179.324 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 58.3 m80 -120.88 140.74 51.38 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.153 0.501 . . . . 0.0 111.212 -175.11 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 3.3 mt -123.97 103.25 12.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.484 179.12 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -121.41 -19.65 3.44 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.18 178.099 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 772' ' ' ILE . . . . . 0.428 ' HA ' ' HD3' ' A' ' 773' ' ' PRO . 18.8 mm -94.56 132.69 28.24 Favored Pre-proline 0 C--N 1.326 -0.416 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 773' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 772' ' ' ILE . 3.9 Cg_exo -80.31 164.86 21.5 Favored 'Trans proline' 0 N--CA 1.459 -0.552 0 C-N-CA 122.967 2.445 . . . . 0.0 112.45 179.848 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -91.95 -157.47 0.52 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.337 179.074 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 775' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -64.76 61.13 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 178.609 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.71 -12.4 17.69 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 169.026 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -136.32 150.1 69.77 Favored Pre-proline 0 N--CA 1.447 -0.585 0 CA-C-N 114.139 -1.391 . . . . 0.0 108.617 176.507 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -61.94 102.65 0.26 Allowed 'Trans proline' 0 C--O 1.233 0.254 0 C-N-CA 122.706 2.271 . . . . 0.0 113.174 -177.034 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 115.34 -4.58 21.74 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.481 -0.866 . . . . 0.0 113.548 174.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 780' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.33 122.74 39.53 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 117.217 0.508 . . . . 0.0 109.999 -179.197 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 781' ' ' TRP . . . . . 0.645 ' HZ3' HD11 ' A' ' 794' ' ' LEU . 13.0 m95 -133.78 134.9 43.47 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 -179.178 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . 0.902 HG12 ' HB ' ' A' ' 764' ' ' THR . 26.6 m -140.77 152.11 20.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 121.129 0.49 . . . . 0.0 110.735 174.557 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 783' ' ' HIS . . . . . . . . . . . . . 3.1 t-160 -155.67 119.84 4.57 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.276 174.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -89.49 100.14 13.0 Favored 'General case' 0 C--N 1.317 -0.833 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.689 -179.701 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 785' ' ' VAL . . . . . 0.547 HG21 ' HE1' ' A' ' 765' ' ' PHE . 0.0 OUTLIER -167.58 -172.46 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.527 179.365 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 786' ' ' ALA . . . . . 0.41 ' HA ' HD11 ' A' ' 718' ' ' LEU . . . -114.53 55.24 0.75 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.484 0.183 . . . . 0.0 111.468 -178.042 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 787' ' ' ALA . . . . . 0.792 ' HB3' ' HG ' ' A' ' 718' ' ' LEU . . . 51.52 61.99 11.81 Favored Pre-proline 0 N--CA 1.469 0.491 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.442 177.384 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 788' ' ' PRO . . . . . 0.428 ' HD3' ' N ' ' A' ' 787' ' ' ALA . 1.1 Cg_endo -84.0 46.24 1.96 Allowed 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 123.088 2.525 . . . . 0.0 112.837 -176.745 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 70.07 -15.73 0.32 Allowed 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 113.305 0.854 . . . . 0.0 113.305 174.167 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 790' ' ' GLU . . . . . 0.54 ' H ' ' HG3' ' A' ' 790' ' ' GLU . 0.0 OUTLIER -73.72 -51.76 15.49 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -175.39 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 791' ' ' LEU . . . . . 0.635 HD23 HG12 ' A' ' 763' ' ' VAL . 0.3 OUTLIER -58.91 -50.54 87.46 Favored Pre-proline 0 CA--C 1.534 0.354 0 N-CA-C 112.427 0.528 . . . . 0.0 112.427 -176.959 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 792' ' ' PRO . . . . . 0.507 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 10.8 Cg_endo -55.8 -33.45 88.19 Favored 'Trans proline' 0 C--N 1.357 0.987 0 C-N-CA 121.971 1.781 . . . . 0.0 112.258 177.283 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -66.4 -50.39 63.6 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 120.938 0.399 . . . . 0.0 110.723 178.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 794' ' ' LEU . . . . . 0.645 HD11 ' HZ3' ' A' ' 781' ' ' TRP . 1.0 OUTLIER -64.41 -33.8 76.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.926 179.683 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 795' ' ' LEU . . . . . 0.509 ' HG ' HD11 ' A' ' 748' ' ' ILE . 0.7 OUTLIER -67.25 -43.8 81.01 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.995 -179.092 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -60.25 -37.14 79.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.074 0.464 . . . . 0.0 110.621 178.25 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 797' ' ' ARG . . . . . 0.444 ' O ' ' HG ' ' A' ' 800' ' ' LEU . 0.0 OUTLIER -71.91 -48.78 43.12 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.225 179.124 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 798' ' ' ILE . . . . . 0.45 HG22 ' O ' ' A' ' 795' ' ' LEU . 0.6 OUTLIER -62.86 -18.02 20.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -176.979 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -63.22 -39.37 94.43 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 175.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 800' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 797' ' ' ARG . 6.1 mt . . . . . 0 N--CA 1.467 0.392 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.232 177.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 15.1 t70 . . . . . 0 N--CA 1.466 0.34 0 CA-C-O 120.883 0.373 . . . . 0.0 111.491 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 4.0 ttm -137.7 135.4 36.41 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 -178.176 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 826' ' ' MET . . . . . 0.56 ' HA ' ' HB2' ' A' ' 850' ' ' GLN . 21.2 ptp -108.43 129.09 55.27 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.663 0.744 . . . . 0.0 111.613 -177.122 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 827' ' ' ILE . . . . . 0.592 HG21 HD21 ' A' ' 873' ' ' LEU . 10.0 mm -109.82 144.17 18.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-N 114.864 -1.062 . . . . 0.0 108.836 175.405 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 828' ' ' LEU . . . . . 0.645 HD13 HG11 ' A' ' 863' ' ' VAL . 16.1 tp -103.23 122.24 44.35 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.664 0.268 . . . . 0.0 110.282 -177.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 829' ' ' VAL . . . . . 0.495 ' HA ' ' HG ' ' A' ' 873' ' ' LEU . 1.2 p -114.73 104.33 16.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.372 0.606 . . . . 0.0 110.1 -179.222 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 830' ' ' VAL . . . . . 0.546 HG22 ' HB1' ' A' ' 854' ' ' ALA . 60.6 t -119.09 119.87 62.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.172 -179.703 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 831' ' ' ASP . . . . . 1.033 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 0.9 OUTLIER -130.06 153.8 48.09 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 176.86 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 832' ' ' ASP . . . . . 0.517 ' HB3' HG12 ' A' ' 876' ' ' VAL . 0.0 OUTLIER -79.75 -13.96 59.07 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -172.365 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 7.8 m80 -131.68 95.83 22.24 Favored Pre-proline 0 C--N 1.327 -0.371 0 O-C-N 121.798 -0.564 . . . . 0.0 111.451 -178.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_exo -27.03 -46.52 0.08 OUTLIER 'Trans proline' 0 C--N 1.353 0.811 1 C-N-CA 125.835 4.357 . . . . 0.0 116.618 -171.756 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 1.2 pp -57.18 -44.0 82.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -176.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 836' ' ' ASN . . . . . 0.499 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 1.5 t30 -73.09 -46.75 49.57 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -178.322 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 837' ' ' ARG . . . . . 1.033 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 0.4 OUTLIER -51.9 -39.85 59.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.862 178.451 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.51 -47.08 80.22 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.489 177.751 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.62 -42.48 95.47 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.106 -0.497 . . . . 0.0 112.011 -173.831 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 840' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' ' 836' ' ' ASN . 0.0 OUTLIER -70.88 -26.79 63.39 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.211 177.14 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -66.81 -33.57 75.91 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.156 0.503 . . . . 0.0 109.818 175.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -64.49 -41.72 96.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.974 174.415 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 843' ' ' GLN . . . . . 0.418 ' HG2' HG22 ' A' ' 932' ' ' ILE . 0.3 OUTLIER -62.01 -41.61 98.26 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.491 176.069 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 844' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.66 -33.19 73.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.595 176.067 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -65.39 -34.19 88.64 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.94 -0.648 . . . . 0.0 111.707 175.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 9.3 m -68.91 -28.23 66.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.91 0.386 . . . . 0.0 110.606 176.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.65 -22.45 63.45 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.27 176.013 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 84.84 24.06 47.03 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 121.088 -0.577 . . . . 0.0 113.446 173.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -114.77 -177.93 3.25 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.718 0.294 . . . . 0.0 110.454 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 850' ' ' GLN . . . . . 0.56 ' HB2' ' HA ' ' A' ' 826' ' ' MET . 4.2 mm100 -85.76 141.38 29.74 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 177.011 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -132.09 116.59 17.23 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 120.797 0.332 . . . . 0.0 110.892 -177.682 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -93.74 109.6 21.26 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 176.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 853' ' ' THR . . . . . 0.461 HG21 HG11 ' A' ' 829' ' ' VAL . 0.0 OUTLIER -91.8 116.6 29.03 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.689 -174.065 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 854' ' ' ALA . . . . . 0.546 ' HB1' HG22 ' A' ' 830' ' ' VAL . . . -136.18 161.09 36.71 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.752 178.691 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -142.04 73.95 1.43 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.975 177.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 856' ' ' ASP . . . . . 0.763 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 31.7 t70 176.55 150.17 0.14 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.784 -178.474 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -77.4 -42.69 17.72 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.514 -178.103 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 858' ' ' VAL . . . . . 0.449 ' H ' HG23 ' A' ' 858' ' ' VAL . 0.5 OUTLIER -71.71 -34.67 52.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.739 0.304 . . . . 0.0 110.348 -178.698 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 859' ' ' ASP . . . . . 0.763 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 0.1 OUTLIER -57.03 -38.85 73.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.642 177.306 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -66.57 -40.79 89.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.833 179.228 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 861' ' ' LEU . . . . . 0.475 HD21 ' HA ' ' A' ' 861' ' ' LEU . 0.2 OUTLIER -66.33 -33.25 75.3 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.095 0.474 . . . . 0.0 110.439 178.358 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -67.42 -42.55 83.03 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.884 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 863' ' ' VAL . . . . . 0.645 HG11 HD13 ' A' ' 828' ' ' LEU . 1.6 p -70.72 -32.02 47.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.715 0.293 . . . . 0.0 110.462 178.334 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 864' ' ' LEU . . . . . 0.443 HD22 ' HA ' ' A' ' 864' ' ' LEU . 1.2 tm? -61.53 -39.68 91.93 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 121.15 0.5 . . . . 0.0 109.954 174.746 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 6.0 m -78.0 -16.97 57.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.935 178.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 2.8 tttp -76.26 -60.63 2.25 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.423 178.178 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -121.69 -90.17 0.58 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.147 177.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 23.7 p80 -179.1 -39.56 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 122.168 0.187 . . . . 0.0 110.869 176.291 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 869' ' ' ILE . . . . . 0.609 HG12 ' HB2' ' A' ' 828' ' ' LEU . 0.3 OUTLIER 69.38 149.58 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 O-C-N 123.392 0.432 . . . . 0.0 110.273 -175.6 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -92.41 -39.89 11.18 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.518 -0.473 . . . . 0.0 111.414 -177.073 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 871' ' ' ILE . . . . . 0.461 ' HB ' HD11 ' A' ' 827' ' ' ILE . 1.4 mt -138.64 133.9 42.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 177.901 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 872' ' ' VAL . . . . . . . . . . . . . 72.4 t -107.89 112.29 39.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.661 -179.363 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 873' ' ' LEU . . . . . 0.592 HD21 HG21 ' A' ' 827' ' ' ILE . 1.4 pp -108.72 127.92 54.41 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.115 0.484 . . . . 0.0 110.028 176.315 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -123.26 114.69 20.58 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.668 -177.707 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 875' ' ' ASP . . . . . 0.806 ' HB3' ' HB2' ' A' ' 831' ' ' ASP . 34.0 t0 -102.5 136.32 42.54 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 178.468 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 876' ' ' VAL . . . . . 0.638 HG21 HG22 ' A' ' 903' ' ' THR . 0.0 OUTLIER -141.09 129.19 22.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-O 121.296 0.569 . . . . 0.0 111.402 -177.053 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -80.21 -39.06 29.88 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 171.09 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.536 0 CA-C-N 114.519 -1.219 . . . . 0.0 109.001 175.21 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.341 0 CA-C-O 120.306 -0.163 . . . . 0.0 113.094 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -123.25 -43.25 2.21 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.101 0.477 . . . . 0.0 110.346 -178.03 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -60.92 -36.4 79.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.809 -177.788 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.26 -42.96 99.23 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.462 -179.552 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.2 -44.34 76.03 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.047 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 888' ' ' GLN . . . . . 0.438 ' OE1' ' HD3' ' A' ' 891' ' ' ARG . 3.3 tp-100 -60.49 -43.04 97.41 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.6 178.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -70.62 -33.08 70.63 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.148 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 890' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -60.81 -48.35 89.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.707 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 891' ' ' ARG . . . . . 0.438 ' HD3' ' OE1' ' A' ' 888' ' ' GLN . 0.0 OUTLIER -74.49 -23.17 58.82 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.814 0.34 . . . . 0.0 110.6 179.606 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 892' ' ' GLN . . . . . 0.427 ' HG3' HH21 ' A' ' 891' ' ' ARG . 5.3 mt-30 -70.92 -43.36 68.41 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.896 178.454 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 893' ' ' LEU . . . . . 0.47 ' HA ' HD22 ' A' ' 893' ' ' LEU . 0.2 OUTLIER -66.06 -55.04 18.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.87 -178.421 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 163.06 60.96 0.02 OUTLIER Glycine 0 N--CA 1.453 -0.208 0 C-N-CA 120.34 -0.933 . . . . 0.0 112.432 -179.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 895' ' ' LEU . . . . . 0.41 ' HB3' ' HA ' ' A' ' 891' ' ' ARG . 0.4 OUTLIER -68.15 111.15 4.33 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.971 0.415 . . . . 0.0 110.894 -179.509 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -128.42 7.84 5.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.442 174.143 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 897' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.31 138.98 32.74 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.032 -177.163 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.32 144.88 46.98 Favored 'Trans proline' 0 C--O 1.238 0.486 0 C-N-CA 122.571 2.181 . . . . 0.0 112.572 -178.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 899' ' ' VAL . . . . . 0.442 ' CG1' ' HA ' ' A' ' 919' ' ' MET . 0.2 OUTLIER -121.07 137.75 53.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 121.534 0.683 . . . . 0.0 110.331 179.443 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 900' ' ' ILE . . . . . 0.727 HG21 ' HB2' ' A' ' 921' ' ' SER . 6.3 mt -108.47 112.11 38.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.03 -179.85 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 901' ' ' GLY . . . . . 0.442 ' O ' ' HA ' ' A' ' 922' ' ' CYS . . . -97.93 110.04 3.94 Favored Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 121.053 -0.594 . . . . 0.0 112.009 -179.027 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 902' ' ' VAL . . . . . 0.556 ' HB ' ' HB2' ' A' ' 923' ' ' LEU . 0.2 OUTLIER -105.06 126.19 60.04 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 178.83 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 903' ' ' THR . . . . . 0.638 HG22 HG21 ' A' ' 876' ' ' VAL . 0.2 OUTLIER -135.2 153.77 51.83 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.056 0.455 . . . . 0.0 111.611 -174.665 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -90.78 104.02 16.65 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.722 174.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 16.4 t30 43.73 61.46 2.27 Favored 'General case' 0 N--CA 1.468 0.427 0 O-C-N 124.034 0.834 . . . . 0.0 111.553 -178.326 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -55.29 -64.82 0.72 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.843 -178.279 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 3.6 mp 56.24 35.19 25.34 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.848 178.475 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -175.7 -45.36 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.096 -175.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -20.23 63.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.327 -175.618 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 910' ' ' GLU . . . . . 0.449 ' HG2' ' H ' ' A' ' 911' ' ' LYS . 3.5 pm0 -62.29 -40.82 97.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.245 0.545 . . . . 0.0 109.682 172.911 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 911' ' ' LYS . . . . . 0.449 ' H ' ' HG2' ' A' ' 910' ' ' GLU . 0.7 OUTLIER -67.84 -35.94 79.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.99 178.286 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 912' ' ' GLN . . . . . 0.446 ' O ' ' HG3' ' A' ' 916' ' ' GLU . 0.0 OUTLIER -63.32 -44.19 95.64 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.225 176.125 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 913' ' ' ARG . . . . . 0.547 ' HD3' ' HB3' ' A' ' 919' ' ' MET . 0.0 OUTLIER -63.7 -28.07 69.64 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.912 179.562 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 63.8 m -74.42 -28.11 60.92 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.96 0.41 . . . . 0.0 110.064 176.451 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.43 -49.98 50.02 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.049 179.217 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 916' ' ' GLU . . . . . 0.531 ' H ' ' HG3' ' A' ' 916' ' ' GLU . 0.0 OUTLIER -77.26 -38.42 51.02 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.984 -178.574 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.74 36.72 18.45 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 121.286 0.565 . . . . 0.0 111.18 -175.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -125.09 -14.06 3.44 Favored Glycine 0 N--CA 1.446 -0.646 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.691 179.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 919' ' ' MET . . . . . 0.718 ' O ' ' HB2' ' A' ' 920' ' ' ASP . 2.7 ttm -63.79 -108.24 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.542 0.337 . . . . 0.0 110.575 175.617 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 920' ' ' ASP . . . . . 0.718 ' HB2' ' O ' ' A' ' 919' ' ' MET . 0.6 OUTLIER 153.0 -81.12 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.563 1.145 . . . . 0.0 110.097 174.355 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 921' ' ' SER . . . . . 0.727 ' HB2' HG21 ' A' ' 900' ' ' ILE . 0.0 OUTLIER -98.61 149.38 22.83 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.133 -174.188 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 922' ' ' CYS . . . . . 0.442 ' HA ' ' O ' ' A' ' 901' ' ' GLY . 10.2 m -130.82 119.46 22.28 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.045 0.45 . . . . 0.0 109.838 176.67 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 923' ' ' LEU . . . . . 0.556 ' HB2' ' HB ' ' A' ' 902' ' ' VAL . 68.3 mt -120.17 167.11 12.57 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.939 -174.759 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -89.29 147.06 24.32 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.143 175.875 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 925' ' ' LYS . . . . . 0.526 ' HB3' ' HD3' ' A' ' 926' ' ' PRO . 10.0 tttp -57.56 -49.05 95.99 Favored Pre-proline 0 CA--C 1.539 0.55 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 179.73 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 926' ' ' PRO . . . . . 0.526 ' HD3' ' HB3' ' A' ' 925' ' ' LYS . 11.5 Cg_exo -72.24 66.16 3.51 Favored 'Trans proline' 0 C--N 1.357 0.985 0 C-N-CA 122.245 1.963 . . . . 0.0 112.708 177.756 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 927' ' ' VAL . . . . . 0.675 HG22 HG12 ' A' ' 931' ' ' VAL . 1.1 t -99.28 136.47 30.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.262 178.314 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -94.57 171.84 8.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.307 -178.179 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 929' ' ' LEU . . . . . 0.462 ' HA ' HG23 ' A' ' 932' ' ' ILE . 0.3 OUTLIER -54.43 -45.93 73.12 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 -177.105 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.8 -48.48 81.61 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.914 0.387 . . . . 0.0 110.287 -175.652 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 931' ' ' VAL . . . . . 0.675 HG12 HG22 ' A' ' 927' ' ' VAL . 43.7 t -62.08 -52.39 60.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.42 179.009 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 932' ' ' ILE . . . . . 0.526 HG21 ' N ' ' A' ' 933' ' ' LYS . 0.0 OUTLIER -63.13 -39.09 83.89 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 CA-C-O 120.647 0.261 . . . . 0.0 111.284 -175.412 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 933' ' ' LYS . . . . . 0.526 ' N ' HG21 ' A' ' 932' ' ' ILE . 0.0 OUTLIER -67.26 -47.68 70.0 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-O 120.875 0.369 . . . . 0.0 110.305 -179.327 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 934' ' ' GLN . . . . . 0.599 ' O ' ' HB2' ' A' ' 938' ' ' LEU . 0.0 OUTLIER -65.62 -35.82 81.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.107 -178.455 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 935' ' ' THR . . . . . 0.492 ' N ' ' HG2' ' A' ' 934' ' ' GLN . 19.2 m -72.97 -43.86 61.75 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.621 0.248 . . . . 0.0 111.187 -179.486 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 936' ' ' LEU . . . . . 0.417 HD11 HG23 ' A' ' 827' ' ' ILE . 0.3 OUTLIER -64.19 -45.02 90.2 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.572 -0.285 . . . . 0.0 110.343 178.862 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 26.6 m -64.37 -40.75 96.45 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.829 178.049 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 938' ' ' LEU . . . . . 0.644 ' O ' ' HG2' ' A' ' 941' ' ' GLU . 1.4 tp -62.68 -42.38 99.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.063 179.155 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -75.86 -27.09 57.66 Favored 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.974 -179.321 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -65.53 -32.65 74.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.172 0.511 . . . . 0.0 109.953 172.605 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 941' ' ' GLU . . . . . 0.644 ' HG2' ' O ' ' A' ' 938' ' ' LEU . 2.1 pt-20 -74.6 -31.46 62.03 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.161 175.621 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 942' ' ' ARG . . . . . 0.598 ' HG2' ' O ' ' A' ' 938' ' ' LEU . 4.6 mmt85 -65.34 -47.42 76.54 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-O 120.94 0.4 . . . . 0.0 110.278 177.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 943' ' ' VAL . . . . . 0.495 HG23 ' N ' ' A' ' 944' ' ' ARG . 5.1 m -69.01 -30.58 47.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.649 179.186 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 944' ' ' ARG . . . . . 0.495 ' N ' HG23 ' A' ' 943' ' ' VAL . 0.0 OUTLIER -67.63 -41.76 83.38 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.422 177.042 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 2.0 pttt -74.36 -25.85 59.77 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.575 0.226 . . . . 0.0 110.906 -179.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 15.2 m -76.21 -34.93 59.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.225 0.536 . . . . 0.0 109.741 175.178 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -72.9 -22.92 60.67 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.315 176.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.267 177.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.064 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 80.69 -67.51 3.53 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.901 -0.666 . . . . 0.0 111.928 -178.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . 139.22 104.35 0.61 Allowed Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 121.045 -0.597 . . . . 0.0 112.015 -179.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.28 91.69 1.34 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.154 0.502 . . . . 0.0 111.096 -178.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . -127.08 119.27 3.23 Favored Glycine 0 N--CA 1.445 -0.735 0 C-N-CA 120.932 -0.652 . . . . 0.0 111.853 179.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . 0.517 ' HA ' ' OD1' ' A' ' 855' ' ' ASN . 1.5 m -115.32 145.12 21.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 120.935 0.397 . . . . 0.0 110.632 177.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -128.3 -87.01 0.56 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.055 178.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . 71.93 -116.54 6.02 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.132 179.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -93.82 -30.94 14.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.889 0.376 . . . . 0.0 110.259 178.438 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.85 100.94 0.17 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.403 174.36 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 127.97 -6.72 6.87 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.971 -0.633 . . . . 0.0 111.751 -176.018 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 2.9 mmmt -66.7 134.78 52.94 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 175.483 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 708' ' ' ARG . . . . . . . . . . . . . 10.5 mtt180 -102.7 146.25 28.49 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 121.473 0.654 . . . . 0.0 111.953 -171.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 709' ' ' CYS . . . . . 0.429 ' O ' ' HA ' ' A' ' 733' ' ' VAL . 61.8 m -134.86 119.73 18.46 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.986 -1.007 . . . . 0.0 109.019 174.146 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 710' ' ' TRP . . . . . 0.485 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 81.5 m95 -92.14 134.94 34.39 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 -177.288 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 711' ' ' LEU . . . . . 0.421 ' O ' ' HG ' ' A' ' 711' ' ' LEU . 0.1 OUTLIER -126.16 125.55 42.67 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.611 0.72 . . . . 0.0 111.11 -177.958 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -120.9 65.59 0.86 Allowed 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.181 -0.918 . . . . 0.0 108.86 176.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 713' ' ' VAL . . . . . 0.766 HG12 ' HB3' ' A' ' 750' ' ' ASP . 21.1 t -114.76 113.54 43.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.348 -177.514 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 41.8 mtm180 -77.13 -23.61 51.71 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.186 0.517 . . . . 0.0 109.622 179.146 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -72.83 97.42 2.24 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.481 175.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -61.94 -31.52 71.85 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.897 -174.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.32 -48.25 78.83 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.136 0.493 . . . . 0.0 110.275 179.153 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 718' ' ' LEU . . . . . 0.564 HD12 ' HA ' ' A' ' 786' ' ' ALA . 1.4 tt -72.49 -42.53 64.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.496 178.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 719' ' ' CYS . . . . . 0.7 ' HB2' ' HB ' ' A' ' 713' ' ' VAL . 0.0 OUTLIER -58.93 -52.18 66.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.804 -177.852 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 720' ' ' GLN . . . . . 0.632 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 22.5 tt0 -62.23 -42.36 99.24 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.979 -179.124 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -59.39 -53.06 62.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.038 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.98 -44.76 88.23 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.253 -177.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 723' ' ' GLU . . . . . 0.632 ' HG2' ' HA ' ' A' ' 720' ' ' GLN . 2.0 pt-20 -64.55 -40.12 94.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.644 -174.535 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 724' ' ' THR . . . . . 0.519 ' N ' ' HG3' ' A' ' 723' ' ' GLU . 9.2 m -70.04 -38.61 75.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.853 0.358 . . . . 0.0 110.96 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 20.3 m -64.39 -38.28 90.47 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.507 -178.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 726' ' ' LEU . . . . . 0.403 HD21 HD12 ' A' ' 795' ' ' LEU . 5.4 mt -74.58 -36.34 63.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.055 0.455 . . . . 0.0 110.97 -178.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -75.66 6.91 4.24 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.65 -178.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 8.3 mtm-85 -76.7 -16.51 59.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.881 0.372 . . . . 0.0 111.077 179.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 14.5 m -107.72 -99.68 0.36 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.759 177.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 730' ' ' GLY . . . . . . . . . . . . . . . -144.88 31.88 1.73 Allowed Glycine 0 N--CA 1.448 -0.514 0 N-CA-C 110.933 -0.867 . . . . 0.0 110.933 179.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 731' ' ' ILE . . . . . . . . . . . . . 26.6 mm -100.24 132.64 45.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.303 -0.448 . . . . 0.0 110.045 -176.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 732' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -100.72 105.4 17.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.094 0.473 . . . . 0.0 110.536 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 733' ' ' VAL . . . . . 0.429 ' HA ' ' O ' ' A' ' 709' ' ' CYS . 4.5 t -84.08 126.9 40.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.624 177.121 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 734' ' ' THR . . . . . 0.431 ' HB ' ' CE3' ' A' ' 710' ' ' TRP . 0.2 OUTLIER -124.36 140.14 53.23 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.921 0.391 . . . . 0.0 111.131 -175.77 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 1.4 m -65.79 115.52 6.01 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.977 178.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 736' ' ' TYR . . . . . 0.485 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 70.3 t80 -89.57 114.08 25.59 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.474 -179.157 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -117.98 -49.77 2.5 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.475 178.169 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -157.32 38.86 0.55 Allowed Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.965 -0.636 . . . . 0.0 111.563 -179.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 15.5 mp0 -86.2 175.68 8.37 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.475 -0.362 . . . . 0.0 110.775 -177.022 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 740' ' ' GLU . . . . . 0.432 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 11.5 mt-10 -95.12 147.78 33.59 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.683 -178.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 741' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 740' ' ' GLU . 3.1 Cg_endo -84.77 122.45 2.66 Favored 'Trans proline' 0 N--CA 1.455 -0.774 0 C-N-CA 122.803 2.335 . . . . 0.0 112.471 -179.076 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 742' ' ' THR . . . . . 0.646 HG23 ' HD2' ' A' ' 743' ' ' PRO . 0.3 OUTLIER -103.32 138.11 19.45 Favored Pre-proline 0 C--N 1.322 -0.615 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.269 177.344 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 743' ' ' PRO . . . . . 0.646 ' HD2' HG23 ' A' ' 742' ' ' THR . 36.4 Cg_endo -66.02 -0.98 4.55 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.954 2.436 . . . . 0.0 113.131 -178.706 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -108.31 -6.51 16.26 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.088 0.47 . . . . 0.0 110.261 178.057 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 87.6 m-20 -108.49 157.66 18.25 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.596 -170.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 746' ' ' VAL . . . . . 0.438 ' HA ' ' O ' ' A' ' 761' ' ' ALA . 1.3 p -123.71 137.35 57.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.484 -179.254 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 747' ' ' LEU . . . . . 0.472 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 0.6 OUTLIER -106.72 111.55 24.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.513 -179.43 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 2.9 mt -100.78 110.72 28.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 176.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 4.9 t -118.76 166.61 12.57 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.709 0.29 . . . . 0.0 111.012 -176.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 750' ' ' ASP . . . . . 0.766 ' HB3' HG12 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -111.74 136.89 50.39 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.589 177.663 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 751' ' ' GLU . . . . . 0.677 ' HG3' ' H ' ' A' ' 752' ' ' VAL . 3.0 tp10 66.51 174.74 0.24 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.917 -1.038 . . . . 0.0 111.433 -178.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 752' ' ' VAL . . . . . 0.677 ' H ' ' HG3' ' A' ' 751' ' ' GLU . 2.9 p -56.96 120.89 3.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 121.477 0.656 . . . . 0.0 111.233 -179.63 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 2.7 p -99.34 158.74 3.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.336 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -113.17 25.96 10.89 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.141 0.496 . . . . 0.0 110.5 -178.516 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.67 169.29 10.52 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.1 -179.448 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -108.84 -39.69 5.26 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.723 -178.278 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 757' ' ' TRP . . . . . 0.472 ' CD2' ' HB2' ' A' ' 747' ' ' LEU . 76.6 t-105 61.9 85.09 0.13 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.51 0.672 . . . . 0.0 111.233 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 25.7 mm100 -78.01 67.4 3.85 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.1 176.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 759' ' ' GLY . . . . . 0.477 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -129.46 -147.12 6.23 Favored Glycine 0 N--CA 1.444 -0.801 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.291 -177.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.38 -47.22 20.4 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.717 0.294 . . . . 0.0 110.802 -179.352 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 761' ' ' ALA . . . . . 0.438 ' O ' ' HA ' ' A' ' 746' ' ' VAL . . . -166.75 158.56 13.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.689 -179.064 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 762' ' ' VAL . . . . . 0.451 HG21 ' N ' ' A' ' 763' ' ' VAL . 1.5 p -131.69 137.37 55.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.53 175.258 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 763' ' ' VAL . . . . . 0.451 ' N ' HG21 ' A' ' 762' ' ' VAL . 77.7 t -115.96 121.82 68.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.04 -179.217 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 764' ' ' THR . . . . . 0.478 ' HB ' HG11 ' A' ' 782' ' ' VAL . 5.7 m -110.92 98.78 7.81 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.242 0.544 . . . . 0.0 111.468 -178.175 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 765' ' ' PHE . . . . . 0.448 ' CZ ' HD13 ' A' ' 791' ' ' LEU . 20.6 m-85 -76.83 119.73 21.0 Favored 'General case' 0 C--O 1.221 -0.398 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 174.004 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -94.13 133.82 37.21 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 120.355 -0.538 . . . . 0.0 110.879 -174.103 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 767' ' ' ARG . . . . . 0.573 ' NE ' ' HA ' ' A' ' 767' ' ' ARG . 0.1 OUTLIER -110.08 -36.43 5.85 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.711 -179.374 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.37 -58.13 0.26 Allowed 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.76 0.281 . . . . 0.0 111.76 177.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 34.1 m170 -114.1 146.32 40.43 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 121.752 0.787 . . . . 0.0 112.514 -172.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 770' ' ' ILE . . . . . 0.541 HG23 ' H ' ' A' ' 771' ' ' GLY . 0.6 OUTLIER -110.37 -179.47 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.688 0 CA-C-N 114.448 -1.251 . . . . 0.0 109.644 -179.123 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 771' ' ' GLY . . . . . 0.541 ' H ' HG23 ' A' ' 770' ' ' ILE . . . 170.29 -33.56 0.16 Allowed Glycine 0 N--CA 1.451 -0.346 0 N-CA-C 110.668 -0.973 . . . . 0.0 110.668 -178.252 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 772' ' ' ILE . . . . . 1.063 HG13 ' HD2' ' A' ' 773' ' ' PRO . 1.2 tp -80.64 148.4 65.56 Favored Pre-proline 0 C--N 1.32 -0.685 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 171.503 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 773' ' ' PRO . . . . . 1.063 ' HD2' HG13 ' A' ' 772' ' ' ILE . 33.4 Cg_endo -65.45 -108.33 0.0 OUTLIER 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 122.652 2.235 . . . . 0.0 113.829 -179.433 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . 0.503 ' HG ' ' H ' ' A' ' 776' ' ' LYS . 1.0 OUTLIER 174.36 -154.75 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 -177.365 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 775' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -60.3 -0.01 0.21 Allowed 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . 0.503 ' H ' ' HG ' ' A' ' 774' ' ' LEU . 0.0 OUTLIER -75.01 -11.51 60.12 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 121.334 0.588 . . . . 0.0 109.829 171.487 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 777' ' ' ALA . . . . . 0.418 ' HB1' ' HD2' ' A' ' 778' ' ' PRO . . . -102.91 158.76 31.13 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.597 176.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 778' ' ' PRO . . . . . 0.418 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 54.7 Cg_endo -70.35 63.09 2.13 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.974 2.449 . . . . 0.0 113.445 -177.631 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 116.09 49.24 0.46 Allowed Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.807 176.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 780' ' ' GLU . . . . . 0.437 ' HG2' ' CG1' ' A' ' 762' ' ' VAL . 0.7 OUTLIER -130.78 140.06 50.26 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 177.165 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 45.5 m95 -141.47 112.64 7.41 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 110.487 -0.19 . . . . 0.0 110.487 -178.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . 0.478 HG11 ' HB ' ' A' ' 764' ' ' THR . 31.2 m -106.67 143.84 16.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-O 121.151 0.501 . . . . 0.0 111.063 179.138 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 783' ' ' HIS . . . . . . . . . . . . . 7.5 t-160 -165.47 121.38 1.36 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.189 174.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.45 100.74 9.46 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.106 176.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 785' ' ' VAL . . . . . 0.414 ' HB ' ' HD3' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -154.94 176.54 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.0 -0.545 . . . . 0.0 109.69 179.941 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 786' ' ' ALA . . . . . 0.564 ' HA ' HD12 ' A' ' 718' ' ' LEU . . . -115.87 39.92 2.92 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.515 178.518 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 787' ' ' ALA . . . . . 0.465 ' HB2' ' HG ' ' A' ' 718' ' ' LEU . . . 62.91 69.99 0.8 Allowed Pre-proline 0 CA--C 1.529 0.156 0 CA-C-N 115.795 -0.638 . . . . 0.0 111.595 178.841 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 788' ' ' PRO . . . . . 0.672 ' HD2' ' OE1' ' A' ' 790' ' ' GLU . 12.1 Cg_exo -70.18 -66.54 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.772 2.315 . . . . 0.0 111.529 175.608 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 789' ' ' HIS . . . . . 0.414 ' HB3' ' O ' ' A' ' 788' ' ' PRO . 1.8 p80 177.08 -3.96 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.214 178.653 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 790' ' ' GLU . . . . . 0.672 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -84.38 -48.68 9.42 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.803 0.297 . . . . 0.0 111.803 -172.065 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 791' ' ' LEU . . . . . 0.565 ' N ' ' HD2' ' A' ' 792' ' ' PRO . 1.1 mt -70.43 -42.84 16.02 Favored Pre-proline 0 C--N 1.326 -0.438 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -177.187 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 792' ' ' PRO . . . . . 0.565 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 8.8 Cg_endo -54.23 -36.85 87.38 Favored 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 121.653 1.569 . . . . 0.0 111.713 170.83 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -69.84 -37.21 76.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.612 177.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 794' ' ' LEU . . . . . 0.433 HD21 ' HA ' ' A' ' 794' ' ' LEU . 1.6 tm? -61.59 -39.02 89.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.104 176.758 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 795' ' ' LEU . . . . . 0.473 HD22 ' HA ' ' A' ' 795' ' ' LEU . 0.2 OUTLIER -63.23 -43.76 97.15 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.995 0.426 . . . . 0.0 110.658 178.531 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -66.63 -30.96 71.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.628 178.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.3 -44.24 65.55 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.753 178.384 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -65.55 -31.11 52.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.968 -179.078 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 799' ' ' TYR . . . . . 0.415 ' HD1' ' HA ' ' A' ' 799' ' ' TYR . 0.2 OUTLIER -83.7 -27.6 28.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.418 177.189 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 69.59 45.29 0.81 Allowed 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.169 179.454 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 801' ' ' ILE . . . . . 0.401 ' H ' HG13 ' A' ' 801' ' ' ILE . 0.5 OUTLIER -85.37 -54.31 8.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 174.552 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 50.91 47.41 24.78 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 114.877 -1.056 . . . . 0.0 111.732 177.208 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 803' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.01 -30.68 17.61 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.078 0.466 . . . . 0.0 110.536 179.011 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 804' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -101.35 116.61 33.19 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.189 179.114 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.05 76.51 9.79 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.012 0.434 . . . . 0.0 110.409 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -79.47 -28.58 41.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.048 -177.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 26.2 t0 61.74 78.57 0.3 Allowed Pre-proline 0 N--CA 1.465 0.276 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.733 -172.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 808' ' ' PRO . . . . . 0.402 ' HA ' ' CE1' ' A' ' 789' ' ' HIS . 22.1 Cg_exo -64.78 -43.07 13.39 Favored 'Trans proline' 0 C--O 1.233 0.25 0 C-N-CA 122.915 2.41 . . . . 0.0 113.053 -175.298 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . 51.47 -120.07 1.56 Allowed 'General case' 0 CA--C 1.529 0.158 0 O-C-N 123.435 0.459 . . . . 0.0 110.313 -173.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 36.5 t-20 -167.83 135.53 2.3 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 174.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -78.3 -32.59 49.47 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.926 -178.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 812' ' ' LEU . . . . . 0.48 ' HA ' ' HD3' ' A' ' 813' ' ' PRO . 0.2 OUTLIER -160.28 135.57 5.78 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.292 -179.309 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 813' ' ' PRO . . . . . 0.48 ' HD3' ' HA ' ' A' ' 812' ' ' LEU . 6.4 Cg_exo -73.47 70.48 4.03 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 123.075 2.517 . . . . 0.0 111.52 177.791 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.32 -51.27 70.51 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.726 -175.654 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -140.5 138.6 34.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.86 -179.487 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -74.89 112.72 11.4 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 177.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -98.33 121.26 40.04 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.958 0.409 . . . . 0.0 110.797 -177.758 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -78.61 123.03 26.68 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.24 176.369 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 21.2 t -96.86 94.49 4.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 121.262 0.553 . . . . 0.0 110.787 -178.184 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -109.55 103.89 12.84 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.459 177.436 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -120.75 134.78 55.27 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.903 0.382 . . . . 0.0 110.397 -179.56 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -166.61 -42.38 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.127 177.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -88.45 70.04 8.99 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.223 176.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -132.07 74.86 1.61 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.721 -176.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 3.2 ttm -96.23 108.14 20.57 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.594 175.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 826' ' ' MET . . . . . 0.576 ' HG2' HG13 ' A' ' 869' ' ' ILE . 2.3 tpp -100.16 118.27 36.15 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.794 -178.509 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 827' ' ' ILE . . . . . 0.612 ' HB ' HD23 ' A' ' 844' ' ' LEU . 4.8 mm -108.58 128.79 63.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.657 178.129 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 828' ' ' LEU . . . . . 0.592 HD12 ' HB1' ' A' ' 854' ' ' ALA . 0.5 OUTLIER -105.41 128.76 53.69 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.424 -177.892 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 829' ' ' VAL . . . . . 0.563 ' HB ' HD12 ' A' ' 873' ' ' LEU . 1.2 p -114.77 114.87 47.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 121.084 0.469 . . . . 0.0 110.532 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 830' ' ' VAL . . . . . 0.612 HG22 ' HB2' ' A' ' 854' ' ' ALA . 80.3 t -109.23 105.45 18.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.918 177.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 831' ' ' ASP . . . . . 0.853 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 33.3 t0 -117.55 137.41 52.59 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.739 -177.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.05 -21.95 60.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.666 178.653 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 1.2 m170 -111.48 106.82 57.02 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.581 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -49.29 -44.57 33.46 Favored 'Trans proline' 0 CA--C 1.533 0.463 0 C-N-CA 123.965 3.11 . . . . 0.0 114.672 -174.047 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 835' ' ' ILE . . . . . 0.557 HG22 ' N ' ' A' ' 836' ' ' ASN . 0.4 OUTLIER -65.39 -36.21 77.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.862 0.363 . . . . 0.0 111.081 -178.253 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 836' ' ' ASN . . . . . 0.557 ' N ' HG22 ' A' ' 835' ' ' ILE . 5.0 m120 -75.33 -35.47 61.21 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 178.186 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 837' ' ' ARG . . . . . 0.853 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 1.3 ttp180 -53.36 -45.91 69.35 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.427 175.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -72.03 -28.75 63.57 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.982 178.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.99 -53.21 27.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.53 -0.304 . . . . 0.0 111.807 -177.093 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 840' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 836' ' ' ASN . 0.0 OUTLIER -72.24 -27.69 62.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.944 0.402 . . . . 0.0 109.963 -179.997 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 841' ' ' ALA . . . . . 0.474 ' HB3' ' O ' ' A' ' 837' ' ' ARG . . . -64.63 -35.53 81.31 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.079 174.854 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -64.8 -43.94 91.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.211 176.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 843' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.11 -46.45 85.54 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.128 176.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 844' ' ' LEU . . . . . 0.612 HD23 ' HB ' ' A' ' 827' ' ' ILE . 0.1 OUTLIER -60.5 -42.62 96.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.071 178.177 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -68.04 -22.36 74.12 Favored Glycine 0 N--CA 1.45 -0.369 0 CA-C-N 116.05 -0.523 . . . . 0.0 112.282 178.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 35.8 m -75.32 -30.34 60.29 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.515 -0.18 . . . . 0.0 110.515 177.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 847' ' ' LEU . . . . . 0.481 ' HA ' HD12 ' A' ' 847' ' ' LEU . 0.1 OUTLIER -68.52 -44.51 74.45 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 120.911 0.386 . . . . 0.0 110.168 173.41 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 105.19 59.56 0.65 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.79 -0.719 . . . . 0.0 113.35 174.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -143.45 -178.59 5.95 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 122.781 -0.246 . . . . 0.0 110.348 177.51 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -74.86 122.26 23.11 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 -177.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -122.47 120.55 34.24 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.516 -177.056 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 852' ' ' LYS . . . . . 0.418 ' HB3' HD13 ' A' ' 828' ' ' LEU . 0.0 OUTLIER -110.85 115.26 29.23 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.405 178.84 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.78 114.84 26.61 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.026 -177.344 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 854' ' ' ALA . . . . . 0.612 ' HB2' HG22 ' A' ' 830' ' ' VAL . . . -132.42 171.81 13.27 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.112 0.482 . . . . 0.0 111.629 -179.391 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 855' ' ' ASN . . . . . 0.517 ' OD1' ' HA ' ' A' ' 701' ' ' VAL . 6.3 t-20 -160.8 97.53 1.18 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.305 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 856' ' ' ASP . . . . . 0.469 ' HB2' ' O ' ' A' ' 855' ' ' ASN . 48.8 t0 170.06 156.28 0.06 Allowed 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.293 179.354 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -88.61 -49.36 3.66 Favored Glycine 0 N--CA 1.447 -0.606 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.071 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -74.27 -34.83 38.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 O-C-N 122.773 -0.251 . . . . 0.0 111.138 -178.144 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 859' ' ' ASP . . . . . 0.44 ' HB2' ' OD2' ' A' ' 856' ' ' ASP . 3.7 t0 -69.05 -19.12 64.09 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 111.925 0.343 . . . . 0.0 111.925 -178.163 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -64.78 -53.02 53.58 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.5 0.666 . . . . 0.0 109.582 173.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 861' ' ' LEU . . . . . 0.679 HD12 ' HA ' ' A' ' 890' ' ' ILE . 9.6 tp -61.15 -41.54 96.94 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.481 -0.782 . . . . 0.0 109.731 175.183 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 862' ' ' ASN . . . . . 0.406 ' HB3' ' HA ' ' A' ' 859' ' ' ASP . 48.2 t30 -60.03 -29.23 68.36 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.742 -1.117 . . . . 0.0 110.834 178.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 863' ' ' VAL . . . . . 0.77 HG11 HD11 ' A' ' 869' ' ' ILE . 0.5 OUTLIER -72.92 -34.62 46.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.621 -179.211 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 864' ' ' LEU . . . . . 0.483 HD22 HD22 ' A' ' 897' ' ' LEU . 6.3 mt -64.71 -33.33 75.71 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.224 0.535 . . . . 0.0 109.774 175.305 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -78.14 -24.88 47.2 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.875 178.199 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 9.0 mtmt -77.93 -48.55 16.07 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.93 -178.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 2.1 p30 -156.72 176.55 12.59 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.21 -177.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 79.2 t60 -91.31 97.3 11.02 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.109 0.481 . . . . 0.0 112.01 -174.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 869' ' ' ILE . . . . . 0.77 HD11 HG11 ' A' ' 863' ' ' VAL . 0.7 OUTLIER -94.31 133.65 34.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 166.806 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -86.37 -43.99 12.41 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.71 0.29 . . . . 0.0 111.143 -174.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 871' ' ' ILE . . . . . 0.581 ' HB ' HG22 ' A' ' 827' ' ' ILE . 43.2 mm -122.59 126.31 73.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.217 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 872' ' ' VAL . . . . . 0.471 HG22 HG23 ' A' ' 869' ' ' ILE . 3.6 t -106.46 122.48 60.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 120.683 0.278 . . . . 0.0 110.334 178.343 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 873' ' ' LEU . . . . . 0.563 HD12 ' HB ' ' A' ' 829' ' ' VAL . 0.1 OUTLIER -104.86 121.55 43.91 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.114 177.113 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -109.45 106.34 16.05 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 177.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 875' ' ' ASP . . . . . 0.52 ' CG ' ' HZ2' ' A' ' 925' ' ' LYS . 7.0 t0 -106.13 119.92 40.46 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.491 -175.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 10.5 t -126.26 119.87 55.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.213 -176.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 877' ' ' ASN . . . . . 0.723 ' HB2' ' HE2' ' A' ' 925' ' ' LYS . 0.1 OUTLIER -109.78 -36.35 5.94 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.156 175.186 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 878' ' ' MET . . . . . 0.443 ' HA ' ' HD3' ' A' ' 879' ' ' PRO . 1.5 mmm -121.27 131.74 24.39 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-O 121.017 0.437 . . . . 0.0 111.308 -178.384 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 879' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 878' ' ' MET . 4.5 Cg_exo -80.06 64.93 8.92 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 123.122 2.548 . . . . 0.0 111.986 178.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -81.91 -10.39 59.3 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.82 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 881' ' ' MET . . . . . 0.429 ' HG3' ' N ' ' A' ' 882' ' ' ASP . 0.0 OUTLIER -153.21 143.98 22.76 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.605 -175.483 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 882' ' ' ASP . . . . . 0.429 ' N ' ' HG3' ' A' ' 881' ' ' MET . 0.9 OUTLIER -65.25 132.64 49.59 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.458 177.506 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -104.11 2.12 44.09 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.46 -0.876 . . . . 0.0 113.711 -172.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -70.88 -43.04 69.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.442 0.639 . . . . 0.0 109.479 -177.609 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 885' ' ' ARG . . . . . 0.442 ' HG2' ' HG3' ' A' ' 889' ' ' ARG . 0.0 OUTLIER -58.21 -32.97 68.78 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.325 177.1 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.75 -56.22 19.51 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.909 -176.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 887' ' ' THR . . . . . 0.515 ' O ' HG21 ' A' ' 890' ' ' ILE . 0.1 OUTLIER -65.83 -44.32 85.89 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.434 -176.741 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 6.3 tp60 -61.24 -50.36 73.38 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.184 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 889' ' ' ARG . . . . . 0.442 ' HG3' ' HG2' ' A' ' 885' ' ' ARG . 2.9 mtt180 -66.51 -41.45 88.82 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.436 -176.196 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 890' ' ' ILE . . . . . 0.699 HG12 ' HG ' ' A' ' 895' ' ' LEU . 10.5 tt -64.53 -41.71 93.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 C-N-CA 121.159 -0.216 . . . . 0.0 111.398 -176.305 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 891' ' ' ARG . . . . . 0.955 ' HA ' ' HB2' ' A' ' 895' ' ' LEU . 10.5 ptt85 -76.35 -32.32 58.57 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.671 179.001 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -70.02 -45.58 66.91 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.319 -176.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 893' ' ' LEU . . . . . 0.473 HD21 ' HA ' ' A' ' 893' ' ' LEU . 3.9 mt -75.06 -26.91 59.72 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.865 0.321 . . . . 0.0 111.865 -175.587 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 146.48 71.88 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.027 -1.082 . . . . 0.0 113.47 175.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 895' ' ' LEU . . . . . 0.955 ' HB2' ' HA ' ' A' ' 891' ' ' ARG . 0.5 OUTLIER -85.22 127.87 34.46 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 173.977 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -129.38 -9.29 4.67 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.126 0.489 . . . . 0.0 111.367 -177.727 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 897' ' ' LEU . . . . . 0.483 HD22 HD22 ' A' ' 864' ' ' LEU . 0.4 OUTLIER -122.89 157.98 58.57 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.832 -172.368 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -71.33 140.14 36.34 Favored 'Trans proline' 0 C--O 1.241 0.643 0 C-N-CA 123.069 2.513 . . . . 0.0 112.718 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 899' ' ' VAL . . . . . 0.911 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 43.3 t -114.53 132.98 62.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.733 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 900' ' ' ILE . . . . . 0.417 HG12 ' HB2' ' A' ' 921' ' ' SER . 89.6 mt -103.5 114.33 42.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.955 175.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 901' ' ' GLY . . . . . 0.515 ' O ' ' HA ' ' A' ' 922' ' ' CYS . . . -94.17 109.75 3.87 Favored Glycine 0 N--CA 1.443 -0.866 0 C-N-CA 120.738 -0.744 . . . . 0.0 111.518 177.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 902' ' ' VAL . . . . . 0.573 ' HB ' HD12 ' A' ' 923' ' ' LEU . 0.1 OUTLIER -108.6 118.76 56.88 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 177.707 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.95 154.06 48.53 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.859 -171.258 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -83.0 105.76 14.26 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.018 174.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 69.07 104.08 0.06 Allowed 'General case' 0 N--CA 1.467 0.409 0 O-C-N 123.803 0.689 . . . . 0.0 110.944 179.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -81.13 53.25 1.96 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.747 -175.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 1.3 mt -80.79 -58.91 2.88 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.006 0.431 . . . . 0.0 110.368 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -94.0 -19.49 20.84 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.374 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.56 -54.03 50.62 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.158 -178.172 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 910' ' ' GLU . . . . . 0.461 ' HA ' ' NH1' ' A' ' 913' ' ' ARG . 9.8 tp10 -50.85 -46.44 60.15 Favored 'General case' 0 N--CA 1.463 0.189 0 O-C-N 123.581 0.551 . . . . 0.0 111.453 -176.172 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 10.1 tmtt? -64.77 -52.49 56.64 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.399 -176.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -69.61 -43.94 71.73 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 111.699 0.259 . . . . 0.0 111.699 -174.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 913' ' ' ARG . . . . . 0.461 ' NH1' ' HA ' ' A' ' 910' ' ' GLU . 0.1 OUTLIER -65.98 -27.26 68.0 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 121.184 -0.206 . . . . 0.0 111.135 -176.9 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 78.3 m -74.63 -39.8 61.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.77 0.319 . . . . 0.0 110.377 175.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.61 -42.92 95.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.612 179.698 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -72.72 -42.71 63.86 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.804 179.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 50.7 50.0 19.81 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.807 -176.339 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -123.56 16.45 7.94 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.218 -178.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 919' ' ' MET . . . . . 0.911 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -113.77 -113.18 0.34 Allowed 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 179.221 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 920' ' ' ASP . . . . . 0.601 ' HB2' ' O ' ' A' ' 919' ' ' MET . 5.3 t70 164.52 -58.48 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.482 0 O-C-N 124.199 0.937 . . . . 0.0 109.89 174.697 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 921' ' ' SER . . . . . 0.417 ' HB2' HG12 ' A' ' 900' ' ' ILE . 57.9 m -113.87 164.59 13.56 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.035 177.805 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 922' ' ' CYS . . . . . 0.515 ' HA ' ' O ' ' A' ' 901' ' ' GLY . 0.1 OUTLIER -148.78 140.13 23.3 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.513 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 923' ' ' LEU . . . . . 0.573 HD12 ' HB ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -147.68 177.86 8.95 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.773 0.321 . . . . 0.0 110.439 178.184 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.87 146.18 24.61 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.991 -178.674 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 925' ' ' LYS . . . . . 0.723 ' HE2' ' HB2' ' A' ' 877' ' ' ASN . 3.7 tmtm? -45.73 -51.62 28.45 Favored Pre-proline 0 N--CA 1.47 0.572 0 O-C-N 123.67 0.606 . . . . 0.0 112.308 177.375 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -72.1 64.61 3.41 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 121.742 1.628 . . . . 0.0 112.169 175.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 2.1 p -71.65 148.94 9.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.043 0.449 . . . . 0.0 110.633 179.199 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.82 160.25 14.76 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.552 179.298 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 929' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.67 -45.36 81.74 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.107 -179.14 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -65.99 -44.61 84.34 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.824 0.345 . . . . 0.0 110.692 -176.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 931' ' ' VAL . . . . . 0.445 ' O ' ' HG3' ' A' ' 934' ' ' GLN . 74.4 t -63.65 -42.94 97.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.785 -178.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 932' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -66.7 -33.9 66.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.444 178.43 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.84 -48.67 58.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.002 -178.763 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 934' ' ' GLN . . . . . 0.445 ' HG3' ' O ' ' A' ' 931' ' ' VAL . 0.6 OUTLIER -65.7 -40.97 92.82 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 121.132 -0.227 . . . . 0.0 111.161 -177.573 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 12.4 m -64.41 -43.77 93.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.731 0.301 . . . . 0.0 111.087 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 936' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.78 -41.94 91.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.856 178.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 39.6 m -65.43 -44.46 87.29 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.229 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.15 -40.34 89.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.081 0.467 . . . . 0.0 110.503 178.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 939' ' ' TYR . . . . . 0.486 ' HD1' ' HA ' ' A' ' 939' ' ' TYR . 0.5 OUTLIER -72.85 -36.3 67.4 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.879 -178.902 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -62.15 -39.07 91.4 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.068 0.461 . . . . 0.0 110.905 177.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 941' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.31 -24.11 43.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.349 178.319 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 942' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.6 -47.75 68.8 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.418 178.512 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 5.8 m -69.51 -28.76 39.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.042 176.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -58.57 -33.52 70.05 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.195 173.763 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 3.3 mmtp -69.1 -48.77 61.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.842 177.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.1 -42.39 72.76 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.835 -0.62 . . . . 0.0 112.658 -175.174 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 11.1 mtm-85 -89.18 -33.74 16.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.755 0.312 . . . . 0.0 111.202 -175.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 1.2 t0 59.54 -168.4 0.15 Allowed 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.369 -177.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.795 -0.621 . . . . 0.0 110.057 178.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 3.1 ttp . . . . . 0 N--CA 1.48 1.031 0 CA-C-O 120.642 0.258 . . . . 0.0 110.506 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . -155.47 99.47 0.19 Allowed Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 121.158 -0.544 . . . . 0.0 112.009 177.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . 176.64 91.73 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 121.031 -0.604 . . . . 0.0 111.694 -179.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.87 -73.33 0.45 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.587 0.232 . . . . 0.0 111.104 -175.787 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . 93.06 -40.34 2.84 Favored Glycine 0 CA--C 1.519 0.309 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.621 -178.336 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 2.0 t 57.12 26.92 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 123.007 0.523 . . . . 0.0 111.554 177.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 54.97 31.31 15.74 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.515 -176.147 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . 130.18 146.57 6.0 Favored Glycine 0 N--CA 1.442 -0.956 0 C-N-CA 120.855 -0.688 . . . . 0.0 111.884 178.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.73 ' HB2' HD13 ' A' ' 801' ' ' ILE . 2.8 mm? -117.06 -141.37 0.37 Allowed 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 179.391 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -127.03 139.27 53.14 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.547 0.213 . . . . 0.0 111.034 179.224 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 80.99 45.84 7.41 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.848 -0.691 . . . . 0.0 113.473 173.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 707' ' ' LYS . . . . . 0.417 ' HZ3' ' CD ' ' A' ' 744' ' ' GLU . 4.4 tptt -145.59 153.74 41.39 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 176.452 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 708' ' ' ARG . . . . . 0.657 ' HG2' HG13 ' A' ' 732' ' ' VAL . 0.0 OUTLIER -118.59 156.39 29.26 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.216 0.532 . . . . 0.0 111.849 -172.716 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 709' ' ' CYS . . . . . 0.454 ' SG ' HG23 ' A' ' 731' ' ' ILE . 0.5 OUTLIER -142.19 145.25 33.95 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.794 173.741 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 710' ' ' TRP . . . . . . . . . . . . . 66.4 m95 -114.26 131.99 56.3 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 177.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 711' ' ' LEU . . . . . 0.486 HD23 ' HA ' ' A' ' 735' ' ' THR . 0.3 OUTLIER -122.86 131.31 53.69 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.476 0.655 . . . . 0.0 111.658 -175.898 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -126.81 65.56 1.27 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.816 -1.084 . . . . 0.0 109.128 174.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 713' ' ' VAL . . . . . 0.835 ' HA ' ' HB2' ' A' ' 750' ' ' ASP . 13.4 t -113.1 134.3 56.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.681 -175.085 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -100.97 -27.6 13.2 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.68 -174.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 -74.57 124.97 27.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.942 173.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -70.37 -40.26 74.12 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.173 -173.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.66 -41.49 95.14 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.164 0.507 . . . . 0.0 110.479 178.63 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 718' ' ' LEU . . . . . 0.652 HD13 ' HD2' ' A' ' 765' ' ' PHE . 0.4 OUTLIER -71.87 -49.37 38.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.704 -179.41 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 719' ' ' CYS . . . . . 0.654 ' HB2' ' HB ' ' A' ' 713' ' ' VAL . 0.0 OUTLIER -60.25 -52.21 66.24 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.824 -177.752 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 720' ' ' GLN . . . . . 0.656 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 0.1 OUTLIER -63.49 -40.29 96.7 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -175.957 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 721' ' ' PHE . . . . . 0.411 ' CD2' ' HB2' ' A' ' 787' ' ' ALA . 38.6 t80 -64.11 -43.48 95.22 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.808 0.337 . . . . 0.0 110.58 -179.241 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 722' ' ' LEU . . . . . 0.462 HD23 ' HD3' ' A' ' 792' ' ' PRO . 0.4 OUTLIER -68.4 -48.41 64.75 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.789 -179.261 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 723' ' ' GLU . . . . . 0.656 ' HG2' ' HA ' ' A' ' 720' ' ' GLN . 1.5 pt-20 -63.05 -42.49 99.74 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.379 -176.493 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 724' ' ' THR . . . . . 0.578 ' N ' ' HG3' ' A' ' 723' ' ' GLU . 20.1 m -70.84 -34.18 71.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.445 0.164 . . . . 0.0 111.359 -178.059 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 72.6 m -68.87 -37.76 79.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.775 0.321 . . . . 0.0 110.927 179.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 726' ' ' LEU . . . . . 0.526 HD22 HD12 ' A' ' 795' ' ' LEU . 14.1 mt -73.41 -42.49 62.02 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.081 0.467 . . . . 0.0 110.493 179.333 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -75.77 10.08 1.99 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.532 178.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.81 -35.14 64.85 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.809 0.338 . . . . 0.0 110.183 179.069 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 13.1 m -100.25 -94.22 0.27 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.677 177.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 730' ' ' GLY . . . . . . . . . . . . . . . -152.28 38.21 0.78 Allowed Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 111.336 -0.705 . . . . 0.0 111.336 -179.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 731' ' ' ILE . . . . . 0.524 HD12 ' H ' ' A' ' 704' ' ' LEU . 42.9 mm -101.42 128.31 53.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 178.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 732' ' ' VAL . . . . . 0.657 HG13 ' HG2' ' A' ' 708' ' ' ARG . 0.9 OUTLIER -98.02 114.73 36.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.368 0.604 . . . . 0.0 110.84 -176.403 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 733' ' ' VAL . . . . . 0.437 HG23 HD22 ' A' ' 711' ' ' LEU . 5.2 p -98.22 147.79 6.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.023 177.557 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 22.3 m -141.67 137.3 31.67 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.849 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 735' ' ' THR . . . . . 0.486 ' HA ' HD23 ' A' ' 711' ' ' LEU . 0.6 OUTLIER -54.9 125.34 19.83 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.727 174.669 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 736' ' ' TYR . . . . . 0.638 ' HH ' ' HE2' ' A' ' 755' ' ' LYS . 21.8 t80 -74.74 83.76 2.12 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.172 0.51 . . . . 0.0 111.059 -179.294 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -70.24 -60.46 2.27 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.133 175.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 179.99 49.02 0.08 OUTLIER Glycine 0 N--CA 1.445 -0.734 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.513 179.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.89 147.07 23.97 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.86 0.362 . . . . 0.0 110.278 -178.703 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 34.7 mp0 -68.63 143.93 95.63 Favored Pre-proline 0 C--N 1.32 -0.71 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.765 -178.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 741' ' ' PRO . . . . . 0.492 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 40.4 Cg_endo -66.14 135.0 38.7 Favored 'Trans proline' 0 C--O 1.234 0.305 0 C-N-CA 122.931 2.421 . . . . 0.0 113.417 -176.429 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 742' ' ' THR . . . . . 0.555 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.0 OUTLIER -117.92 139.59 26.69 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.416 177.491 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 743' ' ' PRO . . . . . 0.564 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 33.5 Cg_endo -64.15 -17.12 58.55 Favored 'Trans proline' 0 N--CA 1.476 0.481 0 C-N-CA 123.042 2.495 . . . . 0.0 113.633 -176.076 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 744' ' ' GLU . . . . . 0.417 ' CD ' ' HZ3' ' A' ' 707' ' ' LYS . 0.9 OUTLIER -97.97 -2.89 39.44 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.915 0.388 . . . . 0.0 110.645 179.492 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -109.56 155.28 21.59 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.232 -170.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 746' ' ' VAL . . . . . 0.884 HG22 HD11 ' A' ' 795' ' ' LEU . 17.3 m -120.09 148.16 23.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.518 -0.764 . . . . 0.0 110.878 -178.266 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 747' ' ' LEU . . . . . 0.49 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 0.2 OUTLIER -117.73 106.03 12.62 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.142 178.296 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 10.4 mt -95.28 108.84 21.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 177.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -114.31 147.38 39.18 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.168 0.509 . . . . 0.0 111.625 -171.433 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 750' ' ' ASP . . . . . 0.835 ' HB2' ' HA ' ' A' ' 713' ' ' VAL . 31.0 t0 -98.1 121.75 40.4 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.427 179.573 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 57.1 -150.54 0.44 Allowed 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.063 -176.677 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 752' ' ' VAL . . . . . . . . . . . . . 6.6 t -97.61 106.21 18.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 O-C-N 122.015 -0.428 . . . . 0.0 112.13 -173.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 2.1 t -103.42 -8.12 9.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.433 169.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 3.9 m 52.59 45.48 28.54 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.82 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 755' ' ' LYS . . . . . 0.638 ' HE2' ' HH ' ' A' ' 736' ' ' TYR . 0.0 OUTLIER -96.13 116.83 29.58 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.254 177.547 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 756' ' ' LYS . . . . . 0.449 ' HD3' ' HA ' ' A' ' 756' ' ' LYS . 1.8 mmpt? -81.98 81.78 7.83 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.445 0.641 . . . . 0.0 109.801 176.213 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 757' ' ' TRP . . . . . 0.614 ' HB3' ' HB ' ' A' ' 762' ' ' VAL . 74.2 t-105 -72.03 103.46 3.26 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.222 -177.469 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.62 87.94 7.53 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 175.514 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 759' ' ' GLY . . . . . 0.564 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -161.91 -139.18 2.58 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.159 -179.017 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 14.8 ttt85 -70.04 -59.49 2.88 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.809 0.338 . . . . 0.0 110.455 -179.308 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -163.86 144.43 8.57 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.264 -178.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 762' ' ' VAL . . . . . 0.614 ' HB ' ' HB3' ' A' ' 757' ' ' TRP . 2.0 p -118.66 119.53 61.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.519 174.671 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 763' ' ' VAL . . . . . 0.447 HG13 HD21 ' A' ' 791' ' ' LEU . 45.6 t -107.88 108.34 25.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.642 -178.475 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 764' ' ' THR . . . . . . . . . . . . . 84.9 m -96.89 116.35 29.03 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.511 179.113 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 765' ' ' PHE . . . . . 0.652 ' HD2' HD13 ' A' ' 718' ' ' LEU . 1.6 m-30 -99.74 93.7 5.95 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 177.343 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 1.3 p -118.67 132.51 56.17 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.679 -177.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 767' ' ' ARG . . . . . 0.828 ' HA ' ' HB3' ' A' ' 784' ' ' SER . 0.4 OUTLIER -109.46 -58.94 1.97 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.753 0.311 . . . . 0.0 110.945 -173.278 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -102.33 -25.87 13.5 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.195 -178.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -109.59 92.77 4.18 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.034 0.445 . . . . 0.0 110.079 179.607 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 3.1 mp -101.09 109.08 24.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.607 -179.065 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -133.44 -9.92 1.98 Allowed Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.927 -179.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 772' ' ' ILE . . . . . 0.473 ' HA ' ' HD3' ' A' ' 773' ' ' PRO . 14.2 mt -104.84 138.39 19.49 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.741 0.27 . . . . 0.0 110.379 -178.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 773' ' ' PRO . . . . . 0.473 ' HD3' ' HA ' ' A' ' 772' ' ' ILE . 14.6 Cg_exo -69.14 162.81 40.23 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 123.315 2.677 . . . . 0.0 112.725 -179.854 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . 0.421 ' HB3' HG23 ' A' ' 782' ' ' VAL . 0.7 OUTLIER -98.89 -156.29 0.54 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.97 -178.399 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 775' ' ' GLU . . . . . 0.442 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 1.4 mp0 -61.42 72.43 0.01 OUTLIER 'General case' 0 C--O 1.234 0.251 0 CA-C-O 122.161 0.981 . . . . 0.0 112.343 176.262 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 5.2 ptmt -131.4 -25.12 2.21 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 114.067 -1.424 . . . . 0.0 108.541 170.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 777' ' ' ALA . . . . . 0.48 ' HB3' ' HB2' ' A' ' 780' ' ' GLU . . . -95.81 163.98 19.88 Favored Pre-proline 0 C--O 1.235 0.34 0 CA-C-N 114.812 -1.086 . . . . 0.0 109.511 175.644 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -68.04 70.82 0.85 Allowed 'Trans proline' 0 CA--C 1.533 0.463 0 C-N-CA 122.726 2.284 . . . . 0.0 113.237 -178.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 117.44 18.08 5.46 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.672 -0.775 . . . . 0.0 113.162 175.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 780' ' ' GLU . . . . . 0.48 ' HB2' ' HB3' ' A' ' 777' ' ' ALA . 2.2 tt0 -94.28 125.83 39.15 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 179.608 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 22.4 m95 -133.38 136.77 45.51 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . 0.421 HG23 ' HB3' ' A' ' 774' ' ' LEU . 27.9 m -134.35 161.71 40.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.824 174.523 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 783' ' ' HIS . . . . . . . . . . . . . 4.6 t-160 -172.98 146.34 1.5 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.582 174.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 784' ' ' SER . . . . . 0.828 ' HB3' ' HA ' ' A' ' 767' ' ' ARG . 0.9 OUTLIER -100.22 100.36 11.18 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 173.52 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -162.65 177.43 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.53 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -121.03 63.43 0.87 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.483 177.551 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 787' ' ' ALA . . . . . 0.411 ' HB2' ' CD2' ' A' ' 721' ' ' PHE . . . 54.75 68.44 2.62 Favored Pre-proline 0 N--CA 1.468 0.427 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.75 178.382 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 788' ' ' PRO . . . . . 0.828 ' HG2' ' HG2' ' A' ' 790' ' ' GLU . 76.5 Cg_endo -89.08 41.24 0.54 Allowed 'Trans proline' 0 N--CA 1.46 -0.443 0 C-N-CA 122.936 2.424 . . . . 0.0 112.978 -177.601 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 73.78 -28.17 0.19 Allowed 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 175.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 790' ' ' GLU . . . . . 0.828 ' HG2' ' HG2' ' A' ' 788' ' ' PRO . 1.2 pt-20 -65.68 -37.88 87.7 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.084 0.402 . . . . 0.0 112.084 -176.295 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 791' ' ' LEU . . . . . 0.462 ' N ' ' HG3' ' A' ' 790' ' ' GLU . 0.2 OUTLIER -67.04 -55.0 17.31 Favored Pre-proline 0 C--N 1.327 -0.375 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -177.491 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 792' ' ' PRO . . . . . 0.462 ' HD3' HD23 ' A' ' 722' ' ' LEU . 9.7 Cg_endo -55.35 -34.1 87.61 Favored 'Trans proline' 0 C--N 1.354 0.856 0 C-N-CA 121.854 1.703 . . . . 0.0 112.238 176.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -67.86 -44.45 77.06 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 120.96 0.41 . . . . 0.0 110.725 177.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 794' ' ' LEU . . . . . 0.4 ' O ' ' HB ' ' A' ' 798' ' ' ILE . 0.1 OUTLIER -63.36 -39.63 95.06 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.364 178.505 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 795' ' ' LEU . . . . . 0.884 HD11 HG22 ' A' ' 746' ' ' VAL . 0.0 OUTLIER -62.06 -34.68 76.71 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.812 179.646 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -62.85 -53.42 54.4 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.297 179.052 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 797' ' ' ARG . . . . . 0.59 ' HA ' HD11 ' A' ' 800' ' ' LEU . 0.0 OUTLIER -72.04 -21.56 61.52 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.944 0.402 . . . . 0.0 111.2 -179.449 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 798' ' ' ILE . . . . . 0.4 ' HB ' ' O ' ' A' ' 794' ' ' LEU . 0.1 OUTLIER -69.25 -28.42 38.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 121.186 0.517 . . . . 0.0 109.893 175.758 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -80.85 -61.14 2.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.663 173.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 800' ' ' LEU . . . . . 0.59 HD11 ' HA ' ' A' ' 797' ' ' ARG . 2.5 tp 50.34 79.6 0.08 Allowed 'General case' 0 N--CA 1.468 0.432 0 O-C-N 124.233 0.958 . . . . 0.0 111.819 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 801' ' ' ILE . . . . . 0.73 HD13 ' HB2' ' A' ' 704' ' ' LEU . 13.5 mt -112.34 -38.17 2.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.837 177.4 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 802' ' ' GLU . . . . . 0.415 ' H ' ' HG ' ' A' ' 704' ' ' LEU . 0.5 OUTLIER 41.64 50.85 3.9 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 124.194 0.934 . . . . 0.0 111.467 177.681 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 803' ' ' MET . . . . . 0.683 ' HB2' HG22 ' A' ' 801' ' ' ILE . 0.8 OUTLIER -105.26 -178.4 3.64 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.232 -0.895 . . . . 0.0 111.288 -172.307 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 804' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 69.21 -167.28 0.18 Allowed 'General case' 0 C--O 1.233 0.233 0 O-C-N 123.819 0.699 . . . . 0.0 111.306 175.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -68.83 103.1 1.7 Allowed 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 121.076 0.465 . . . . 0.0 110.097 176.123 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -68.81 102.08 1.47 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.354 179.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -64.12 135.33 96.27 Favored Pre-proline 0 C--N 1.322 -0.594 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.718 177.014 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 808' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -72.71 48.59 1.37 Allowed 'Trans proline' 0 CA--C 1.529 0.257 0 C-N-CA 122.716 2.278 . . . . 0.0 112.84 -179.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -89.93 25.07 2.21 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.118 0.485 . . . . 0.0 110.556 179.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -62.2 125.27 23.31 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.833 -0.622 . . . . 0.0 110.038 178.308 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -69.41 158.43 35.14 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.211 -176.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -100.65 106.5 43.73 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.56 176.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -79.15 55.01 5.44 Favored 'Trans proline' 0 N--CA 1.459 -0.505 0 C-N-CA 123.31 2.674 . . . . 0.0 112.19 -177.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.07 77.22 2.24 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.26 0.552 . . . . 0.0 110.302 178.388 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 815' ' ' THR . . . . . 0.613 HG22 ' HE2' ' A' ' 817' ' ' LYS . 2.2 t -157.59 11.45 0.2 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.864 -179.254 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 816' ' ' ASP . . . . . 0.487 ' HB3' ' H ' ' A' ' 817' ' ' LYS . 0.8 OUTLIER 59.95 -101.58 0.12 Allowed 'General case' 0 C--O 1.233 0.218 0 CA-C-N 114.733 -1.121 . . . . 0.0 111.316 -178.217 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 817' ' ' LYS . . . . . 0.613 ' HE2' HG22 ' A' ' 815' ' ' THR . 0.3 OUTLIER 57.25 32.59 21.99 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.255 0.55 . . . . 0.0 111.156 -179.481 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 818' ' ' ALA . . . . . 0.414 ' C ' ' H ' ' A' ' 820' ' ' SER . . . -79.53 79.06 6.04 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.128 178.146 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 819' ' ' VAL . . . . . 0.476 ' H ' HG21 ' A' ' 819' ' ' VAL . 0.0 OUTLIER -77.62 25.23 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.782 -177.872 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 820' ' ' SER . . . . . 0.414 ' H ' ' C ' ' A' ' 818' ' ' ALA . 1.2 m 52.75 73.23 0.36 Allowed 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.081 0.467 . . . . 0.0 110.418 -176.437 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -56.63 123.15 13.89 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.385 -178.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 19.6 t30 -68.81 -47.72 65.38 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.612 -173.085 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -116.87 148.27 41.44 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.262 0.553 . . . . 0.0 112.098 -172.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -144.9 30.22 1.18 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.777 -1.101 . . . . 0.0 108.849 171.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 825' ' ' MET . . . . . 0.527 ' HG2' HD13 ' A' ' 827' ' ' ILE . 9.3 ttt -88.04 111.77 21.9 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.591 178.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 826' ' ' MET . . . . . 0.571 ' HE2' ' HB2' ' A' ' 852' ' ' LYS . 0.9 OUTLIER -94.82 122.76 37.77 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.516 0.674 . . . . 0.0 111.367 -172.192 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 827' ' ' ILE . . . . . 0.527 HD13 ' HG2' ' A' ' 825' ' ' MET . 1.5 mm -115.11 125.39 72.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.529 176.018 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 828' ' ' LEU . . . . . 0.429 HD13 ' CG1' ' A' ' 863' ' ' VAL . 0.8 OUTLIER -93.42 115.95 28.49 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.625 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 829' ' ' VAL . . . . . 0.717 ' HB ' HG21 ' A' ' 853' ' ' THR . 0.0 OUTLIER -103.02 97.51 5.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.93 179.944 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 830' ' ' VAL . . . . . 0.483 ' H ' HG22 ' A' ' 830' ' ' VAL . 0.0 OUTLIER -113.54 112.65 41.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.17 -179.476 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 831' ' ' ASP . . . . . 0.676 ' HB2' ' HB3' ' A' ' 875' ' ' ASP . 0.0 OUTLIER -127.22 161.98 27.27 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.942 -175.534 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 832' ' ' ASP . . . . . 0.44 ' CG ' ' H ' ' A' ' 877' ' ' ASN . 1.6 p-10 -96.24 -13.64 23.27 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -175.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -122.25 102.49 39.95 Favored Pre-proline 0 C--N 1.322 -0.601 0 O-C-N 122.343 -0.223 . . . . 0.0 110.778 -175.456 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 834' ' ' PRO . . . . . 0.478 ' HB2' ' HB2' ' A' ' 743' ' ' PRO . 92.7 Cg_exo -42.82 -37.31 5.83 Favored 'Trans proline' 0 CA--C 1.533 0.47 0 C-N-CA 124.054 3.169 . . . . 0.0 114.776 -172.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -65.18 -36.54 78.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-O 121.096 0.474 . . . . 0.0 110.904 179.265 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 836' ' ' ASN . . . . . 0.624 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 0.7 OUTLIER -74.86 -40.72 60.83 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 179.039 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 837' ' ' ARG . . . . . 0.64 ' HG2' HG22 ' A' ' 853' ' ' THR . 3.9 ttt-85 -52.36 -41.25 62.92 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.431 177.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 1.3 tmm_? -67.4 -41.76 84.38 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.448 177.004 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 2.7 mt -63.8 -50.82 67.46 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.351 -176.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 840' ' ' LEU . . . . . 0.624 ' HG ' ' O ' ' A' ' 836' ' ' ASN . 0.0 OUTLIER -69.15 -32.21 71.41 Favored 'General case' 0 CA--C 1.517 -0.302 0 O-C-N 121.997 -0.439 . . . . 0.0 110.623 -178.621 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 841' ' ' ALA . . . . . 0.527 ' HB3' ' O ' ' A' ' 837' ' ' ARG . . . -65.08 -45.99 83.0 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 120.957 0.408 . . . . 0.0 110.49 177.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -62.75 -42.43 99.67 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.403 178.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 843' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -62.68 -40.97 98.76 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.886 178.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 844' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.52 -32.55 74.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.155 0.503 . . . . 0.0 109.762 176.667 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -66.9 -36.56 91.25 Favored Glycine 0 N--CA 1.446 -0.638 0 CA-C-N 115.489 -0.778 . . . . 0.0 112.027 174.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.24 -29.34 70.45 Favored 'General case' 0 N--CA 1.456 -0.138 0 CA-C-O 120.952 0.406 . . . . 0.0 110.494 176.748 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 847' ' ' LEU . . . . . 0.485 HD21 ' HA ' ' A' ' 847' ' ' LEU . 5.8 mt -74.62 -52.01 12.9 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.214 -0.448 . . . . 0.0 109.938 174.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 103.6 42.82 1.93 Allowed Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.641 176.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 1.7 m-30 -113.32 165.94 11.95 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.74 129.75 38.56 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 176.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.61 147.86 41.68 Favored 'General case' 0 C--N 1.321 -0.665 0 C-N-CA 120.584 -0.446 . . . . 0.0 111.35 -176.59 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 852' ' ' LYS . . . . . 0.571 ' HB2' ' HE2' ' A' ' 826' ' ' MET . 0.1 OUTLIER -127.84 109.59 11.77 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 173.54 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 853' ' ' THR . . . . . 0.717 HG21 ' HB ' ' A' ' 829' ' ' VAL . 0.2 OUTLIER -102.42 114.73 29.17 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -173.053 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 854' ' ' ALA . . . . . . . . . . . . . . . -134.24 178.83 6.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.156 179.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 20.1 p-10 -139.52 75.26 1.5 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.804 0.812 . . . . 0.0 111.239 179.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 856' ' ' ASP . . . . . 0.412 ' O ' HG11 ' A' ' 830' ' ' VAL . 27.9 t70 -172.17 159.13 4.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.577 176.146 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -94.14 -44.66 3.49 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.421 -0.895 . . . . 0.0 113.098 -177.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 2.0 p -75.22 -34.03 30.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 117.173 0.487 . . . . 0.0 111.947 -173.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.51 -20.34 62.85 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 120.94 -0.304 . . . . 0.0 110.687 179.266 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -63.66 -38.65 91.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.02 0.438 . . . . 0.0 109.971 174.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 861' ' ' LEU . . . . . 0.417 HD12 ' HB3' ' A' ' 889' ' ' ARG . 0.0 OUTLIER -69.13 -38.41 78.83 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.975 176.373 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 14.1 t30 -59.07 -52.88 63.82 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.028 177.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 863' ' ' VAL . . . . . 0.429 ' CG1' HD13 ' A' ' 828' ' ' LEU . 0.4 OUTLIER -65.73 -31.59 54.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.855 179.022 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 864' ' ' LEU . . . . . 0.588 ' HA ' HD11 ' A' ' 869' ' ' ILE . 0.8 OUTLIER -58.42 -34.32 70.65 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.176 0.512 . . . . 0.0 110.763 177.017 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 1.3 m -92.15 -17.06 25.44 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.604 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 1.1 mmmm -101.88 -2.76 29.2 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -174.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -162.04 161.04 28.22 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 -178.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 868' ' ' HIS . . . . . 0.558 ' O ' ' HG2' ' A' ' 826' ' ' MET . 0.0 OUTLIER -78.96 137.8 37.77 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 110.344 -0.243 . . . . 0.0 110.344 -178.306 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 869' ' ' ILE . . . . . 0.588 HD11 ' HA ' ' A' ' 864' ' ' LEU . 6.7 mt -135.27 142.47 39.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.525 178.572 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 870' ' ' ASP . . . . . 0.406 ' N ' HG21 ' A' ' 869' ' ' ILE . 4.5 m-20 -99.6 -62.95 1.17 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.829 177.779 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 871' ' ' ILE . . . . . . . . . . . . . 18.0 mm -121.61 140.74 44.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.215 178.234 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 872' ' ' VAL . . . . . 0.529 HG21 HG23 ' A' ' 869' ' ' ILE . 55.5 t -119.13 122.04 68.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 175.628 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 873' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -112.15 122.49 47.89 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 178.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -109.83 104.19 13.1 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.05 179.729 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 875' ' ' ASP . . . . . 0.676 ' HB3' ' HB2' ' A' ' 831' ' ' ASP . 37.5 t0 -97.46 112.09 24.08 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.061 -176.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 876' ' ' VAL . . . . . 0.402 ' O ' ' HA ' ' A' ' 903' ' ' THR . 1.1 t -128.38 124.89 62.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.48 0.657 . . . . 0.0 112.223 -172.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 877' ' ' ASN . . . . . 0.44 ' H ' ' CG ' ' A' ' 832' ' ' ASP . 1.3 t30 -98.94 -38.87 8.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.098 -0.955 . . . . 0.0 109.24 171.631 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 878' ' ' MET . . . . . 0.898 ' HG2' ' HD2' ' A' ' 879' ' ' PRO . 0.1 OUTLIER -116.6 145.75 36.02 Favored Pre-proline 0 C--N 1.323 -0.571 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.642 177.31 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 879' ' ' PRO . . . . . 0.898 ' HD2' ' HG2' ' A' ' 878' ' ' MET . 18.1 Cg_endo -60.62 -7.99 8.28 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.869 2.38 . . . . 0.0 112.929 177.332 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 880' ' ' ASN . . . . . 0.461 ' HB3' ' O ' ' A' ' 879' ' ' PRO . 5.4 t30 75.29 -62.77 0.44 Allowed 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.493 0.717 . . . . 0.0 111.318 175.384 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 21.7 ttm -172.7 -69.07 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 -178.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -81.09 -117.94 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.368 175.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . 135.54 -3.46 3.93 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.353 -0.927 . . . . 0.0 113.173 173.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 23.2 p90 -126.51 -33.2 2.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 117.289 0.544 . . . . 0.0 111.077 -177.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 885' ' ' ARG . . . . . 0.691 ' O ' ' HB2' ' A' ' 889' ' ' ARG . 0.0 OUTLIER -60.22 -32.67 71.34 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.12 -178.777 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.32 -46.95 75.13 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.675 0.274 . . . . 0.0 110.694 -177.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.22 -37.48 61.08 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.063 0.459 . . . . 0.0 111.236 -176.701 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 -70.95 -47.24 60.1 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.823 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 889' ' ' ARG . . . . . 0.691 ' HB2' ' O ' ' A' ' 885' ' ' ARG . 0.0 OUTLIER -62.88 -39.12 93.49 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.394 -178.708 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 890' ' ' ILE . . . . . . . . . . . . . 4.3 tt -67.63 -40.38 83.99 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 C-N-CA 120.769 -0.373 . . . . 0.0 111.116 -178.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 891' ' ' ARG . . . . . 0.494 ' HA ' ' CB ' ' A' ' 895' ' ' LEU . 2.5 ptm180 -75.82 -23.87 55.81 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 120.74 0.305 . . . . 0.0 110.807 178.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -74.44 -44.3 52.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.868 -179.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 1.2 mt -67.85 -44.52 76.94 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.953 -178.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 155.76 67.41 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.399 178.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 895' ' ' LEU . . . . . 0.494 ' CB ' ' HA ' ' A' ' 891' ' ' ARG . 3.6 tp -76.12 111.27 11.35 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.794 0.331 . . . . 0.0 110.556 179.296 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -134.62 25.01 3.73 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.244 0.545 . . . . 0.0 110.339 177.295 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 897' ' ' LEU . . . . . 0.407 ' HA ' ' HD3' ' A' ' 898' ' ' PRO . 0.4 OUTLIER -135.76 150.13 70.91 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.863 -177.857 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 898' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 897' ' ' LEU . 14.4 Cg_exo -69.47 118.4 5.66 Favored 'Trans proline' 0 C--O 1.236 0.396 0 C-N-CA 122.812 2.341 . . . . 0.0 112.742 -178.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 899' ' ' VAL . . . . . 0.778 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 94.6 t -104.15 117.8 50.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 121.087 0.47 . . . . 0.0 109.905 175.567 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 900' ' ' ILE . . . . . 0.556 HG21 ' HB2' ' A' ' 921' ' ' SER . 5.9 mt -90.69 107.58 18.69 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.241 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 901' ' ' GLY . . . . . 0.556 ' O ' ' HA ' ' A' ' 922' ' ' CYS . . . -91.19 113.95 4.4 Favored Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.835 -0.698 . . . . 0.0 111.828 179.38 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 902' ' ' VAL . . . . . 0.499 ' HA ' ' O ' ' A' ' 923' ' ' LEU . 0.3 OUTLIER -113.47 130.63 67.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 -179.9 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 903' ' ' THR . . . . . 0.503 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.3 OUTLIER -131.08 160.97 33.11 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.7 -177.422 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -121.58 105.28 10.3 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.68 0.276 . . . . 0.0 111.582 -178.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 8.3 t30 61.14 51.33 4.45 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.559 172.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -90.46 -27.09 19.48 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 175.308 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 907' ' ' LEU . . . . . 0.481 HD13 ' HA ' ' A' ' 907' ' ' LEU . 0.0 OUTLIER 65.57 20.48 11.64 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.883 174.26 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -161.63 30.76 0.13 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.246 -0.888 . . . . 0.0 108.785 178.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.31 -34.36 77.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.884 -1.053 . . . . 0.0 111.182 -173.279 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 910' ' ' GLU . . . . . 0.59 ' HG2' ' N ' ' A' ' 911' ' ' LYS . 1.6 pm0 -67.6 -45.0 76.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.978 0.418 . . . . 0.0 110.52 -179.434 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 911' ' ' LYS . . . . . 0.59 ' N ' ' HG2' ' A' ' 910' ' ' GLU . 0.1 OUTLIER -72.29 -31.85 66.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.914 -177.926 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.02 -43.23 79.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.106 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 913' ' ' ARG . . . . . 0.495 ' HG3' ' N ' ' A' ' 914' ' ' CYS . 0.0 OUTLIER -66.64 -35.3 79.84 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 121.144 -0.222 . . . . 0.0 110.747 -179.663 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 914' ' ' CYS . . . . . 0.495 ' N ' ' HG3' ' A' ' 913' ' ' ARG . 91.3 m -72.4 -35.93 68.54 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.868 0.366 . . . . 0.0 110.648 178.343 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 1.1 tp -65.87 -41.42 91.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.102 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -75.2 -40.1 59.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.019 -179.38 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 50.45 45.16 26.7 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.909 177.758 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -145.09 25.59 1.9 Allowed Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.422 -178.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 919' ' ' MET . . . . . 0.778 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -119.4 -111.46 0.34 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.559 0.179 . . . . 0.0 110.814 -177.832 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 920' ' ' ASP . . . . . 0.499 ' HB2' ' O ' ' A' ' 919' ' ' MET . 13.8 t70 167.0 -53.95 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.971 0.908 . . . . 0.0 109.673 176.653 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 921' ' ' SER . . . . . 0.556 ' HB2' HG21 ' A' ' 900' ' ' ILE . 0.0 OUTLIER -118.32 172.13 7.66 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.052 -177.717 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 922' ' ' CYS . . . . . 0.556 ' HA ' ' O ' ' A' ' 901' ' ' GLY . 0.5 OUTLIER -154.18 139.1 17.2 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.019 -179.513 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 923' ' ' LEU . . . . . 0.499 ' O ' ' HA ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -156.92 -175.47 5.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.772 175.178 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 924' ' ' SER . . . . . 0.503 ' HA ' ' O ' ' A' ' 903' ' ' THR . 0.5 OUTLIER -105.05 160.27 15.18 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.608 -179.059 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 925' ' ' LYS . . . . . 0.527 ' HB3' ' HD3' ' A' ' 926' ' ' PRO . 2.1 tttp -53.59 -48.36 93.34 Favored Pre-proline 0 CA--C 1.544 0.715 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 926' ' ' PRO . . . . . 0.527 ' HD3' ' HB3' ' A' ' 925' ' ' LYS . 31.8 Cg_exo -60.6 98.5 0.13 Allowed 'Trans proline' 0 C--N 1.357 0.981 0 C-N-CA 122.101 1.867 . . . . 0.0 112.53 175.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 927' ' ' VAL . . . . . 0.658 HG13 HG12 ' A' ' 932' ' ' ILE . 19.8 t -134.74 125.7 46.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.825 179.224 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -88.7 173.84 8.36 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.696 -0.229 . . . . 0.0 110.751 177.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 929' ' ' LEU . . . . . 0.476 HD22 ' HA ' ' A' ' 929' ' ' LEU . 0.5 OUTLIER -61.13 -32.67 72.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.621 0.248 . . . . 0.0 110.76 -179.129 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -70.9 -39.03 73.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.883 0.373 . . . . 0.0 110.38 -178.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 931' ' ' VAL . . . . . 0.416 ' HB ' HG12 ' A' ' 927' ' ' VAL . 46.8 t -70.59 -41.24 77.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.306 178.173 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 932' ' ' ILE . . . . . 0.658 HG12 HG13 ' A' ' 927' ' ' VAL . 0.3 OUTLIER -61.77 -41.46 90.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 109.97 -0.382 . . . . 0.0 109.97 177.308 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 933' ' ' LYS . . . . . 0.475 ' N ' HG23 ' A' ' 932' ' ' ILE . 0.0 OUTLIER -66.87 -48.9 67.37 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.213 -177.776 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 934' ' ' GLN . . . . . 0.525 ' O ' ' HB2' ' A' ' 938' ' ' LEU . 0.0 OUTLIER -64.02 -31.71 73.0 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 121.22 -0.192 . . . . 0.0 111.225 -176.751 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 15.8 m -74.52 -46.41 39.36 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 120.687 0.279 . . . . 0.0 111.008 178.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 936' ' ' LEU . . . . . 0.516 HD13 ' HA ' ' A' ' 936' ' ' LEU . 0.0 OUTLIER -63.5 -43.18 97.99 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.496 -179.943 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 37.6 m -66.61 -41.09 88.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.544 179.057 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 938' ' ' LEU . . . . . 0.525 ' HB2' ' O ' ' A' ' 934' ' ' GLN . 0.3 OUTLIER -59.53 -46.11 89.83 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.333 0.587 . . . . 0.0 110.607 179.251 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -77.76 -25.36 49.06 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.245 -177.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -62.86 -39.72 95.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.903 0.382 . . . . 0.0 110.386 174.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 941' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.26 -34.85 71.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.137 177.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 942' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.06 -47.89 75.72 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.772 179.133 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 35.4 m -71.25 -28.49 32.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.651 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.74 -50.54 71.92 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.827 177.359 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 945' ' ' LYS . . . . . 0.507 ' H ' ' HG2' ' A' ' 945' ' ' LYS . 0.0 OUTLIER -77.31 -22.67 51.6 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.789 0.328 . . . . 0.0 111.392 -178.97 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 49.3 m -73.6 -29.86 62.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.921 0.391 . . . . 0.0 110.724 177.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -95.83 -61.51 1.44 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.675 -178.749 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -88.19 122.14 31.4 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.785 -178.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 3.4 m . . . . . 0 C--O 1.251 1.152 0 CA-C-O 118.326 -0.845 . . . . 0.0 110.229 -178.374 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.048 0 CA-C-O 120.905 0.383 . . . . 0.0 110.367 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 162.12 -167.21 36.68 Favored Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 120.998 -0.62 . . . . 0.0 112.156 177.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . -86.03 77.03 2.08 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.8 -0.714 . . . . 0.0 111.974 179.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.77 136.64 58.13 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.554 0.216 . . . . 0.0 110.894 179.743 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . -59.34 111.59 3.54 Favored Glycine 0 N--CA 1.451 -0.35 0 CA-C-N 115.969 -0.559 . . . . 0.0 112.553 -178.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 2.6 p -88.92 112.82 24.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.355 0.598 . . . . 0.0 110.902 -178.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -162.8 160.23 24.99 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.912 177.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . 158.01 -71.33 0.25 Allowed Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.928 -0.653 . . . . 0.0 111.615 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 13.7 mt 53.56 35.0 19.78 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 122.845 0.458 . . . . 0.0 111.582 178.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 705' ' ' SER . . . . . 0.441 ' HA ' ' HA3' ' A' ' 730' ' ' GLY . 0.5 OUTLIER -112.64 135.45 53.35 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.719 0.295 . . . . 0.0 110.665 -179.33 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 116.1 -25.94 9.07 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.148 177.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 707' ' ' LYS . . . . . 0.512 ' HA ' ' HD2' ' A' ' 707' ' ' LYS . 10.2 mmmt -69.78 132.75 46.56 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 176.51 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 708' ' ' ARG . . . . . 0.437 ' HA ' HG21 ' A' ' 732' ' ' VAL . 24.9 mtt85 -100.61 161.56 13.51 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.478 0.656 . . . . 0.0 111.33 -173.542 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 1.1 m -136.78 113.85 10.59 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.253 -0.885 . . . . 0.0 108.722 173.038 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 710' ' ' TRP . . . . . 0.461 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 87.8 m95 -90.5 112.57 24.28 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.401 0.619 . . . . 0.0 110.153 -173.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 711' ' ' LEU . . . . . 0.42 HD13 ' HB2' ' A' ' 719' ' ' CYS . 0.4 OUTLIER -111.83 119.84 39.93 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.109 -0.95 . . . . 0.0 111.061 -170.194 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -126.66 63.84 1.28 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.825 177.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 713' ' ' VAL . . . . . 0.707 HG12 ' HB3' ' A' ' 750' ' ' ASP . 90.4 t -117.27 121.42 67.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.273 -179.239 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 13.8 mtt85 -71.81 -34.0 68.98 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.589 -179.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -69.7 108.01 3.71 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.525 178.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 716' ' ' ALA . . . . . 0.581 ' O ' ' HB2' ' A' ' 720' ' ' GLN . . . -65.15 -32.31 73.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.829 -174.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.11 -44.97 78.58 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.304 0.573 . . . . 0.0 110.344 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.93 -49.04 64.17 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.774 177.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 719' ' ' CYS . . . . . 0.578 ' SG ' ' HA ' ' A' ' 716' ' ' ALA . 3.0 p -63.73 -42.46 97.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.999 -175.744 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 720' ' ' GLN . . . . . 0.581 ' HB2' ' O ' ' A' ' 716' ' ' ALA . 0.1 OUTLIER -65.47 -36.73 84.76 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 111.568 0.21 . . . . 0.0 111.568 -179.26 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -55.44 -59.27 5.05 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.925 0.393 . . . . 0.0 110.508 178.641 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 722' ' ' LEU . . . . . 0.41 HD23 ' HD3' ' A' ' 792' ' ' PRO . 6.9 mt -65.38 -47.26 77.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.28 -178.443 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 723' ' ' GLU . . . . . 0.526 ' HB3' ' O ' ' A' ' 719' ' ' CYS . 0.1 OUTLIER -60.11 -48.47 81.57 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.337 -174.411 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 724' ' ' THR . . . . . . . . . . . . . 45.7 m -67.36 -36.4 81.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.186 -177.109 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 42.9 m -68.27 -37.34 80.62 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.787 0.327 . . . . 0.0 111.297 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 726' ' ' LEU . . . . . . . . . . . . . 14.2 mt -76.51 -38.13 55.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.443 -175.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 2.5 pp0? -74.77 0.44 15.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.621 0.248 . . . . 0.0 111.531 -178.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 2.2 mtm180 -64.27 -35.18 80.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.824 0.345 . . . . 0.0 110.204 178.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 729' ' ' SER . . . . . 0.429 ' HB2' ' H ' ' A' ' 730' ' ' GLY . 0.0 OUTLIER -93.32 -100.24 0.14 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.26 177.418 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 730' ' ' GLY . . . . . 0.441 ' HA3' ' HA ' ' A' ' 705' ' ' SER . . . -143.46 20.97 2.23 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.802 -0.713 . . . . 0.0 111.717 178.721 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 731' ' ' ILE . . . . . . . . . . . . . 20.6 mm -83.32 116.21 27.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.925 0.393 . . . . 0.0 110.226 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 732' ' ' VAL . . . . . 0.437 HG21 ' HA ' ' A' ' 708' ' ' ARG . 0.0 OUTLIER -87.19 97.29 6.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.118 0.485 . . . . 0.0 110.966 -176.64 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 733' ' ' VAL . . . . . 0.403 HG21 ' HA ' ' A' ' 723' ' ' GLU . 6.1 t -77.34 135.85 25.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.556 176.134 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -143.98 135.33 25.77 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.823 0.344 . . . . 0.0 111.219 -173.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.17 112.61 1.59 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.937 176.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 736' ' ' TYR . . . . . 0.461 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 66.7 t80 -90.24 99.33 12.37 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.984 -176.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 737' ' ' GLU . . . . . 0.422 ' H ' ' HG3' ' A' ' 737' ' ' GLU . 0.0 OUTLIER -103.23 -51.21 3.29 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 173.167 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -160.41 75.57 0.19 Allowed Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.907 -0.663 . . . . 0.0 111.91 175.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 739' ' ' GLN . . . . . 0.438 ' HG2' ' CZ3' ' A' ' 710' ' ' TRP . 1.2 mp0 -111.93 -161.39 0.75 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.475 0.178 . . . . 0.0 110.74 -178.24 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -104.48 136.54 19.16 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.364 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 741' ' ' PRO . . . . . 0.469 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 64.8 Cg_endo -84.04 123.35 3.12 Favored 'Trans proline' 0 N--CA 1.454 -0.845 0 C-N-CA 122.473 2.115 . . . . 0.0 111.894 176.421 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 742' ' ' THR . . . . . 0.55 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.1 OUTLIER -96.77 140.64 22.24 Favored Pre-proline 0 C--N 1.316 -0.889 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.863 176.886 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 743' ' ' PRO . . . . . 0.55 ' HD2' HG22 ' A' ' 742' ' ' THR . 28.3 Cg_endo -61.87 -13.67 32.19 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 123.171 2.581 . . . . 0.0 113.306 -173.818 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 744' ' ' GLU . . . . . 0.497 ' HG2' ' H ' ' A' ' 819' ' ' VAL . 0.0 OUTLIER -116.36 5.87 13.6 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.031 178.888 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -102.09 153.78 19.6 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 120.979 0.419 . . . . 0.0 110.458 -177.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 746' ' ' VAL . . . . . 0.846 HG21 HD13 ' A' ' 795' ' ' LEU . 26.9 m -117.49 147.98 20.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 121.323 0.583 . . . . 0.0 111.927 -175.085 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 747' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -106.53 125.5 51.08 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.861 175.833 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 748' ' ' ILE . . . . . 0.446 HD12 HG22 ' A' ' 748' ' ' ILE . 2.5 mm -113.97 107.11 22.08 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 175.456 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 749' ' ' THR . . . . . 0.43 ' OG1' HG23 ' A' ' 753' ' ' VAL . 1.8 t -118.1 153.26 34.07 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.73 -0.214 . . . . 0.0 110.747 -176.787 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 750' ' ' ASP . . . . . 0.707 ' HB3' HG12 ' A' ' 713' ' ' VAL . 1.6 p-10 -100.9 146.76 26.94 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.587 -0.279 . . . . 0.0 110.475 175.146 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 61.88 -170.88 0.16 Allowed 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.768 178.263 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 752' ' ' VAL . . . . . . . . . . . . . 9.7 t -82.44 126.65 40.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.161 177.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 753' ' ' VAL . . . . . 0.43 HG23 ' OG1' ' A' ' 749' ' ' THR . 5.4 m -132.36 157.53 43.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.059 -179.599 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.57 76.09 10.21 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.911 0.386 . . . . 0.0 110.168 176.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.5 149.58 36.17 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.005 -177.696 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 11.6 tptt -121.55 -36.13 3.11 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.595 175.076 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 757' ' ' TRP . . . . . 0.469 ' CH2' ' HA ' ' A' ' 741' ' ' PRO . 68.0 t-105 69.27 95.89 0.07 Allowed 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.342 176.661 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -83.96 51.12 1.97 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.255 0.55 . . . . 0.0 110.402 177.681 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 759' ' ' GLY . . . . . . . . . . . . . . . -121.26 -135.07 4.72 Favored Glycine 0 N--CA 1.444 -0.778 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.667 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 3.3 ttt-85 -81.58 -60.94 2.08 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.94 0.4 . . . . 0.0 111.24 178.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -158.31 148.34 19.93 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.947 -176.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 4.5 p -117.9 127.47 75.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-O 121.41 0.624 . . . . 0.0 110.234 176.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 763' ' ' VAL . . . . . 0.615 HG11 HD23 ' A' ' 791' ' ' LEU . 46.2 t -111.27 122.23 65.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.761 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.722 177.443 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 764' ' ' THR . . . . . 0.71 HG22 ' HG ' ' A' ' 766' ' ' CYS . 3.9 m -107.7 116.54 32.13 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.436 -176.189 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 765' ' ' PHE . . . . . 0.48 ' HE1' HG21 ' A' ' 785' ' ' VAL . 12.3 m-85 -90.24 83.86 6.02 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.609 174.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 766' ' ' CYS . . . . . 0.71 ' HG ' HG22 ' A' ' 764' ' ' THR . 0.0 OUTLIER -96.38 131.34 43.03 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 -177.431 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.25 -30.24 5.66 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.886 0.374 . . . . 0.0 110.787 -175.576 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 13.2 mmm180 -102.09 -59.02 1.77 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.928 -179.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -116.56 133.35 56.12 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.87 -176.818 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 3.2 mp -117.71 91.27 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 121.203 0.525 . . . . 0.0 109.739 176.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -135.02 11.56 4.47 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.03 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 772' ' ' ILE . . . . . 0.619 HG12 ' HD2' ' A' ' 773' ' ' PRO . 0.1 OUTLIER -96.49 152.56 38.72 Favored Pre-proline 0 C--N 1.324 -0.521 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 -178.536 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 773' ' ' PRO . . . . . 0.619 ' HD2' HG12 ' A' ' 772' ' ' ILE . 84.7 Cg_exo -49.63 118.62 3.89 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 123.105 2.537 . . . . 0.0 113.005 178.521 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . 0.58 ' HB2' HG22 ' A' ' 782' ' ' VAL . 0.6 OUTLIER -98.19 -168.22 1.62 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.534 178.98 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 775' ' ' GLU . . . . . 0.553 ' HG3' ' HA ' ' A' ' 781' ' ' TRP . 1.3 mp0 -63.96 72.99 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 121.793 0.806 . . . . 0.0 112.874 178.339 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -129.62 6.09 5.16 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 114.751 -1.113 . . . . 0.0 108.532 169.199 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -139.96 162.99 47.43 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 114.296 -1.32 . . . . 0.0 108.751 179.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -80.13 36.11 0.6 Allowed 'Trans proline' 0 CA--C 1.53 0.323 0 C-N-CA 122.414 2.076 . . . . 0.0 113.255 -175.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 177.32 31.53 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.246 -0.978 . . . . 0.0 112.72 -179.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 780' ' ' GLU . . . . . 0.465 ' HG2' ' HB2' ' A' ' 773' ' ' PRO . 0.9 OUTLIER -137.68 123.37 19.86 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 179.798 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 781' ' ' TRP . . . . . 0.553 ' HA ' ' HG3' ' A' ' 775' ' ' GLU . 25.2 m95 -137.55 143.86 41.79 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 123.188 0.305 . . . . 0.0 110.243 -177.336 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . 0.58 HG22 ' HB2' ' A' ' 774' ' ' LEU . 35.7 m -126.34 146.96 31.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 120.872 0.367 . . . . 0.0 110.516 171.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 783' ' ' HIS . . . . . 0.458 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 2.1 t-160 -160.64 138.73 9.79 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.828 0.347 . . . . 0.0 110.71 175.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 1.7 m -105.33 100.64 10.22 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.579 174.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 785' ' ' VAL . . . . . 0.48 HG21 ' HE1' ' A' ' 765' ' ' PHE . 0.0 OUTLIER -165.93 -176.76 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 178.323 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -111.66 31.65 6.01 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.867 0.365 . . . . 0.0 110.212 176.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 55.01 67.93 2.89 Favored Pre-proline 0 N--CA 1.467 0.383 0 CA-C-N 115.084 -0.962 . . . . 0.0 112.441 178.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 788' ' ' PRO . . . . . 0.552 ' HD2' ' OE1' ' A' ' 790' ' ' GLU . 16.9 Cg_exo -67.29 -66.21 0.04 OUTLIER 'Trans proline' 0 CA--C 1.529 0.255 0 C-N-CA 122.461 2.108 . . . . 0.0 111.955 179.096 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -170.39 24.32 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.937 0.399 . . . . 0.0 111.403 179.721 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 790' ' ' GLU . . . . . 0.552 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -104.45 -48.38 3.84 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.952 0.406 . . . . 0.0 110.212 -178.983 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 791' ' ' LEU . . . . . 0.615 HD23 HG11 ' A' ' 763' ' ' VAL . 0.4 OUTLIER -67.34 -47.54 48.6 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.622 179.794 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 792' ' ' PRO . . . . . 0.515 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 9.6 Cg_endo -57.98 -27.3 78.63 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 121.698 1.599 . . . . 0.0 111.952 175.192 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -76.19 -44.05 39.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.792 0.329 . . . . 0.0 110.599 177.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 794' ' ' LEU . . . . . 0.513 ' HA ' HD23 ' A' ' 794' ' ' LEU . 1.1 tm? -60.54 -42.69 97.02 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 121.166 0.507 . . . . 0.0 110.136 176.053 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 795' ' ' LEU . . . . . 0.846 HD13 HG21 ' A' ' 746' ' ' VAL . 0.2 OUTLIER -63.87 -39.06 93.32 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.602 179.343 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 796' ' ' ALA . . . . . 0.439 ' HB3' ' HB ' ' A' ' 801' ' ' ILE . . . -61.41 -47.3 86.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.362 175.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 797' ' ' ARG . . . . . 0.421 ' CZ ' ' HB2' ' A' ' 797' ' ' ARG . 0.0 OUTLIER -59.43 -41.92 90.68 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.058 179.375 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -75.56 -17.72 15.75 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.709 -177.361 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 2.3 m-30 -103.6 9.8 37.23 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.677 0.275 . . . . 0.0 110.66 178.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 95.4 mt 62.28 32.13 17.2 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.452 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 801' ' ' ILE . . . . . 0.439 ' HB ' ' HB3' ' A' ' 796' ' ' ALA . 59.8 mt -89.78 96.76 6.44 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.661 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 176.671 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -72.27 84.11 1.05 Allowed 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.406 -179.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 803' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.79 -0.86 11.66 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.235 -178.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 804' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -71.03 126.39 29.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.746 0.308 . . . . 0.0 110.301 178.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.46 -55.37 6.43 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.121 0.486 . . . . 0.0 110.314 178.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -158.95 -36.31 0.06 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.671 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 807' ' ' ASP . . . . . 0.411 ' HA ' ' HD3' ' A' ' 808' ' ' PRO . 10.1 t70 -44.75 113.09 1.63 Allowed Pre-proline 0 N--CA 1.465 0.323 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.622 177.611 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 808' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 807' ' ' ASP . 3.9 Cg_exo -77.68 58.68 6.5 Favored 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 123.454 2.77 . . . . 0.0 112.125 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -66.95 99.17 0.61 Allowed 'General case' 0 C--O 1.237 0.397 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.929 175.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -158.22 168.57 26.69 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.015 -175.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -145.99 -56.56 0.29 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.397 176.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 2.6 mt -130.49 116.95 17.51 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.321 174.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -63.35 89.7 0.14 Allowed 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.988 2.458 . . . . 0.0 112.176 -178.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 2.9 m -102.75 115.17 30.06 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.738 -179.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -124.08 94.06 4.11 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.047 178.731 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 816' ' ' ASP . . . . . 0.436 ' HB2' ' H ' ' A' ' 817' ' ' LYS . 1.0 OUTLIER -104.21 -140.04 0.36 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.736 -178.303 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 817' ' ' LYS . . . . . 0.436 ' H ' ' HB2' ' A' ' 816' ' ' ASP . 5.1 mptt -135.34 159.86 40.22 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 -175.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -150.03 152.66 35.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.722 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 819' ' ' VAL . . . . . 0.541 HG23 ' H ' ' A' ' 820' ' ' SER . 1.0 OUTLIER -131.65 176.14 9.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 179.832 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 820' ' ' SER . . . . . 0.541 ' H ' HG23 ' A' ' 819' ' ' VAL . 0.0 OUTLIER -120.33 165.63 14.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.693 0.282 . . . . 0.0 110.812 179.965 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 48.3 t0 -73.62 159.32 33.25 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.412 178.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -78.46 -68.5 0.64 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.343 -178.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -159.83 154.69 24.54 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.27 176.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -130.03 77.56 1.79 Allowed 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.072 0.463 . . . . 0.0 110.357 -171.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 825' ' ' MET . . . . . 0.424 ' HA ' ' OD2' ' A' ' 870' ' ' ASP . 0.0 OUTLIER -105.26 139.73 39.47 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.516 -179.852 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 826' ' ' MET . . . . . 0.686 ' HB2' ' HA ' ' A' ' 869' ' ' ILE . 0.0 OUTLIER -123.31 135.51 54.24 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.904 0.383 . . . . 0.0 110.75 177.574 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 827' ' ' ILE . . . . . 0.626 ' HB ' HD21 ' A' ' 844' ' ' LEU . 2.3 mm -120.02 120.34 62.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 176.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 828' ' ' LEU . . . . . 0.71 HD13 ' HB3' ' A' ' 852' ' ' LYS . 0.9 OUTLIER -105.2 123.48 47.91 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.78 0.324 . . . . 0.0 110.705 -178.759 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 829' ' ' VAL . . . . . 0.547 HG21 HD11 ' A' ' 840' ' ' LEU . 1.0 OUTLIER -102.29 118.81 49.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.092 0.472 . . . . 0.0 110.441 177.332 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 830' ' ' VAL . . . . . 0.471 ' HA ' ' O ' ' A' ' 854' ' ' ALA . 0.2 OUTLIER -109.22 86.98 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.75 177.594 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 831' ' ' ASP . . . . . 0.685 ' HA ' ' O ' ' A' ' 875' ' ' ASP . 0.1 OUTLIER -106.7 147.47 29.55 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.873 0.368 . . . . 0.0 110.883 -176.101 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -89.24 -25.64 21.62 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -175.743 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 833' ' ' HIS . . . . . 0.435 ' HA ' ' HD2' ' A' ' 834' ' ' PRO . 0.6 OUTLIER -114.71 106.21 52.39 Favored Pre-proline 0 N--CA 1.464 0.275 0 O-C-N 121.941 -0.475 . . . . 0.0 111.681 -174.167 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 834' ' ' PRO . . . . . 0.435 ' HD2' ' HA ' ' A' ' 833' ' ' HIS . 1.7 Cg_endo -40.75 -47.07 4.75 Favored 'Trans proline' 0 C--N 1.349 0.555 1 C-N-CA 125.319 4.013 . . . . 0.0 115.604 -169.59 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 1.1 pp -59.32 -38.78 76.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 CA-C-O 121.243 0.544 . . . . 0.0 111.164 -176.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 836' ' ' ASN . . . . . 0.574 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 3.2 m-80 -68.63 -46.46 69.18 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.669 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 837' ' ' ARG . . . . . 0.553 ' HB2' ' OD2' ' A' ' 831' ' ' ASP . 0.0 OUTLIER -52.49 -45.73 66.31 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.495 178.262 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -59.06 -41.81 88.83 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.166 -179.563 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.02 -53.55 25.02 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -176.484 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 840' ' ' LEU . . . . . 0.574 ' HG ' ' O ' ' A' ' 836' ' ' ASN . 0.0 OUTLIER -73.78 -27.95 61.41 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.583 -175.824 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -69.45 -29.9 67.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.963 0.411 . . . . 0.0 110.091 177.076 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -69.49 -41.16 76.49 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.961 175.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 843' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -62.84 -39.15 93.47 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.849 176.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 844' ' ' LEU . . . . . 0.626 HD21 ' HB ' ' A' ' 827' ' ' ILE . 0.0 OUTLIER -63.61 -31.31 72.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.636 174.957 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -69.78 -27.35 73.33 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.154 176.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.06 -45.64 17.94 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.653 0.263 . . . . 0.0 110.683 177.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -152.77 84.5 1.23 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.122 0.487 . . . . 0.0 110.345 176.732 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . -155.03 23.57 0.6 Allowed Glycine 0 N--CA 1.443 -0.835 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.029 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 11.2 m-85 55.52 -128.06 2.12 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.67 108.42 18.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.801 0.334 . . . . 0.0 110.225 176.58 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 851' ' ' CYS . . . . . 0.454 ' HB3' HD22 ' A' ' 844' ' ' LEU . 0.0 OUTLIER -80.97 125.97 30.8 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.597 -177.526 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 852' ' ' LYS . . . . . 0.71 ' HB3' HD13 ' A' ' 828' ' ' LEU . 0.0 OUTLIER -122.42 146.75 47.07 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 174.827 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -131.51 142.81 50.03 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -173.687 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 854' ' ' ALA . . . . . 0.471 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -156.46 165.48 36.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.011 175.612 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 855' ' ' ASN . . . . . 0.431 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 0.9 OUTLIER -148.76 74.04 1.25 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.887 0.375 . . . . 0.0 111.23 176.598 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 856' ' ' ASP . . . . . 0.431 ' HB2' ' O ' ' A' ' 855' ' ' ASN . 7.1 t70 172.73 145.27 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.916 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -66.0 -39.5 94.84 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.034 177.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 1.5 t -73.53 -32.28 35.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 O-C-N 122.713 -0.287 . . . . 0.0 110.87 -178.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -70.52 -34.02 71.82 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.005 0.431 . . . . 0.0 110.271 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 860' ' ' ALA . . . . . 0.468 ' HB2' HG13 ' A' ' 830' ' ' VAL . . . -64.72 -37.42 87.52 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.192 176.117 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 861' ' ' LEU . . . . . 0.58 HD21 HD12 ' A' ' 890' ' ' ILE . 1.4 mt -71.18 -35.31 71.54 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.42 176.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 40.8 t30 -65.8 -49.81 66.93 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.105 -179.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 863' ' ' VAL . . . . . 0.538 HG13 HD23 ' A' ' 828' ' ' LEU . 10.7 p -64.93 -32.26 57.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.361 178.664 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 864' ' ' LEU . . . . . 0.507 HD21 ' HA ' ' A' ' 864' ' ' LEU . 0.5 OUTLIER -64.59 -42.75 95.39 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.624 175.642 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 16.5 m -69.08 -22.19 64.02 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.859 -179.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -79.16 -27.77 42.72 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.924 175.419 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 19.4 t30 62.61 94.66 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.133 -0.94 . . . . 0.0 112.644 175.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -171.18 53.08 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.251 170.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 869' ' ' ILE . . . . . 0.686 ' HA ' ' HB2' ' A' ' 826' ' ' MET . 0.1 OUTLIER -152.11 154.66 7.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.525 179.316 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 870' ' ' ASP . . . . . 0.424 ' OD2' ' HA ' ' A' ' 825' ' ' MET . 13.7 m-20 -112.11 -49.46 2.97 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.568 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 871' ' ' ILE . . . . . 0.478 HG21 HD23 ' A' ' 873' ' ' LEU . 41.8 mm -118.62 133.86 64.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.023 177.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 872' ' ' VAL . . . . . 0.697 HG22 HD21 ' A' ' 828' ' ' LEU . 13.5 t -116.72 128.48 74.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.954 -0.388 . . . . 0.0 109.954 177.034 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 873' ' ' LEU . . . . . 0.478 HD23 HG21 ' A' ' 871' ' ' ILE . 0.2 OUTLIER -109.74 113.24 25.84 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.875 0.369 . . . . 0.0 110.686 179.835 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.81 96.32 9.71 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 175.408 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 875' ' ' ASP . . . . . 0.696 ' CG ' ' HZ1' ' A' ' 925' ' ' LYS . 48.0 t0 -105.83 117.9 35.21 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.005 -173.376 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 876' ' ' VAL . . . . . 0.484 HG13 ' H ' ' A' ' 878' ' ' MET . 2.4 t -141.58 133.31 27.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.114 0.483 . . . . 0.0 111.517 -175.019 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 877' ' ' ASN . . . . . 0.44 ' HB2' ' CE ' ' A' ' 925' ' ' LYS . 40.4 t-20 -127.47 54.77 1.65 Allowed 'General case' 0 C--O 1.234 0.273 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 171.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 878' ' ' MET . . . . . 0.484 ' H ' HG13 ' A' ' 876' ' ' VAL . 0.1 OUTLIER -163.26 108.18 0.99 Allowed Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.915 -179.535 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 879' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -59.55 109.17 0.53 Allowed 'Trans proline' 0 C--O 1.231 0.144 0 C-N-CA 122.496 2.131 . . . . 0.0 111.406 176.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -146.09 169.94 17.67 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.031 -174.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 42.9 mtp -62.78 -34.31 77.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.545 178.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 882' ' ' ASP . . . . . 0.504 ' OD1' ' HB3' ' A' ' 885' ' ' ARG . 24.3 t0 -85.44 61.83 7.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.408 0.623 . . . . 0.0 111.233 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -123.2 22.84 7.01 Favored Glycine 0 N--CA 1.447 -0.614 0 N-CA-C 110.264 -1.134 . . . . 0.0 110.264 172.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -177.66 -24.05 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -173.212 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 885' ' ' ARG . . . . . 0.504 ' HB3' ' OD1' ' A' ' 882' ' ' ASP . 2.1 tmm_? -55.2 -49.6 71.53 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.989 -178.602 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 886' ' ' LEU . . . . . 0.5 ' HG ' ' N ' ' A' ' 887' ' ' THR . 0.2 OUTLIER -65.51 -34.22 77.75 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.359 -177.652 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 887' ' ' THR . . . . . 0.868 HG22 ' HG2' ' A' ' 919' ' ' MET . 0.0 OUTLIER -75.81 -33.33 60.1 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-O 120.742 0.306 . . . . 0.0 111.502 -178.413 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -57.26 -41.81 80.35 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 173.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 889' ' ' ARG . . . . . 0.482 ' HG2' HD22 ' A' ' 861' ' ' LEU . 0.0 OUTLIER -70.07 -33.53 72.04 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.2 177.344 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 890' ' ' ILE . . . . . 0.58 HD12 HD21 ' A' ' 861' ' ' LEU . 1.5 tp -68.09 -36.97 77.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 N-CA-C 111.798 0.295 . . . . 0.0 111.798 -177.654 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 891' ' ' ARG . . . . . 0.535 ' HA ' HD23 ' A' ' 895' ' ' LEU . 1.9 ptm180 -75.39 -28.58 59.52 Favored 'General case' 0 N--CA 1.46 0.067 0 C-N-CA 120.289 -0.564 . . . . 0.0 110.459 177.605 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -69.99 -34.61 73.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.061 0.458 . . . . 0.0 110.797 175.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 893' ' ' LEU . . . . . 0.468 ' HA ' HD23 ' A' ' 893' ' ' LEU . 2.7 mt -74.64 -45.72 42.91 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.808 179.423 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 122.61 70.23 0.25 Allowed Glycine 0 N--CA 1.448 -0.513 0 N-CA-C 111.386 -0.685 . . . . 0.0 111.386 -178.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 895' ' ' LEU . . . . . 0.535 HD23 ' HA ' ' A' ' 891' ' ' ARG . 0.6 OUTLIER -64.45 117.36 7.19 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.393 0.616 . . . . 0.0 110.843 -176.883 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.57 0.5 24.58 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.26 -178.257 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 897' ' ' LEU . . . . . 0.625 HD11 HG23 ' A' ' 872' ' ' VAL . 1.0 OUTLIER -126.81 154.02 75.98 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.788 -175.595 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -73.09 127.79 12.41 Favored 'Trans proline' 0 C--O 1.239 0.533 0 C-N-CA 123.084 2.522 . . . . 0.0 112.326 179.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 899' ' ' VAL . . . . . 0.792 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 3.2 t -108.42 116.07 50.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.365 178.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 900' ' ' ILE . . . . . 0.418 HD13 HG23 ' A' ' 900' ' ' ILE . 42.0 mt -95.09 106.67 18.48 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.887 178.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -86.94 93.32 1.87 Allowed Glycine 0 N--CA 1.445 -0.762 0 C-N-CA 120.867 -0.682 . . . . 0.0 112.341 -177.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 902' ' ' VAL . . . . . 0.596 ' O ' ' HA ' ' A' ' 875' ' ' ASP . 0.2 OUTLIER -91.0 108.76 20.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-O 121.663 0.744 . . . . 0.0 109.603 178.007 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -126.33 152.86 45.66 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.919 -179.014 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -71.23 105.39 3.42 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 168.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -48.31 110.76 0.37 Allowed 'General case' 0 CA--C 1.515 -0.376 0 O-C-N 124.073 0.858 . . . . 0.0 110.96 -171.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -85.52 -56.96 3.26 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.199 -175.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -166.84 -50.04 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 178.054 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -134.48 42.65 2.84 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.012 0.434 . . . . 0.0 111.335 -174.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.03 -31.72 72.44 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.394 -178.483 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 910' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -39.65 94.96 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.163 176.375 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.47 -36.61 79.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.109 178.293 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -60.39 -47.9 84.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.169 176.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.85 -43.77 90.86 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.147 179.761 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 75.6 m -63.99 -32.5 74.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.807 0.337 . . . . 0.0 110.794 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 2.5 tp -70.59 -51.57 27.42 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.454 -179.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.54 -44.08 45.38 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.708 -175.392 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 51.19 42.48 28.86 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.208 0.528 . . . . 0.0 111.143 -176.226 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 918' ' ' GLY . . . . . 0.42 ' O ' HD13 ' A' ' 895' ' ' LEU . . . -119.59 -25.75 2.55 Favored Glycine 0 N--CA 1.447 -0.629 0 CA-C-N 115.716 -0.674 . . . . 0.0 112.225 -177.423 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 919' ' ' MET . . . . . 0.868 ' HG2' HG22 ' A' ' 887' ' ' THR . 2.1 mtt -78.41 -102.83 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.774 0.321 . . . . 0.0 110.158 177.12 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 920' ' ' ASP . . . . . 0.49 ' HB2' ' O ' ' A' ' 919' ' ' MET . 19.6 t70 170.3 -65.31 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 123.699 0.8 . . . . 0.0 109.772 175.196 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -113.26 158.32 20.66 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.802 -177.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 922' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -116.72 118.99 34.08 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 175.553 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 923' ' ' LEU . . . . . 0.485 ' HA ' HD21 ' A' ' 923' ' ' LEU . 0.3 OUTLIER -116.02 161.23 19.17 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.119 -178.858 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 2.6 m -102.15 137.62 40.17 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.313 178.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 925' ' ' LYS . . . . . 0.696 ' HZ1' ' CG ' ' A' ' 875' ' ' ASP . 0.0 OUTLIER -52.0 -41.46 79.86 Favored Pre-proline 0 CA--C 1.541 0.597 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 177.726 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -67.78 65.94 0.88 Allowed 'Trans proline' 0 C--N 1.357 1.004 0 C-N-CA 121.975 1.783 . . . . 0.0 112.417 171.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 927' ' ' VAL . . . . . 0.412 ' O ' HG13 ' A' ' 927' ' ' VAL . 5.3 p -99.19 145.65 9.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.139 179.053 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 34.0 p -102.91 174.06 6.04 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.586 0.231 . . . . 0.0 110.441 179.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 929' ' ' LEU . . . . . 0.442 ' HA ' HD23 ' A' ' 929' ' ' LEU . 0.0 OUTLIER -60.85 -34.74 75.06 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 175.141 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -74.45 -45.62 45.17 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.209 -177.69 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 79.0 t -67.4 -38.99 81.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 120.905 0.383 . . . . 0.0 110.735 -179.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 932' ' ' ILE . . . . . 0.494 HG23 ' N ' ' A' ' 933' ' ' LYS . 0.4 OUTLIER -63.47 -37.59 79.96 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 175.583 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 933' ' ' LYS . . . . . 0.494 ' N ' HG23 ' A' ' 932' ' ' ILE . 20.2 ttmt -63.66 -48.38 77.43 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.579 177.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -55.04 -54.97 36.2 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.346 178.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 1.5 m -62.11 -46.29 89.69 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.725 -176.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 936' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.7 -44.51 96.06 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.61 -0.268 . . . . 0.0 110.797 -179.507 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 56.1 m -64.33 -48.24 76.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.307 -179.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 3.1 tp -63.1 -37.38 86.97 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.433 -176.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -79.43 -34.2 41.87 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.779 -0.368 . . . . 0.0 111.034 -179.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 940' ' ' ALA . . . . . 0.465 ' O ' HG23 ' A' ' 943' ' ' VAL . . . -66.43 -38.85 88.35 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.841 178.085 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 941' ' ' GLU . . . . . 0.534 ' HG3' ' N ' ' A' ' 942' ' ' ARG . 0.0 OUTLIER -70.3 -33.82 72.0 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 177.001 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 942' ' ' ARG . . . . . 0.534 ' N ' ' HG3' ' A' ' 941' ' ' GLU . 1.6 tpm_? -64.84 -48.17 75.31 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.85 179.565 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 943' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 940' ' ' ALA . 31.4 m -69.2 -29.57 43.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 178.118 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 944' ' ' ARG . . . . . 0.451 ' HB2' ' O ' ' A' ' 940' ' ' ALA . 0.0 OUTLIER -64.58 -35.13 79.98 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.78 176.814 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 1.1 mmtp -65.08 -42.34 94.22 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.296 0.57 . . . . 0.0 110.362 176.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 5.0 m -72.18 -17.68 61.92 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.297 179.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.4 -61.15 1.76 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.863 0.364 . . . . 0.0 110.972 -179.497 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -111.89 68.91 0.68 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.055 -177.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.758 -0.639 . . . . 0.0 110.787 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 0.992 0 CA-C-O 120.65 0.262 . . . . 0.0 110.341 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . -104.24 166.51 15.37 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.203 -179.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . -87.39 98.41 2.38 Favored Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 121.011 -0.614 . . . . 0.0 111.689 179.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -93.54 73.12 4.4 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.885 0.374 . . . . 0.0 111.17 -176.375 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . 172.91 120.5 0.57 Allowed Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.542 -0.837 . . . . 0.0 112.707 178.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 21.4 t -125.33 -47.22 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 177.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 62.39 -162.47 0.28 Allowed 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.837 177.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . 161.63 139.6 2.68 Favored Glycine 0 N--CA 1.45 -0.399 0 N-CA-C 111.084 -0.807 . . . . 0.0 111.084 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.498 HD22 HD13 ' A' ' 801' ' ' ILE . 0.1 OUTLIER -100.9 53.57 0.85 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.524 0.678 . . . . 0.0 111.565 -174.654 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -114.25 122.99 48.42 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.899 174.598 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 122.85 -11.23 8.84 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.482 -179.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 707' ' ' LYS . . . . . 0.408 ' HG3' HD23 ' A' ' 704' ' ' LEU . 4.1 mmtt -74.41 147.0 42.46 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 178.085 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 708' ' ' ARG . . . . . 0.47 ' HA ' HG22 ' A' ' 732' ' ' VAL . 2.7 mtm180 -102.81 156.47 17.63 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.078 0.466 . . . . 0.0 111.754 -172.128 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 709' ' ' CYS . . . . . 0.797 ' HG ' ' HE2' ' A' ' 799' ' ' TYR . 1.0 OUTLIER -142.37 115.04 8.58 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.973 174.794 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 710' ' ' TRP . . . . . 0.484 ' CZ3' ' HB ' ' A' ' 734' ' ' THR . 91.1 m95 -91.41 118.12 30.27 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 -178.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 711' ' ' LEU . . . . . 0.682 HD21 HG11 ' A' ' 733' ' ' VAL . 1.9 pt? -118.72 127.61 53.72 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.496 0.665 . . . . 0.0 111.605 -177.423 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -127.05 58.73 1.43 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.541 175.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 713' ' ' VAL . . . . . 0.867 HG13 ' HB2' ' A' ' 750' ' ' ASP . 21.2 t -96.93 121.42 47.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.628 -179.547 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 714' ' ' ARG . . . . . 0.569 ' H ' ' HB3' ' A' ' 750' ' ' ASP . 38.0 mtp85 -66.96 -46.86 73.39 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.193 -175.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 715' ' ' ASN . . . . . 0.476 ' O ' ' HB2' ' A' ' 719' ' ' CYS . 7.6 p30 -78.96 133.39 36.88 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.236 179.131 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -77.69 -17.39 57.7 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.529 -175.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.43 -56.58 19.64 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.098 0.475 . . . . 0.0 110.182 178.382 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 718' ' ' LEU . . . . . 0.471 ' HB3' HG11 ' A' ' 713' ' ' VAL . 0.6 OUTLIER -72.58 -39.47 67.37 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.552 178.579 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 719' ' ' CYS . . . . . 0.723 ' SG ' ' HB ' ' A' ' 713' ' ' VAL . 0.1 OUTLIER -55.48 -52.64 62.97 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.12 -178.905 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 720' ' ' GLN . . . . . 0.516 ' O ' ' HG2' ' A' ' 723' ' ' GLU . 0.6 OUTLIER -67.85 -42.85 80.75 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.392 -177.705 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 721' ' ' PHE . . . . . 0.465 ' HE2' ' HG3' ' A' ' 792' ' ' PRO . 57.2 t80 -58.18 -54.76 43.31 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.734 0.302 . . . . 0.0 110.738 -179.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.09 -44.36 94.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.892 -177.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 723' ' ' GLU . . . . . 0.535 ' HA ' HG13 ' A' ' 733' ' ' VAL . 6.3 pt-20 -62.64 -36.3 82.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.881 -178.233 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 724' ' ' THR . . . . . . . . . . . . . 87.8 m -65.12 -44.56 88.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.178 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.98 -37.66 85.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.987 0.422 . . . . 0.0 111.173 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 726' ' ' LEU . . . . . 0.483 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 23.7 mt -74.49 -48.09 29.34 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.988 -177.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.71 -5.74 44.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.733 -177.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.13 -27.65 59.87 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 175.424 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 729' ' ' SER . . . . . 0.49 ' HB2' ' H ' ' A' ' 730' ' ' GLY . 0.3 OUTLIER -90.03 -104.15 0.09 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.897 175.796 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 730' ' ' GLY . . . . . 0.49 ' H ' ' HB2' ' A' ' 729' ' ' SER . . . -148.26 31.24 1.3 Allowed Glycine 0 N--CA 1.446 -0.691 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 175.216 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 731' ' ' ILE . . . . . 0.483 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 15.3 mm -95.77 126.0 48.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.736 0.303 . . . . 0.0 110.369 -177.307 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 732' ' ' VAL . . . . . 0.47 HG22 ' HA ' ' A' ' 708' ' ' ARG . 0.0 OUTLIER -85.86 98.53 6.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 121.275 0.559 . . . . 0.0 110.553 179.629 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 733' ' ' VAL . . . . . 0.682 HG11 HD21 ' A' ' 711' ' ' LEU . 0.1 OUTLIER -71.59 113.33 8.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.159 177.867 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 734' ' ' THR . . . . . 0.484 ' HB ' ' CZ3' ' A' ' 710' ' ' TRP . 0.2 OUTLIER -118.46 127.03 53.26 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.19 0.519 . . . . 0.0 110.824 -178.408 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -55.66 124.61 17.97 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.972 174.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 736' ' ' TYR . . . . . 0.672 ' HE2' ' HD3' ' A' ' 755' ' ' LYS . 9.4 t80 -81.19 70.07 7.95 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.622 0.725 . . . . 0.0 109.846 177.063 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 737' ' ' GLU . . . . . 0.419 ' H ' ' HG3' ' A' ' 737' ' ' GLU . 3.5 mt-10 -75.51 -25.04 56.91 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.788 -177.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 154.3 60.9 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.344 0 N-CA-C 111.431 -0.668 . . . . 0.0 111.431 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 26.7 mp0 -112.55 -178.84 3.5 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.77 0.319 . . . . 0.0 110.89 -175.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.6 143.99 51.96 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.941 -177.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 741' ' ' PRO . . . . . 0.405 ' HA ' ' CZ3' ' A' ' 757' ' ' TRP . 1.3 Cg_endo -82.32 123.17 3.84 Favored 'Trans proline' 0 N--CA 1.452 -0.925 0 C-N-CA 122.644 2.229 . . . . 0.0 111.701 175.837 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 742' ' ' THR . . . . . 0.412 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.1 OUTLIER -110.73 136.18 20.71 Favored Pre-proline 0 C--N 1.32 -0.703 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.755 178.966 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 743' ' ' PRO . . . . . 0.412 ' HD2' HG22 ' A' ' 742' ' ' THR . 37.8 Cg_endo -66.5 -1.91 6.46 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 123.053 2.502 . . . . 0.0 112.883 -179.279 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.27 -9.63 18.44 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.498 178.279 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -109.27 152.18 25.56 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.415 -0.812 . . . . 0.0 111.204 -170.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 16.2 m -116.68 147.85 19.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.429 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 747' ' ' LEU . . . . . 0.651 HD21 HG22 ' A' ' 749' ' ' THR . 0.4 OUTLIER -108.14 135.22 49.85 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.001 177.813 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 748' ' ' ILE . . . . . 0.469 HG12 HD21 ' A' ' 795' ' ' LEU . 1.7 mt -117.77 118.09 57.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 173.531 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 749' ' ' THR . . . . . 0.651 HG22 HD21 ' A' ' 747' ' ' LEU . 2.5 p -125.18 150.19 47.19 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -167.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 750' ' ' ASP . . . . . 0.867 ' HB2' HG13 ' A' ' 713' ' ' VAL . 34.8 t0 -113.54 116.59 29.78 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.773 175.005 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 751' ' ' GLU . . . . . 0.678 ' HG3' ' H ' ' A' ' 752' ' ' VAL . 1.8 tp10 68.17 -177.85 0.21 Allowed 'General case' 0 CA--C 1.536 0.432 0 O-C-N 123.868 0.73 . . . . 0.0 111.063 -177.173 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 752' ' ' VAL . . . . . 0.678 ' H ' ' HG3' ' A' ' 751' ' ' GLU . 15.2 t -75.19 100.2 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.298 -176.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 19.5 m -90.33 -0.29 8.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.483 176.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 58.31 41.35 23.38 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.351 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 755' ' ' LYS . . . . . 0.672 ' HD3' ' HE2' ' A' ' 736' ' ' TYR . 0.1 OUTLIER -120.03 126.97 52.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.318 180.0 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 2.1 tmtm? -81.43 -42.27 20.63 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.06 -179.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 757' ' ' TRP . . . . . 0.405 ' CZ3' ' HA ' ' A' ' 741' ' ' PRO . 76.0 t-105 62.46 90.44 0.07 Allowed 'General case' 0 CA--C 1.53 0.21 0 O-C-N 123.71 0.631 . . . . 0.0 111.657 179.388 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -83.23 58.82 4.66 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.148 0.499 . . . . 0.0 109.822 175.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 759' ' ' GLY . . . . . . . . . . . . . . . -117.62 -144.28 7.68 Favored Glycine 0 N--CA 1.444 -0.791 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.901 -178.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -75.81 -53.27 8.74 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.96 0.41 . . . . 0.0 110.242 179.217 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -161.49 156.56 23.7 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.386 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 3.0 p -140.75 126.87 20.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-O 121.126 0.489 . . . . 0.0 109.852 179.004 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 763' ' ' VAL . . . . . 0.528 HG21 HD13 ' A' ' 795' ' ' LEU . 18.6 t -111.65 105.29 18.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.05 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 764' ' ' THR . . . . . 0.473 ' HA ' ' OG1' ' A' ' 749' ' ' THR . 33.4 m -97.66 119.68 36.66 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.219 0.533 . . . . 0.0 110.607 178.749 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 765' ' ' PHE . . . . . 0.761 ' HZ ' ' HG ' ' A' ' 791' ' ' LEU . 33.0 m-85 -76.98 123.88 26.97 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.633 175.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 766' ' ' CYS . . . . . 0.486 ' SG ' ' HB ' ' A' ' 782' ' ' VAL . 0.0 OUTLIER -95.58 131.64 41.57 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 176.925 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.72 -69.34 0.74 Allowed 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.902 0.382 . . . . 0.0 110.672 -177.034 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 768' ' ' ARG . . . . . 0.433 ' HA ' ' HD2' ' A' ' 768' ' ' ARG . 0.0 OUTLIER -118.69 -30.09 5.21 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.261 -177.988 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -114.77 134.06 55.41 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.312 0.577 . . . . 0.0 110.965 -178.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 770' ' ' ILE . . . . . 0.48 HG21 ' N ' ' A' ' 771' ' ' GLY . 2.7 mp -97.51 156.28 3.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 173.131 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 771' ' ' GLY . . . . . 0.48 ' N ' HG21 ' A' ' 770' ' ' ILE . . . 175.45 -43.37 0.12 Allowed Glycine 0 CA--C 1.505 -0.571 0 N-CA-C 110.612 -0.995 . . . . 0.0 110.612 -177.474 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 772' ' ' ILE . . . . . 0.456 ' HA ' ' HD3' ' A' ' 773' ' ' PRO . 17.5 mm -87.03 123.4 70.3 Favored Pre-proline 0 C--N 1.321 -0.643 0 N-CA-C 108.374 -0.972 . . . . 0.0 108.374 169.358 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 773' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' A' ' 772' ' ' ILE . 23.7 Cg_exo -62.63 -85.62 0.01 OUTLIER 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.982 2.455 . . . . 0.0 112.673 -175.371 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . 0.598 ' O ' ' HB3' ' A' ' 780' ' ' GLU . 0.9 OUTLIER 171.53 -155.41 0.01 OUTLIER 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 -179.901 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 775' ' ' GLU . . . . . 0.577 ' HA ' ' O ' ' A' ' 780' ' ' GLU . 2.6 mp0 -60.3 75.13 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 122.082 0.944 . . . . 0.0 112.269 174.242 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 12.5 mmmt -119.19 -45.71 2.54 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 114.17 -1.377 . . . . 0.0 109.008 171.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -91.57 165.88 19.66 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 115.333 -0.848 . . . . 0.0 110.233 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_endo -60.91 91.81 0.1 OUTLIER 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.829 2.352 . . . . 0.0 113.18 -178.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 99.05 15.06 34.37 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.797 176.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 780' ' ' GLU . . . . . 0.598 ' HB3' ' O ' ' A' ' 774' ' ' LEU . 2.2 tt0 -84.23 122.01 28.29 Favored 'General case' 0 C--O 1.218 -0.589 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 -179.138 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 17.6 m95 -133.49 143.54 48.85 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.626 0.25 . . . . 0.0 110.344 178.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . 0.486 ' HB ' ' SG ' ' A' ' 766' ' ' CYS . 17.1 m -134.66 156.57 40.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 172.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 783' ' ' HIS . . . . . 0.457 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.1 OUTLIER -176.22 144.34 0.56 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.725 0.298 . . . . 0.0 110.896 178.228 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 4.9 m -105.74 102.77 12.19 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.354 175.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -150.57 155.28 7.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.67 0.271 . . . . 0.0 110.543 178.191 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -86.73 7.41 26.86 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.428 174.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 787' ' ' ALA . . . . . 0.414 ' N ' ' HD3' ' A' ' 788' ' ' PRO . . . 57.8 63.6 4.51 Favored Pre-proline 0 N--CA 1.464 0.251 0 CA-C-N 115.22 -0.9 . . . . 0.0 112.2 179.109 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 788' ' ' PRO . . . . . 0.414 ' HD3' ' N ' ' A' ' 787' ' ' ALA . 21.2 Cg_exo -66.58 -54.84 0.41 Allowed 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.135 1.89 . . . . 0.0 111.725 176.83 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 7.3 p-80 -161.05 -22.12 0.05 Allowed 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 176.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 790' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -72.83 -38.6 67.08 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -175.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 791' ' ' LEU . . . . . 0.761 ' HG ' ' HZ ' ' A' ' 765' ' ' PHE . 1.2 tm? -62.21 -54.62 47.96 Favored Pre-proline 0 CA--C 1.536 0.438 0 N-CA-C 111.65 0.241 . . . . 0.0 111.65 -178.067 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 792' ' ' PRO . . . . . 0.465 ' HG3' ' HE2' ' A' ' 721' ' ' PHE . 11.2 Cg_endo -58.37 -26.6 78.17 Favored 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 121.523 1.482 . . . . 0.0 112.201 176.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -71.79 -40.56 69.15 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.789 176.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -59.62 -47.17 86.66 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.107 0.48 . . . . 0.0 109.784 176.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 795' ' ' LEU . . . . . 0.528 HD13 HG21 ' A' ' 763' ' ' VAL . 0.2 OUTLIER -70.89 -29.7 65.85 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.13 -178.755 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 796' ' ' ALA . . . . . 0.419 ' HB1' ' HB ' ' A' ' 801' ' ' ILE . . . -62.67 -46.51 87.84 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 174.581 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 797' ' ' ARG . . . . . 0.406 ' HB2' ' OD2' ' A' ' 806' ' ' ASP . 0.1 OUTLIER -64.3 -33.51 76.0 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.06 177.054 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 798' ' ' ILE . . . . . 0.478 ' HB ' ' HA ' ' A' ' 795' ' ' LEU . 0.3 OUTLIER -62.01 -32.28 53.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.879 178.771 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 799' ' ' TYR . . . . . 0.797 ' HE2' ' HG ' ' A' ' 709' ' ' CYS . 0.6 OUTLIER -103.91 15.54 28.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.155 179.6 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 9.7 mt 61.04 41.15 14.27 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 115.878 -0.601 . . . . 0.0 112.127 176.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 801' ' ' ILE . . . . . 0.556 HG23 ' HG2' ' A' ' 803' ' ' MET . 2.6 mm -88.33 66.78 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.58 0.705 . . . . 0.0 109.134 176.07 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 802' ' ' GLU . . . . . 0.432 ' H ' ' HG3' ' A' ' 802' ' ' GLU . 0.2 OUTLIER -74.71 72.47 1.99 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.082 -0.963 . . . . 0.0 111.148 -175.992 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 803' ' ' MET . . . . . 0.556 ' HG2' HG23 ' A' ' 801' ' ' ILE . 12.0 ptp -134.58 33.73 3.24 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.193 0.521 . . . . 0.0 110.818 176.853 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 804' ' ' GLU . . . . . 0.41 ' C ' ' H ' ' A' ' 806' ' ' ASP . 1.7 mm-40 -150.97 179.37 8.3 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.546 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 1.2 m -75.84 42.94 0.25 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.126 0.488 . . . . 0.0 111.118 177.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 806' ' ' ASP . . . . . 0.41 ' H ' ' C ' ' A' ' 804' ' ' GLU . 24.2 t70 -75.32 112.57 11.76 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.097 -0.501 . . . . 0.0 109.69 179.324 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 807' ' ' ASP . . . . . 0.476 ' HA ' ' HD3' ' A' ' 808' ' ' PRO . 0.0 OUTLIER -79.17 120.96 82.48 Favored Pre-proline 0 C--N 1.317 -0.833 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.868 -179.104 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 808' ' ' PRO . . . . . 0.476 ' HD3' ' HA ' ' A' ' 807' ' ' ASP . 13.3 Cg_exo -69.93 68.97 1.76 Allowed 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 123.323 2.682 . . . . 0.0 112.483 -177.089 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -144.98 138.14 26.59 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.563 176.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 2.4 t30 62.97 43.73 6.48 Favored 'General case' 0 C--N 1.33 -0.253 0 O-C-N 123.698 0.624 . . . . 0.0 110.075 -175.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -151.13 73.89 1.12 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.38 -178.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -80.38 115.34 54.22 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.22 178.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -74.79 140.21 25.81 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.488 2.126 . . . . 0.0 112.185 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -80.14 162.77 24.56 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.47 178.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.48 105.46 0.52 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.902 0.382 . . . . 0.0 110.999 179.024 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.31 60.06 4.84 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.183 -176.036 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.51 43.97 1.67 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.49 -179.568 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -148.63 172.89 13.82 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.994 0.426 . . . . 0.0 111.204 -178.124 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 3.7 p -127.97 158.27 39.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.293 177.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -88.38 -64.38 1.15 Allowed 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -175.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -159.6 -165.84 1.63 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.075 0.464 . . . . 0.0 111.236 -173.288 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 21.3 t30 -127.51 -43.82 1.57 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.875 177.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 30.3 t70 59.83 103.71 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.709 0 O-C-N 123.888 0.743 . . . . 0.0 111.107 -176.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 824' ' ' ASP . . . . . 0.513 ' HB3' ' H ' ' A' ' 825' ' ' MET . 0.9 OUTLIER -122.66 -123.53 0.27 Allowed 'General case' 0 N--CA 1.445 -0.686 0 CA-C-O 121.14 0.495 . . . . 0.0 111.13 -174.274 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 825' ' ' MET . . . . . 0.513 ' H ' ' HB3' ' A' ' 824' ' ' ASP . 2.7 ttm -151.53 140.86 21.44 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.004 -175.336 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 826' ' ' MET . . . . . 0.73 ' HG3' ' HA ' ' A' ' 869' ' ' ILE . 1.6 ptp -135.05 123.34 23.09 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.155 0.502 . . . . 0.0 110.841 178.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 827' ' ' ILE . . . . . 0.45 HG21 ' HB ' ' A' ' 871' ' ' ILE . 5.5 mm -108.25 140.72 25.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.816 -179.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 828' ' ' LEU . . . . . 0.423 HD12 HG12 ' A' ' 863' ' ' VAL . 16.2 tp -106.55 118.33 36.39 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.139 0.495 . . . . 0.0 110.615 -178.179 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 829' ' ' VAL . . . . . 0.441 ' H ' HG22 ' A' ' 829' ' ' VAL . 0.0 OUTLIER -106.27 109.88 29.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.257 -179.803 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 830' ' ' VAL . . . . . 0.404 ' HA ' ' O ' ' A' ' 854' ' ' ALA . 13.4 t -109.54 100.39 10.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.232 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 831' ' ' ASP . . . . . 0.484 ' HA ' ' O ' ' A' ' 875' ' ' ASP . 7.2 t0 -112.34 149.2 32.79 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 -177.75 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 832' ' ' ASP . . . . . 0.457 ' CG ' ' HD1' ' A' ' 833' ' ' HIS . 0.0 OUTLIER -91.02 -22.13 20.93 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.841 179.76 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 833' ' ' HIS . . . . . 0.457 ' HD1' ' CG ' ' A' ' 832' ' ' ASP . 1.7 m80 -111.93 113.68 52.19 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.553 -176.053 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 834' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' A' ' 833' ' ' HIS . 5.4 Cg_endo -48.22 -46.46 22.65 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 124.106 3.204 . . . . 0.0 114.173 -174.385 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -56.35 -46.6 81.86 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 120.961 0.41 . . . . 0.0 111.395 -178.868 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 836' ' ' ASN . . . . . 0.613 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 3.0 m120 -75.75 -35.13 60.28 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 -178.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 837' ' ' ARG . . . . . 0.439 HH11 ' HB ' ' A' ' 853' ' ' THR . 0.8 OUTLIER -53.09 -46.26 68.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.44 176.996 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 1.7 tmm_? -65.66 -39.95 91.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.448 177.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.71 -53.57 55.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.112 -176.655 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 840' ' ' LEU . . . . . 0.613 ' HG ' ' O ' ' A' ' 836' ' ' ASN . 0.0 OUTLIER -73.64 -33.31 64.46 Favored 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 120.603 -0.439 . . . . 0.0 111.144 -177.281 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -63.75 -45.43 89.89 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.967 0.413 . . . . 0.0 110.866 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -65.99 -38.99 89.91 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.52 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 843' ' ' GLN . . . . . 0.943 ' HG3' HD21 ' A' ' 929' ' ' LEU . 0.0 OUTLIER -70.67 -32.41 69.66 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.985 -178.514 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 844' ' ' LEU . . . . . 0.584 ' HG ' HD23 ' A' ' 936' ' ' LEU . 0.3 OUTLIER -61.2 -37.12 81.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.037 0.446 . . . . 0.0 109.842 173.631 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -64.57 -37.33 94.28 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.303 176.041 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -67.07 -26.69 66.86 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.953 0.406 . . . . 0.0 111.044 178.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.25 -13.17 61.09 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.572 177.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 84.68 30.04 27.86 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.877 -0.677 . . . . 0.0 112.849 176.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -124.61 144.45 50.16 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 20.6 mm-40 -65.92 134.75 53.65 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.903 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.06 133.63 55.73 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.131 -172.744 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.05 126.17 51.76 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 174.17 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 853' ' ' THR . . . . . 0.439 ' HB ' HH11 ' A' ' 837' ' ' ARG . 0.0 OUTLIER -106.66 138.62 42.5 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.926 0.393 . . . . 0.0 111.747 -174.593 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 854' ' ' ALA . . . . . 0.404 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -140.4 145.22 36.79 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.277 175.558 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 855' ' ' ASN . . . . . 0.454 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 0.6 OUTLIER -121.89 72.63 1.04 Allowed 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 176.146 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 856' ' ' ASP . . . . . 0.486 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 35.0 t70 164.25 141.06 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.007 0.923 . . . . 0.0 109.544 178.195 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 857' ' ' GLY . . . . . 0.491 ' HA3' ' HB2' ' A' ' 886' ' ' LEU . . . -67.18 -49.61 51.72 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.972 -0.632 . . . . 0.0 113.228 -177.516 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 858' ' ' VAL . . . . . 0.446 ' HA ' HD11 ' A' ' 861' ' ' LEU . 0.7 OUTLIER -73.73 -31.31 31.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.135 0.493 . . . . 0.0 110.728 -177.021 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 859' ' ' ASP . . . . . 0.486 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 18.9 t0 -58.91 -31.16 68.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.824 177.425 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -62.85 -33.79 75.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.79 177.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 861' ' ' LEU . . . . . 0.446 HD11 ' HA ' ' A' ' 858' ' ' VAL . 0.3 OUTLIER -69.01 -40.77 78.5 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.022 0.439 . . . . 0.0 110.261 178.794 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -59.35 -49.67 76.91 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.634 177.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 863' ' ' VAL . . . . . 0.423 HG12 HD12 ' A' ' 828' ' ' LEU . 0.8 OUTLIER -66.42 -31.66 54.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.778 179.789 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 864' ' ' LEU . . . . . 0.564 HD23 HD13 ' A' ' 869' ' ' ILE . 0.6 OUTLIER -63.38 -41.93 98.81 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.012 0.434 . . . . 0.0 110.52 177.13 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 3.5 m -76.02 -22.68 55.51 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.578 -176.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.46 -44.61 9.51 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.388 -178.595 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -96.11 -133.03 0.2 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.405 -177.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 3.5 m170 -136.69 -76.9 0.42 Allowed 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 178.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 869' ' ' ILE . . . . . 0.73 ' HA ' ' HG3' ' A' ' 826' ' ' MET . 3.0 mt 69.35 134.6 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 O-C-N 123.792 0.682 . . . . 0.0 111.405 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -98.28 -47.95 5.25 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.485 -178.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 871' ' ' ILE . . . . . 0.58 HD12 ' HD2' ' A' ' 939' ' ' TYR . 36.3 mm -121.62 131.51 72.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.298 -179.607 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 872' ' ' VAL . . . . . 0.714 HG22 HD13 ' A' ' 897' ' ' LEU . 17.0 t -111.82 135.38 51.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 110.125 -0.324 . . . . 0.0 110.125 177.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 873' ' ' LEU . . . . . . . . . . . . . 1.2 pp -139.99 141.72 36.35 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.937 0.399 . . . . 0.0 110.382 174.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 874' ' ' SER . . . . . 0.474 ' O ' HG12 ' A' ' 902' ' ' VAL . 0.9 OUTLIER -119.72 102.06 8.34 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.639 -179.024 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 875' ' ' ASP . . . . . 0.579 ' OD1' ' HG2' ' A' ' 925' ' ' LYS . 0.4 OUTLIER -89.1 106.28 18.33 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.896 -179.583 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -119.16 125.7 74.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-O 121.165 0.507 . . . . 0.0 111.654 -173.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 877' ' ' ASN . . . . . 0.417 ' CB ' ' HD2' ' A' ' 925' ' ' LYS . 0.1 OUTLIER -96.47 -35.61 11.08 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 172.418 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -119.74 133.18 23.85 Favored Pre-proline 0 C--N 1.319 -0.749 0 CA-C-N 114.882 -1.054 . . . . 0.0 108.741 172.427 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 879' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -55.0 -14.63 8.63 Favored 'Trans proline' 0 CA--C 1.532 0.379 0 C-N-CA 123.156 2.571 . . . . 0.0 113.864 -177.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 61.64 70.67 0.58 Allowed 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 -179.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 72.19 -62.68 0.46 Allowed 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.344 -171.332 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -152.91 130.7 11.65 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.073 178.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -95.97 38.07 3.23 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.859 -175.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -131.15 -28.07 1.96 Allowed 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 177.773 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.51 -39.82 67.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.704 -178.538 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 886' ' ' LEU . . . . . 0.587 ' HG ' ' N ' ' A' ' 887' ' ' THR . 0.0 OUTLIER -70.8 -44.19 67.11 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 121.123 -0.231 . . . . 0.0 110.949 -176.852 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 887' ' ' THR . . . . . 0.587 ' N ' ' HG ' ' A' ' 886' ' ' LEU . 0.0 OUTLIER -67.14 -41.78 85.49 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.972 0.415 . . . . 0.0 110.46 -178.964 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 888' ' ' GLN . . . . . 0.456 ' O ' ' HB2' ' A' ' 892' ' ' GLN . 8.6 tp60 -58.18 -41.01 82.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.15 176.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 11.0 mmt-85 -70.99 -35.03 71.93 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.941 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 890' ' ' ILE . . . . . 0.606 HG23 ' N ' ' A' ' 891' ' ' ARG . 0.0 OUTLIER -66.75 -41.5 88.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 C-N-CA 121.175 -0.21 . . . . 0.0 110.914 -179.018 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 891' ' ' ARG . . . . . 0.606 ' N ' HG23 ' A' ' 890' ' ' ILE . 0.0 OUTLIER -75.32 -24.11 57.37 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 120.711 -0.396 . . . . 0.0 110.502 175.843 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 892' ' ' GLN . . . . . 0.456 ' HB2' ' O ' ' A' ' 888' ' ' GLN . 0.0 OUTLIER -65.45 -38.87 91.12 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.796 178.274 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -83.81 -11.47 57.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.664 -179.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 87.04 85.92 1.11 Allowed Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.798 -0.715 . . . . 0.0 111.778 -178.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 895' ' ' LEU . . . . . 0.577 ' HG ' ' O ' ' A' ' 895' ' ' LEU . 0.5 OUTLIER -71.83 111.59 7.22 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.46 0.648 . . . . 0.0 110.827 -177.388 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -88.15 -12.61 43.5 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.011 179.74 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 897' ' ' LEU . . . . . 0.714 HD13 HG22 ' A' ' 872' ' ' VAL . 1.8 pt? -124.34 147.83 56.25 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.121 -177.634 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 898' ' ' PRO . . . . . 0.771 ' HB2' ' HE2' ' A' ' 939' ' ' TYR . 57.2 Cg_endo -71.28 141.19 38.65 Favored 'Trans proline' 0 C--O 1.242 0.701 0 C-N-CA 122.648 2.232 . . . . 0.0 112.748 -178.105 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 899' ' ' VAL . . . . . 0.811 HG22 ' HB3' ' A' ' 919' ' ' MET . 0.2 OUTLIER -127.28 144.74 36.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.409 0.623 . . . . 0.0 110.548 179.783 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 900' ' ' ILE . . . . . . . . . . . . . 2.5 mt -108.61 119.05 57.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.155 177.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -94.74 98.78 2.34 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.858 -0.686 . . . . 0.0 111.542 179.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 902' ' ' VAL . . . . . 0.825 ' HB ' HD12 ' A' ' 923' ' ' LEU . 0.1 OUTLIER -99.56 101.46 12.12 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 CA-C-O 121.717 0.77 . . . . 0.0 109.203 178.769 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 903' ' ' THR . . . . . 0.472 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.1 OUTLIER -105.12 173.73 6.18 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.812 -174.269 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -79.76 103.84 9.94 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.807 -0.357 . . . . 0.0 110.713 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 45.7 t30 18.82 91.78 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.76 0 O-C-N 125.219 1.574 . . . . 0.0 114.787 177.031 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -95.29 8.46 43.05 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.246 -0.434 . . . . 0.0 109.884 172.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 3.1 tp 69.25 -67.89 0.21 Allowed 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.596 -176.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -99.22 67.89 1.61 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.128 0.49 . . . . 0.0 109.814 176.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.42 -27.88 67.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.676 -178.44 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 910' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.84 -40.87 94.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.638 176.359 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 3.9 tttt -70.53 -32.83 70.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.269 -179.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.5 -44.29 94.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.715 174.641 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 913' ' ' ARG . . . . . 0.535 ' HA ' ' HE3' ' A' ' 919' ' ' MET . 1.0 OUTLIER -59.93 -42.54 94.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.905 177.211 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 66.6 m -68.38 -34.73 76.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.282 -179.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.47 -44.69 74.27 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.817 -178.78 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 916' ' ' GLU . . . . . 0.568 ' OE1' ' HB ' ' A' ' 887' ' ' THR . 0.3 OUTLIER -77.14 -50.93 11.9 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.505 -177.701 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 2.1 m 50.24 47.88 23.04 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.568 -174.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 918' ' ' GLY . . . . . 0.448 ' HA3' ' HD2' ' A' ' 891' ' ' ARG . . . -132.67 7.37 5.24 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.166 -1.016 . . . . 0.0 112.965 -179.165 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 919' ' ' MET . . . . . 0.811 ' HB3' HG22 ' A' ' 899' ' ' VAL . 0.0 OUTLIER -121.89 -89.32 0.6 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.734 0.302 . . . . 0.0 110.296 -178.143 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 920' ' ' ASP . . . . . 0.521 ' HB2' ' O ' ' A' ' 919' ' ' MET . 25.5 t70 165.74 -54.79 0.0 OUTLIER 'General case' 0 CA--C 1.516 -0.347 0 O-C-N 124.404 1.065 . . . . 0.0 108.562 176.639 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 921' ' ' SER . . . . . 0.602 ' HG ' ' HH ' ' A' ' 939' ' ' TYR . 20.7 m -129.68 166.61 19.45 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.348 177.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 922' ' ' CYS . . . . . 0.408 ' HB2' ' HB2' ' A' ' 913' ' ' ARG . 0.8 OUTLIER -144.74 147.63 33.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.829 -178.898 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 923' ' ' LEU . . . . . 0.825 HD12 ' HB ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -150.2 -176.82 5.61 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 175.176 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 924' ' ' SER . . . . . 0.472 ' HA ' ' O ' ' A' ' 903' ' ' THR . 1.5 m -108.67 147.49 31.83 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 121.255 -0.178 . . . . 0.0 110.553 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 925' ' ' LYS . . . . . 0.579 ' HG2' ' OD1' ' A' ' 875' ' ' ASP . 0.0 OUTLIER -51.56 -40.79 72.67 Favored Pre-proline 0 CA--C 1.54 0.558 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 -175.577 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 926' ' ' PRO . . . . . 0.549 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 10.9 Cg_endo -57.18 84.86 0.04 OUTLIER 'Trans proline' 0 C--N 1.358 1.035 0 C-N-CA 121.915 1.744 . . . . 0.0 112.1 171.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 927' ' ' VAL . . . . . 0.572 HG13 ' HB ' ' A' ' 931' ' ' VAL . 2.3 t -122.55 129.2 75.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.341 -177.09 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.86 172.12 10.32 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.97 178.379 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 929' ' ' LEU . . . . . 0.943 HD21 ' HG3' ' A' ' 843' ' ' GLN . 1.0 OUTLIER -60.93 -41.9 97.11 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.416 -175.837 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.67 -29.07 68.26 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.989 0.424 . . . . 0.0 110.584 -179.105 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 931' ' ' VAL . . . . . 0.572 ' HB ' HG13 ' A' ' 927' ' ' VAL . 60.2 t -70.55 -51.11 40.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.956 -178.507 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 932' ' ' ILE . . . . . 0.449 HD11 HG21 ' A' ' 932' ' ' ILE . 0.0 OUTLIER -63.45 -37.52 79.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-O 120.842 0.353 . . . . 0.0 110.107 179.075 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 933' ' ' LYS . . . . . 0.407 ' N ' HG23 ' A' ' 932' ' ' ILE . 0.5 OUTLIER -60.36 -45.76 92.35 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.32 175.78 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 934' ' ' GLN . . . . . 0.505 ' O ' ' HB2' ' A' ' 938' ' ' LEU . 47.5 mt-30 -67.54 -32.88 73.97 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.086 -178.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 8.6 m -64.67 -48.03 76.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.801 0.334 . . . . 0.0 110.438 178.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 936' ' ' LEU . . . . . 0.584 HD23 ' HG ' ' A' ' 844' ' ' LEU . 1.4 mp -62.93 -48.23 79.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.569 178.217 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 28.3 m -60.56 -44.83 95.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.548 -178.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 938' ' ' LEU . . . . . 0.505 ' HB2' ' O ' ' A' ' 934' ' ' GLN . 0.1 OUTLIER -58.5 -43.17 88.98 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.253 -177.989 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 939' ' ' TYR . . . . . 0.771 ' HE2' ' HB2' ' A' ' 898' ' ' PRO . 4.5 m-85 -79.17 -35.95 41.12 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.097 -177.37 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 940' ' ' ALA . . . . . 0.405 ' O ' HG21 ' A' ' 943' ' ' VAL . . . -62.3 -44.32 96.79 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.864 0.364 . . . . 0.0 110.717 178.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 941' ' ' GLU . . . . . 0.471 ' O ' ' HE2' ' A' ' 945' ' ' LYS . 4.1 pt-20 -70.41 -33.36 71.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.448 178.515 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 942' ' ' ARG . . . . . 0.439 HH11 ' HD2' ' A' ' 942' ' ' ARG . 0.3 OUTLIER -64.34 -48.19 76.51 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.822 -179.336 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 943' ' ' VAL . . . . . 0.405 HG21 ' O ' ' A' ' 940' ' ' ALA . 28.6 m -71.15 -29.71 37.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.828 -179.665 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.85 -47.15 86.36 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.237 178.679 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 945' ' ' LYS . . . . . 0.471 ' HE2' ' O ' ' A' ' 941' ' ' GLU . 0.1 OUTLIER -77.23 -22.47 52.22 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.901 -0.32 . . . . 0.0 111.124 -177.685 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 69.5 m -76.71 -32.84 58.11 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.809 0.338 . . . . 0.0 110.621 175.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.4 -42.59 18.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.079 -178.733 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -101.75 104.48 15.28 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.235 0.541 . . . . 0.0 110.312 178.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.252 1.198 0 CA-C-O 117.858 -1.068 . . . . 0.0 109.512 177.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.943 0 CA-C-O 121.001 0.429 . . . . 0.0 110.588 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . -112.36 143.33 17.55 Favored Glycine 0 N--CA 1.447 -0.624 0 C-N-CA 120.894 -0.669 . . . . 0.0 111.601 178.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . -160.3 120.6 0.97 Allowed Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.317 -0.944 . . . . 0.0 112.742 -177.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -115.56 -42.82 3.09 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.1 0.476 . . . . 0.0 110.103 175.336 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . 72.89 -113.64 4.45 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.422 178.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 5.7 t 58.12 68.21 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.249 0 CA-C-O 121.354 0.597 . . . . 0.0 110.361 -178.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.36 -82.71 0.1 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.489 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . 147.8 40.86 0.04 OUTLIER Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.575 -0.821 . . . . 0.0 112.838 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.467 HD21 ' HA ' ' A' ' 801' ' ' ILE . 0.2 OUTLIER -96.18 -172.23 2.5 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 176.44 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 52.02 77.27 0.15 Allowed 'General case' 0 N--CA 1.464 0.253 0 O-C-N 123.698 0.624 . . . . 0.0 111.976 176.077 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 145.24 -11.9 1.82 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.199 -1.001 . . . . 0.0 112.644 -178.244 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 707' ' ' LYS . . . . . 0.474 ' HB2' HD11 ' A' ' 731' ' ' ILE . 11.3 mmtt -67.27 140.03 57.34 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 175.313 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 708' ' ' ARG . . . . . 0.655 ' HG2' HG22 ' A' ' 732' ' ' VAL . 0.8 OUTLIER -105.31 141.89 36.04 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.037 0.446 . . . . 0.0 111.464 -174.759 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 1.5 m -121.94 110.24 15.61 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.275 174.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 710' ' ' TRP . . . . . 0.567 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 70.0 m95 -91.85 134.21 34.97 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 -178.467 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 711' ' ' LEU . . . . . 0.674 HD21 ' HA ' ' A' ' 735' ' ' THR . 2.2 pt? -131.79 137.94 48.35 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 121.355 0.598 . . . . 0.0 111.264 -177.465 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -126.05 37.38 4.35 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.902 -1.044 . . . . 0.0 109.161 175.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 713' ' ' VAL . . . . . 0.809 ' HB ' ' HB3' ' A' ' 719' ' ' CYS . 2.1 t -87.75 116.34 29.69 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.833 177.751 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 714' ' ' ARG . . . . . 0.413 ' NH2' ' HB2' ' A' ' 751' ' ' GLU . 15.4 mtm180 -84.41 -16.2 43.57 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.439 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 54.9 t-20 -70.57 105.71 3.21 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.214 172.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 716' ' ' ALA . . . . . 0.625 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -60.92 -41.92 97.08 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.677 -174.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.69 -41.3 94.87 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.31 0.576 . . . . 0.0 110.376 179.21 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.74 -49.19 26.79 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.347 -177.891 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 719' ' ' CYS . . . . . 0.809 ' HB3' ' HB ' ' A' ' 713' ' ' VAL . 31.8 p -68.42 -40.68 81.11 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.013 -175.487 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 720' ' ' GLN . . . . . 0.571 ' O ' ' HG3' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -66.44 -39.75 89.09 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.46 -178.947 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -63.17 -46.58 86.43 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 121.165 0.507 . . . . 0.0 110.586 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.72 -47.42 78.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.921 -179.408 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 723' ' ' GLU . . . . . 0.571 ' HG3' ' O ' ' A' ' 720' ' ' GLN . 0.3 OUTLIER -60.12 -42.17 94.2 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.151 -176.75 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 724' ' ' THR . . . . . 0.605 ' O ' ' HG3' ' A' ' 728' ' ' ARG . 91.8 m -64.12 -36.87 85.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.881 0.372 . . . . 0.0 110.784 -179.553 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 725' ' ' SER . . . . . 0.426 ' HA ' ' HE ' ' A' ' 728' ' ' ARG . 19.5 m -70.47 -48.02 57.79 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.665 -179.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 726' ' ' LEU . . . . . 0.43 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 16.3 mt -66.35 -38.92 88.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.905 0.383 . . . . 0.0 111.548 -176.888 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 727' ' ' GLN . . . . . 0.433 ' HG2' ' O ' ' A' ' 723' ' ' GLU . 6.8 pt20 -72.58 -7.39 49.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.545 -177.629 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 728' ' ' ARG . . . . . 0.605 ' HG3' ' O ' ' A' ' 724' ' ' THR . 33.4 mtm180 -79.16 -34.63 42.98 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.112 0.482 . . . . 0.0 110.467 178.681 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -86.25 -24.52 25.98 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.658 -176.57 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 730' ' ' GLY . . . . . . . . . . . . . . . 120.36 14.9 5.22 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.525 -0.845 . . . . 0.0 111.855 -177.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 731' ' ' ILE . . . . . 0.474 HD11 ' HB2' ' A' ' 707' ' ' LYS . 9.6 mm -91.49 114.11 28.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 175.603 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 732' ' ' VAL . . . . . 0.655 HG22 ' HG2' ' A' ' 708' ' ' ARG . 0.0 OUTLIER -77.93 100.52 3.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 121.309 0.575 . . . . 0.0 110.963 -176.492 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 733' ' ' VAL . . . . . . . . . . . . . 1.3 p -74.31 133.12 32.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.056 176.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 7.7 m -141.96 132.16 24.84 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.936 0.398 . . . . 0.0 110.399 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 735' ' ' THR . . . . . 0.674 ' HA ' HD21 ' A' ' 711' ' ' LEU . 0.2 OUTLIER -58.22 124.89 20.96 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.754 176.721 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 736' ' ' TYR . . . . . 0.567 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 31.7 t80 -85.39 81.53 8.71 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.058 0.456 . . . . 0.0 110.536 -179.252 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -58.05 -45.76 86.49 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.503 174.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 149.33 41.83 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.547 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.944 178.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.19 -87.52 0.06 Allowed 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 120.396 0.141 . . . . 0.0 111.263 -176.897 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 740' ' ' GLU . . . . . 0.478 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 1.1 mt-10 -149.59 141.38 14.95 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-O 120.546 0.212 . . . . 0.0 111.23 -175.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 741' ' ' PRO . . . . . 0.609 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 5.3 Cg_endo -88.25 123.32 1.61 Allowed 'Trans proline' 0 N--CA 1.455 -0.744 0 C-N-CA 123.424 2.749 . . . . 0.0 112.239 175.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 742' ' ' THR . . . . . 0.533 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.2 OUTLIER -104.27 138.65 19.58 Favored Pre-proline 0 C--N 1.322 -0.622 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.929 179.073 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 743' ' ' PRO . . . . . 0.533 ' HD2' HG22 ' A' ' 742' ' ' THR . 37.0 Cg_endo -67.43 -7.13 18.24 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.882 2.388 . . . . 0.0 112.764 179.595 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -102.87 -8.72 20.5 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.114 0.483 . . . . 0.0 110.455 177.052 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -111.8 158.97 18.75 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.774 -171.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 27.3 m -120.76 148.55 23.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.173 -176.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 747' ' ' LEU . . . . . 0.553 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 1.0 OUTLIER -117.64 112.24 20.24 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.036 177.766 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 748' ' ' ILE . . . . . 0.867 HG22 ' HB ' ' A' ' 763' ' ' VAL . 0.2 OUTLIER -99.37 107.15 20.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.906 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 176.151 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 749' ' ' THR . . . . . 0.555 ' OG1' HG11 ' A' ' 753' ' ' VAL . 12.6 t -107.39 158.33 17.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.289 0.566 . . . . 0.0 112.079 -173.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 750' ' ' ASP . . . . . 0.44 ' HB2' HG13 ' A' ' 713' ' ' VAL . 3.5 t70 -106.22 129.05 54.34 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.027 175.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 751' ' ' GLU . . . . . 0.413 ' HB2' ' NH2' ' A' ' 714' ' ' ARG . 3.8 mm-40 66.94 -175.75 0.19 Allowed 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.514 0.726 . . . . 0.0 111.988 178.337 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 752' ' ' VAL . . . . . 0.731 HG22 ' HB2' ' A' ' 769' ' ' HIS . 55.9 t -69.88 130.43 34.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.743 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 753' ' ' VAL . . . . . 0.555 HG11 ' OG1' ' A' ' 749' ' ' THR . 0.4 OUTLIER -123.01 158.47 27.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.68 -178.543 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.89 -36.34 25.43 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.208 0.527 . . . . 0.0 110.185 178.533 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 755' ' ' LYS . . . . . 0.481 ' HE2' ' HE2' ' A' ' 736' ' ' TYR . 0.0 OUTLIER -113.24 110.38 20.29 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 176.937 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 756' ' ' LYS . . . . . 0.523 ' H ' ' HG2' ' A' ' 756' ' ' LYS . 0.0 OUTLIER -73.2 -57.59 3.91 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.432 -178.815 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 757' ' ' TRP . . . . . 0.651 ' HB2' ' HB ' ' A' ' 762' ' ' VAL . 2.3 t-105 164.31 162.58 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.459 -169.351 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -147.1 53.27 1.08 Allowed 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 174.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 759' ' ' GLY . . . . . 0.431 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -146.53 -133.98 2.54 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.884 -175.621 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.22 -57.69 5.02 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.722 0.296 . . . . 0.0 111.316 -176.531 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -162.61 145.89 11.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.032 0.444 . . . . 0.0 111.298 -178.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 762' ' ' VAL . . . . . 0.651 ' HB ' ' HB2' ' A' ' 757' ' ' TRP . 2.0 p -118.58 123.23 71.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.838 175.472 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 763' ' ' VAL . . . . . 0.867 ' HB ' HG22 ' A' ' 748' ' ' ILE . 48.0 t -103.74 108.99 25.82 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-O 121.058 0.456 . . . . 0.0 109.812 178.457 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 764' ' ' THR . . . . . 0.412 ' HA ' HG21 ' A' ' 749' ' ' THR . 5.5 m -93.14 112.53 24.51 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.156 -178.554 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 765' ' ' PHE . . . . . 0.481 ' CZ ' ' HG ' ' A' ' 791' ' ' LEU . 34.0 m-85 -83.97 125.99 32.59 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 175.071 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -95.28 133.85 38.71 Favored 'General case' 0 C--N 1.314 -0.944 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.106 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.76 -74.3 0.64 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.37 -0.377 . . . . 0.0 109.986 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 1.7 mmt85 -106.86 -35.38 6.96 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 175.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . 0.731 ' HB2' HG22 ' A' ' 752' ' ' VAL . 5.7 m80 -117.77 155.38 30.14 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.382 175.661 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 770' ' ' ILE . . . . . 0.405 ' O ' HG21 ' A' ' 752' ' ' VAL . 52.1 mt -107.8 -55.01 5.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 176.026 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . 70.7 -74.28 0.6 Allowed Glycine 0 C--N 1.33 0.231 0 CA-C-N 115.749 -0.659 . . . . 0.0 112.373 177.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 772' ' ' ILE . . . . . 0.406 ' HA ' ' HD3' ' A' ' 773' ' ' PRO . 14.6 mm -65.24 122.78 81.78 Favored Pre-proline 0 C--N 1.324 -0.53 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 177.419 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 773' ' ' PRO . . . . . 0.47 ' O ' ' HB3' ' A' ' 774' ' ' LEU . 41.6 Cg_exo -56.91 -72.06 0.03 OUTLIER 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.679 2.252 . . . . 0.0 112.672 -176.107 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . 0.598 ' O ' ' HB3' ' A' ' 780' ' ' GLU . 1.1 pt? 169.83 -153.12 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.277 0 N-CA-C 108.65 -0.871 . . . . 0.0 108.65 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 775' ' ' GLU . . . . . 0.557 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 1.5 mp0 -59.47 69.14 0.01 OUTLIER 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.306 0.574 . . . . 0.0 111.869 170.47 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . 0.464 ' HG3' ' HB2' ' A' ' 773' ' ' PRO . 0.0 OUTLIER -106.28 -38.38 6.25 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.1 174.863 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -103.0 153.21 38.45 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.398 171.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -61.3 98.4 0.15 Allowed 'Trans proline' 0 CA--C 1.529 0.252 0 C-N-CA 122.494 2.129 . . . . 0.0 112.258 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 116.63 -1.24 20.19 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.265 179.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 780' ' ' GLU . . . . . 0.598 ' HB3' ' O ' ' A' ' 774' ' ' LEU . 0.9 OUTLIER -87.69 122.77 31.78 Favored 'General case' 0 C--O 1.219 -0.519 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 -179.546 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 28.2 m95 -132.82 146.78 52.12 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 177.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . 0.541 HG22 ' CB ' ' A' ' 774' ' ' LEU . 33.6 m -136.34 158.26 37.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 176.375 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 783' ' ' HIS . . . . . 0.452 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.0 OUTLIER -172.86 120.27 0.37 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.746 175.044 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.63 101.52 14.2 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 172.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 4.9 p -175.42 158.01 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.191 -176.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -86.85 9.66 18.48 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.038 178.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 58.33 71.87 0.95 Allowed Pre-proline 0 N--CA 1.468 0.427 0 CA-C-N 115.647 -0.706 . . . . 0.0 112.262 177.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 788' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -66.27 -61.8 0.08 OUTLIER 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.35 2.033 . . . . 0.0 111.589 178.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 789' ' ' HIS . . . . . 0.402 ' O ' ' HB3' ' A' ' 793' ' ' ALA . 0.1 OUTLIER -141.25 -31.68 0.57 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.937 0.399 . . . . 0.0 111.153 176.105 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 790' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -61.8 -44.49 96.77 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.802 -0.636 . . . . 0.0 112.659 -170.322 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 791' ' ' LEU . . . . . 0.481 ' HG ' ' CZ ' ' A' ' 765' ' ' PHE . 0.6 OUTLIER -68.93 -53.47 14.47 Favored Pre-proline 0 C--N 1.326 -0.437 0 C-N-CA 120.601 -0.44 . . . . 0.0 111.67 -176.87 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 792' ' ' PRO . . . . . 0.424 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 9.6 Cg_endo -57.03 -32.47 93.23 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 121.554 1.503 . . . . 0.0 112.048 175.736 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 793' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' A' ' 789' ' ' HIS . . . -69.58 -40.99 76.4 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.784 0.326 . . . . 0.0 110.85 177.072 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 794' ' ' LEU . . . . . 0.428 ' HA ' HD23 ' A' ' 794' ' ' LEU . 1.4 tm? -59.63 -44.76 93.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.152 0.501 . . . . 0.0 109.751 177.042 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 795' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.32 -48.56 77.53 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.904 -179.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -61.99 -41.61 98.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.352 -179.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.17 -33.92 76.52 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.88 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -69.31 -32.97 55.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.695 179.57 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -96.29 3.16 53.22 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.4 -179.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 800' ' ' LEU . . . . . 0.421 ' O ' ' HB ' ' A' ' 801' ' ' ILE . 1.2 mp 70.99 -62.83 0.44 Allowed 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.611 0.764 . . . . 0.0 112.482 175.36 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 801' ' ' ILE . . . . . 0.467 ' HA ' HD21 ' A' ' 704' ' ' LEU . 1.7 mp 73.89 -51.47 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 123.454 0.702 . . . . 0.0 111.255 -177.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 73.19 -49.96 0.7 Allowed 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 172.084 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 803' ' ' MET . . . . . . . . . . . . . 6.4 mmt -61.23 -61.56 2.47 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.374 -174.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 804' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -90.6 121.87 32.9 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.261 -0.427 . . . . 0.0 109.909 178.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.92 134.61 44.85 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.837 -176.259 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -76.76 -22.62 53.5 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 174.137 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 21.5 t70 72.27 111.25 0.03 OUTLIER Pre-proline 0 N--CA 1.463 0.183 0 CA-C-N 114.578 -1.192 . . . . 0.0 112.701 171.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 808' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -93.04 24.2 0.47 Allowed 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 123.389 2.726 . . . . 0.0 111.611 173.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . 62.76 49.14 3.85 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.747 -177.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -120.38 89.82 3.2 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.9 179.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -83.83 108.96 17.17 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.57 -179.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -162.32 108.55 1.11 Allowed Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.385 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -81.53 143.02 13.36 Favored 'Trans proline' 0 N--CA 1.461 -0.392 0 C-N-CA 122.494 2.129 . . . . 0.0 112.263 179.125 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.1 115.72 3.98 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.082 176.655 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -118.38 104.65 10.94 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 112.115 0.413 . . . . 0.0 112.115 -173.589 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -138.34 110.81 7.49 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 173.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -134.68 53.77 1.98 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.025 0.441 . . . . 0.0 110.082 -179.528 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -74.04 -35.52 64.33 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.162 -179.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 819' ' ' VAL . . . . . 0.4 ' C ' ' HG ' ' A' ' 820' ' ' SER . 76.5 t -88.34 115.01 27.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.457 -177.339 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 820' ' ' SER . . . . . 0.4 ' HG ' ' C ' ' A' ' 819' ' ' VAL . 0.7 OUTLIER -157.69 150.72 23.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.87 174.751 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 6.1 t0 58.39 71.36 0.59 Allowed 'General case' 0 N--CA 1.466 0.351 0 O-C-N 123.605 0.565 . . . . 0.0 111.914 174.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -103.03 62.73 0.8 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.13 0.49 . . . . 0.0 110.286 178.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -115.88 111.03 19.85 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.764 179.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -127.48 -57.12 1.29 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.806 -176.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 825' ' ' MET . . . . . 0.558 ' HE3' HG12 ' A' ' 871' ' ' ILE . 0.0 OUTLIER -100.19 109.1 21.35 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.747 178.198 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 826' ' ' MET . . . . . 0.571 ' HG3' ' HA ' ' A' ' 869' ' ' ILE . 0.0 OUTLIER -115.37 129.17 56.51 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.113 0.482 . . . . 0.0 110.952 -176.071 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 827' ' ' ILE . . . . . 0.691 HD12 ' HB ' ' A' ' 871' ' ' ILE . 2.9 mm -118.02 127.29 75.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.58 -0.737 . . . . 0.0 109.52 179.371 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 828' ' ' LEU . . . . . 0.555 HD11 HG13 ' A' ' 863' ' ' VAL . 7.7 tp -104.53 130.19 52.5 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.523 0.202 . . . . 0.0 110.748 -177.672 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 829' ' ' VAL . . . . . 0.433 ' H ' HG12 ' A' ' 829' ' ' VAL . 0.3 OUTLIER -112.92 121.78 65.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.98 177.452 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 830' ' ' VAL . . . . . 0.458 HG11 ' HB3' ' A' ' 854' ' ' ALA . 0.2 OUTLIER -115.74 86.85 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.112 178.552 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 831' ' ' ASP . . . . . 0.866 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 55.0 t0 -108.94 134.02 52.16 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.434 -176.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -73.99 -13.72 60.91 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.866 178.547 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 1.1 m80 -109.24 92.65 11.66 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.179 177.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 834' ' ' PRO . . . . . 0.568 ' HA ' ' HD3' ' A' ' 837' ' ' ARG . 2.5 Cg_endo -46.33 -37.66 19.36 Favored 'Trans proline' 0 CA--C 1.534 0.521 0 C-N-CA 123.733 2.955 . . . . 0.0 114.167 -175.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 835' ' ' ILE . . . . . 0.405 HG13 ' H ' ' A' ' 836' ' ' ASN . 1.1 pp -65.3 -42.7 94.44 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 CA-C-O 120.921 0.391 . . . . 0.0 111.74 -178.168 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 836' ' ' ASN . . . . . 0.607 ' HB3' ' OD2' ' A' ' 831' ' ' ASP . 0.3 OUTLIER -69.62 -43.87 71.81 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.506 -0.554 . . . . 0.0 109.506 179.856 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 837' ' ' ARG . . . . . 0.866 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 1.1 ttt-85 -55.64 -40.6 72.41 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.872 -1.058 . . . . 0.0 111.032 177.077 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.75 -39.85 94.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.586 178.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.48 -49.16 67.53 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.211 -177.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 840' ' ' LEU . . . . . 0.547 HD23 ' HA ' ' A' ' 837' ' ' ARG . 2.3 pp -73.95 -27.68 61.13 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.933 -0.307 . . . . 0.0 111.173 -177.138 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -66.15 -32.69 74.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.987 0.422 . . . . 0.0 110.061 174.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -63.62 -45.73 88.95 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.928 176.119 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 843' ' ' GLN . . . . . 0.832 ' HG2' HD22 ' A' ' 929' ' ' LEU . 3.1 mt-30 -60.25 -42.21 94.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.283 175.564 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 844' ' ' LEU . . . . . 0.65 HD22 ' HB ' ' A' ' 827' ' ' ILE . 1.2 mp -58.88 -44.61 91.18 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.004 179.65 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -63.72 -41.43 98.97 Favored Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.905 -0.588 . . . . 0.0 112.326 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 68.8 m -73.19 -13.74 61.22 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.687 0.279 . . . . 0.0 111.331 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 847' ' ' LEU . . . . . 0.607 HD23 ' HA ' ' A' ' 933' ' ' LYS . 0.1 OUTLIER -83.62 -4.93 59.0 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.872 0.368 . . . . 0.0 110.691 176.828 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 87.86 17.06 58.72 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.943 -0.646 . . . . 0.0 112.884 177.091 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -112.11 144.06 42.11 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.726 0.298 . . . . 0.0 110.475 -178.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -75.69 108.25 8.4 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.108 0.48 . . . . 0.0 109.726 -179.723 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 851' ' ' CYS . . . . . 0.472 ' HB3' HD21 ' A' ' 844' ' ' LEU . 0.0 OUTLIER -87.61 122.03 30.8 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.55 -174.942 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 7.0 mptt -107.73 120.58 42.63 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 174.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -99.77 137.79 37.76 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 120.904 0.383 . . . . 0.0 111.852 -173.42 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 854' ' ' ALA . . . . . 0.458 ' HB3' HG11 ' A' ' 830' ' ' VAL . . . -150.41 157.97 43.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.056 176.294 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -149.19 75.56 1.29 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.708 179.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 856' ' ' ASP . . . . . . . . . . . . . 24.4 t70 175.16 136.95 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.828 179.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -65.1 -44.4 94.23 Favored Glycine 0 CA--C 1.519 0.309 0 C-N-CA 120.985 -0.626 . . . . 0.0 113.307 -179.001 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 37.7 t -73.91 -44.98 50.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.029 0.442 . . . . 0.0 110.597 -177.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -66.36 -19.72 65.88 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.154 -176.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -61.72 -39.56 91.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.905 0.383 . . . . 0.0 110.403 174.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 861' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.52 -34.07 65.07 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.226 178.006 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 19.9 t30 -63.28 -41.99 99.06 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.247 176.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 863' ' ' VAL . . . . . 0.555 HG13 HD11 ' A' ' 828' ' ' LEU . 0.4 OUTLIER -70.92 -31.48 45.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.374 177.6 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 864' ' ' LEU . . . . . 0.749 HD21 HD11 ' A' ' 897' ' ' LEU . 0.9 OUTLIER -58.89 -36.0 73.93 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.776 176.151 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -83.58 -38.27 21.87 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.847 179.828 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.69 -52.73 63.88 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.078 0.466 . . . . 0.0 110.645 179.274 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 867' ' ' ASN . . . . . 0.471 ' HB3' ' H ' ' A' ' 868' ' ' HIS . 0.1 OUTLIER -106.19 -127.35 0.25 Allowed 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.798 -0.816 . . . . 0.0 108.798 176.292 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 868' ' ' HIS . . . . . 0.471 ' H ' ' HB3' ' A' ' 867' ' ' ASN . 0.2 OUTLIER -165.19 -56.17 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 110.07 -0.345 . . . . 0.0 110.07 174.371 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 869' ' ' ILE . . . . . 0.571 ' HA ' ' HG3' ' A' ' 826' ' ' MET . 2.4 mp 74.24 140.55 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 O-C-N 123.758 0.661 . . . . 0.0 111.562 174.73 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 870' ' ' ASP . . . . . 0.447 ' N ' HG22 ' A' ' 869' ' ' ILE . 8.7 m-20 -87.43 -57.99 2.75 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.417 -179.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 871' ' ' ILE . . . . . 0.691 ' HB ' HD12 ' A' ' 827' ' ' ILE . 41.4 mm -111.82 126.99 69.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.323 -179.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 872' ' ' VAL . . . . . 0.635 ' HB ' ' HB ' ' A' ' 899' ' ' VAL . 0.1 OUTLIER -105.11 137.02 36.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.788 -178.689 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 873' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -125.0 124.76 42.68 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 173.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 874' ' ' SER . . . . . 0.494 ' HB2' ' HE2' ' A' ' 919' ' ' MET . 1.0 OUTLIER -121.89 101.79 7.78 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 120.989 0.423 . . . . 0.0 109.993 178.95 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 875' ' ' ASP . . . . . 0.891 ' HB3' HG21 ' A' ' 902' ' ' VAL . 0.5 OUTLIER -107.48 115.67 30.56 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 122.013 0.911 . . . . 0.0 110.907 -178.673 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 3.1 p -137.33 128.87 41.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 114.951 -1.022 . . . . 0.0 110.213 -176.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 877' ' ' ASN . . . . . 0.576 ' ND2' ' HB1' ' A' ' 904' ' ' ALA . 1.8 t30 -155.96 64.28 0.58 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.43 0.633 . . . . 0.0 110.393 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 6.8 mmt -154.9 164.12 22.1 Favored Pre-proline 0 C--N 1.32 -0.699 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 176.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 879' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -65.3 66.54 0.33 Allowed 'Trans proline' 0 CA--C 1.532 0.395 0 C-N-CA 122.59 2.194 . . . . 0.0 112.016 174.168 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -78.08 -41.76 34.32 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.694 -0.684 . . . . 0.0 109.742 179.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 10.1 mtp 66.97 11.74 8.55 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.447 176.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -113.76 16.24 18.55 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.248 0.546 . . . . 0.0 110.485 179.139 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -81.79 39.9 2.59 Favored Glycine 0 N--CA 1.451 -0.34 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.406 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 884' ' ' TYR . . . . . 0.433 ' O ' ' HB2' ' A' ' 888' ' ' GLN . 2.7 t80 -138.5 -50.91 0.56 Allowed 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 177.641 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -66.05 -46.54 77.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.64 179.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 886' ' ' LEU . . . . . 0.511 ' HG ' ' N ' ' A' ' 887' ' ' THR . 0.0 OUTLIER -62.97 -45.94 90.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.67 -177.974 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 887' ' ' THR . . . . . 0.511 ' N ' ' HG ' ' A' ' 886' ' ' LEU . 0.0 OUTLIER -65.39 -42.37 92.72 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.075 -179.469 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 888' ' ' GLN . . . . . 0.433 ' HB2' ' O ' ' A' ' 884' ' ' TYR . 0.3 OUTLIER -64.69 -47.3 78.87 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.889 -178.712 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 889' ' ' ARG . . . . . 0.517 ' HD3' ' OE1' ' A' ' 892' ' ' GLN . 13.1 mmt180 -66.54 -32.41 73.75 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.532 -0.303 . . . . 0.0 111.074 -177.537 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 890' ' ' ILE . . . . . . . . . . . . . 5.3 mt -60.55 -51.17 76.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.964 0.412 . . . . 0.0 110.718 178.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 891' ' ' ARG . . . . . 0.599 ' HB3' ' HA2' ' A' ' 918' ' ' GLY . 0.1 OUTLIER -74.67 -31.16 61.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.859 -178.997 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 892' ' ' GLN . . . . . 0.517 ' OE1' ' HD3' ' A' ' 889' ' ' ARG . 7.5 mt-30 -65.61 -41.99 92.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.589 179.313 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 893' ' ' LEU . . . . . 0.477 ' HA ' HD22 ' A' ' 893' ' ' LEU . 0.3 OUTLIER -67.14 -29.21 68.86 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.009 177.218 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 92.7 64.03 1.11 Allowed Glycine 0 N--CA 1.443 -0.842 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.736 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 895' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.26 111.09 3.79 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 178.173 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.66 0.58 56.28 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.14 -176.167 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 897' ' ' LEU . . . . . 0.749 HD11 HD21 ' A' ' 864' ' ' LEU . 0.0 OUTLIER -107.95 135.78 19.82 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.436 176.806 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -67.96 124.78 12.23 Favored 'Trans proline' 0 C--O 1.235 0.338 0 C-N-CA 122.653 2.235 . . . . 0.0 112.32 -177.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 899' ' ' VAL . . . . . 0.867 HG11 ' HA ' ' A' ' 919' ' ' MET . 0.2 OUTLIER -113.62 131.8 64.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 121.573 0.702 . . . . 0.0 110.526 179.783 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 900' ' ' ILE . . . . . 1.03 HG21 ' HG ' ' A' ' 923' ' ' LEU . 0.4 OUTLIER -101.09 117.85 46.95 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.161 178.873 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -91.68 117.06 5.13 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.809 -0.71 . . . . 0.0 111.496 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 902' ' ' VAL . . . . . 0.891 HG21 ' HB3' ' A' ' 875' ' ' ASP . 0.5 OUTLIER -105.66 134.4 47.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.717 0 CA-C-O 121.425 0.631 . . . . 0.0 110.699 -175.921 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -139.73 159.32 42.44 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.344 -175.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 904' ' ' ALA . . . . . 0.581 ' HB3' ' HB2' ' A' ' 925' ' ' LYS . . . -109.95 114.33 27.79 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 122.35 -0.219 . . . . 0.0 110.485 179.157 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 61.02 54.66 3.31 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.667 -178.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -104.33 93.28 4.73 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.36 177.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.37 125.66 21.76 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.598 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . 59.59 48.08 9.97 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.143 -178.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.22 -30.03 70.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.153 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 910' ' ' GLU . . . . . 0.484 ' HA ' ' SG ' ' A' ' 922' ' ' CYS . 0.0 OUTLIER -65.01 -43.99 90.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.014 175.646 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -63.33 -43.25 98.28 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.341 177.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -61.46 -42.38 98.69 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.977 179.17 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.97 -41.52 91.07 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.145 -179.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 69.4 m -69.5 -31.67 70.05 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.862 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.65 -46.25 89.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.94 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 916' ' ' GLU . . . . . 0.517 ' HG2' ' H ' ' A' ' 918' ' ' GLY . 0.0 OUTLIER -77.71 -32.29 52.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.557 178.615 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 917' ' ' SER . . . . . 0.488 ' N ' ' HG2' ' A' ' 916' ' ' GLU . 0.1 OUTLIER 47.03 46.82 16.06 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.383 -178.664 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 918' ' ' GLY . . . . . 0.599 ' HA2' ' HB3' ' A' ' 891' ' ' ARG . . . -122.56 -32.2 0.98 Allowed Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.605 -178.361 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 919' ' ' MET . . . . . 0.867 ' HA ' HG11 ' A' ' 899' ' ' VAL . 3.3 mtt -83.16 -86.87 0.1 Allowed 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 121.206 -0.198 . . . . 0.0 110.5 179.819 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 920' ' ' ASP . . . . . 0.541 ' HB2' ' O ' ' A' ' 919' ' ' MET . 43.8 t0 161.18 -67.72 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.616 0 O-C-N 124.183 0.927 . . . . 0.0 109.276 177.295 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 921' ' ' SER . . . . . 0.919 ' HG ' ' HH ' ' A' ' 939' ' ' TYR . 66.3 m -127.06 -177.87 4.21 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.502 -178.578 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 922' ' ' CYS . . . . . 0.484 ' SG ' ' HA ' ' A' ' 910' ' ' GLU . 0.5 OUTLIER -139.59 145.44 38.58 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.897 0.379 . . . . 0.0 111.094 -177.021 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 923' ' ' LEU . . . . . 1.03 ' HG ' HG21 ' A' ' 900' ' ' ILE . 58.4 mt -130.04 166.73 19.53 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.041 179.346 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 924' ' ' SER . . . . . 0.468 ' O ' HG22 ' A' ' 927' ' ' VAL . 0.7 OUTLIER -91.52 144.75 25.23 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.016 173.971 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 925' ' ' LYS . . . . . 0.673 ' HE2' ' HB2' ' A' ' 875' ' ' ASP . 2.7 tmtt? -58.72 -46.71 99.55 Favored Pre-proline 0 N--CA 1.467 0.38 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 926' ' ' PRO . . . . . 0.483 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 46.7 Cg_endo -69.69 55.38 1.24 Allowed 'Trans proline' 0 C--N 1.355 0.908 0 C-N-CA 122.055 1.837 . . . . 0.0 112.592 174.296 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 927' ' ' VAL . . . . . 0.713 HG21 HG12 ' A' ' 931' ' ' VAL . 0.9 OUTLIER -67.97 129.19 32.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.789 176.786 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.57 167.89 10.86 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.824 179.841 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 929' ' ' LEU . . . . . 0.832 HD22 ' HG2' ' A' ' 843' ' ' GLN . 0.0 OUTLIER -54.9 -45.38 74.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.872 0.367 . . . . 0.0 110.764 179.201 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -64.06 -40.22 95.8 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.912 0.387 . . . . 0.0 110.721 -178.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 931' ' ' VAL . . . . . 0.713 HG12 HG21 ' A' ' 927' ' ' VAL . 13.6 t -65.27 -49.98 75.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.802 -178.743 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 932' ' ' ILE . . . . . 0.58 ' O ' ' HB2' ' A' ' 936' ' ' LEU . 2.9 tp -66.23 -31.4 53.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.812 0.339 . . . . 0.0 110.659 -179.123 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 933' ' ' LYS . . . . . 0.607 ' HA ' HD23 ' A' ' 847' ' ' LEU . 0.3 OUTLIER -66.21 -49.17 68.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.983 178.936 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 934' ' ' GLN . . . . . 0.474 ' HG3' ' N ' ' A' ' 935' ' ' THR . 0.1 OUTLIER -75.22 -42.31 55.75 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.648 -174.375 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 935' ' ' THR . . . . . 0.474 ' N ' ' HG3' ' A' ' 934' ' ' GLN . 3.3 m -70.14 -42.2 72.89 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.531 0.197 . . . . 0.0 111.531 -175.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 936' ' ' LEU . . . . . 0.58 ' HB2' ' O ' ' A' ' 932' ' ' ILE . 0.7 OUTLIER -67.17 -44.54 79.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.695 0.283 . . . . 0.0 110.788 -179.985 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 80.4 m -68.17 -38.66 82.3 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.226 -178.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 938' ' ' LEU . . . . . 0.499 ' O ' ' HB2' ' A' ' 942' ' ' ARG . 0.0 OUTLIER -63.52 -42.18 98.46 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.907 0.384 . . . . 0.0 110.423 178.078 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 939' ' ' TYR . . . . . 0.919 ' HH ' ' HG ' ' A' ' 921' ' ' SER . 0.4 OUTLIER -69.28 -40.91 77.48 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.91 179.311 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -59.15 -47.83 83.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.588 -178.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 941' ' ' GLU . . . . . 0.434 ' HG3' ' N ' ' A' ' 942' ' ' ARG . 3.8 pt-20 -71.53 -32.96 68.74 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.759 0.314 . . . . 0.0 110.598 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 942' ' ' ARG . . . . . 0.499 ' HB2' ' O ' ' A' ' 938' ' ' LEU . 2.3 ttp180 -65.23 -48.26 73.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.315 -178.016 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 18.1 m -70.92 -36.67 64.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 120.962 0.411 . . . . 0.0 111.367 -178.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.3 -38.68 63.27 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.494 -176.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 8.5 pttp -70.76 -35.39 72.6 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.657 0.265 . . . . 0.0 110.669 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 19.8 m -73.03 -23.26 60.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.13 0.491 . . . . 0.0 110.423 177.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.22 -21.57 33.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.371 176.647 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 32.3 t0 55.36 50.82 14.07 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 123.874 0.733 . . . . 0.0 110.826 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 2.1 m . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.532 -0.747 . . . . 0.0 109.807 178.717 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.863 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 109.45 -94.84 0.85 Allowed Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.831 -0.7 . . . . 0.0 112.39 178.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . 90.32 18.57 48.95 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.503 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -119.86 114.15 21.66 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.897 0.38 . . . . 0.0 110.603 -179.31 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . -108.31 135.3 12.75 Favored Glycine 0 N--CA 1.444 -0.798 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.943 -178.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 1.5 t -92.91 -32.26 4.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 174.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 26.4 mp0 -125.91 -158.74 0.86 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.237 -0.892 . . . . 0.0 109.219 175.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . 81.55 -58.19 4.89 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.444 -0.884 . . . . 0.0 111.726 -177.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -78.95 92.2 4.91 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 175.017 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -137.0 94.4 2.95 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.547 -174.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 88.8 3.31 77.26 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.832 -0.699 . . . . 0.0 113.402 171.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.87 137.83 57.46 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 178.326 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 708' ' ' ARG . . . . . . . . . . . . . 3.8 mtt85 -103.02 156.29 17.78 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.215 0.531 . . . . 0.0 111.615 -177.354 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -138.74 128.78 25.34 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.02 -0.991 . . . . 0.0 108.741 174.167 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 710' ' ' TRP . . . . . 0.822 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 96.5 m95 -92.26 129.31 38.24 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.408 0.623 . . . . 0.0 110.468 -176.263 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 711' ' ' LEU . . . . . 0.616 HD21 ' HB2' ' A' ' 719' ' ' CYS . 0.9 OUTLIER -118.1 125.95 51.3 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.668 -172.657 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 712' ' ' ALA . . . . . 0.514 ' HB3' HG23 ' A' ' 749' ' ' THR . . . -126.15 52.7 1.67 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.311 0.577 . . . . 0.0 110.045 177.681 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 713' ' ' VAL . . . . . 0.691 ' HA ' ' HB3' ' A' ' 750' ' ' ASP . 87.5 t -111.95 120.96 63.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.917 179.434 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 714' ' ' ARG . . . . . 0.459 ' NH2' ' HB3' ' A' ' 751' ' ' GLU . 1.9 mtm180 -81.34 -19.57 42.52 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.081 0.467 . . . . 0.0 110.461 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -75.62 100.17 4.54 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.853 176.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 716' ' ' ALA . . . . . 0.6 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -61.68 -35.29 77.57 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.714 -173.936 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -65.07 -46.79 79.74 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.008 0.433 . . . . 0.0 110.44 177.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 718' ' ' LEU . . . . . 0.539 ' HG ' ' HB2' ' A' ' 787' ' ' ALA . 2.3 tt -69.27 -45.17 70.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.762 -179.504 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 719' ' ' CYS . . . . . 0.616 ' HB2' HD21 ' A' ' 711' ' ' LEU . 8.3 p -66.82 -40.68 88.12 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.941 -177.325 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 720' ' ' GLN . . . . . 0.439 ' HB2' ' O ' ' A' ' 716' ' ' ALA . 0.1 OUTLIER -59.95 -41.33 91.63 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-O 120.586 0.232 . . . . 0.0 110.811 177.925 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -56.71 -52.82 63.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.899 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 722' ' ' LEU . . . . . 0.508 HD11 HG23 ' A' ' 748' ' ' ILE . 3.2 mt -67.08 -47.46 71.17 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.094 -178.44 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 723' ' ' GLU . . . . . 0.43 ' HA ' ' CG2' ' A' ' 733' ' ' VAL . 0.3 OUTLIER -61.42 -39.29 90.25 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.278 -174.386 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 724' ' ' THR . . . . . 0.547 ' HA ' ' CG ' ' A' ' 727' ' ' GLN . 88.3 m -73.01 -34.2 66.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.693 0.282 . . . . 0.0 111.155 -178.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 50.4 m -61.98 -36.15 80.62 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.761 0.315 . . . . 0.0 110.933 177.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 726' ' ' LEU . . . . . 0.526 HD11 HG22 ' A' ' 733' ' ' VAL . 1.1 mt -78.42 -41.36 33.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.271 -178.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 727' ' ' GLN . . . . . 0.547 ' CG ' ' HA ' ' A' ' 724' ' ' THR . 1.7 pt20 -74.2 -4.82 38.23 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.973 0.416 . . . . 0.0 111.111 -179.287 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.4 -22.26 65.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.171 175.102 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 729' ' ' SER . . . . . 0.52 ' HB2' ' H ' ' A' ' 730' ' ' GLY . 0.1 OUTLIER -104.38 -107.98 0.28 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.227 177.358 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 730' ' ' GLY . . . . . 0.52 ' H ' ' HB2' ' A' ' 729' ' ' SER . . . -138.93 25.55 2.79 Favored Glycine 0 CA--C 1.51 -0.239 0 N-CA-C 110.922 -0.871 . . . . 0.0 110.922 179.134 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 731' ' ' ILE . . . . . 0.431 ' O ' ' HA ' ' A' ' 727' ' ' GLN . 1.0 OUTLIER -107.47 146.68 13.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 -178.067 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 732' ' ' VAL . . . . . . . . . . . . . 2.1 p -123.36 131.57 72.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.043 0.449 . . . . 0.0 110.981 -176.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 733' ' ' VAL . . . . . 0.526 HG22 HD11 ' A' ' 726' ' ' LEU . 3.7 t -101.44 147.56 8.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 177.768 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -149.01 141.61 24.41 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.816 0.341 . . . . 0.0 111.057 -173.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -59.48 118.21 5.77 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.829 178.325 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 736' ' ' TYR . . . . . 0.822 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 36.5 t80 -85.31 91.01 8.06 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.189 0.519 . . . . 0.0 110.833 -179.494 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 737' ' ' GLU . . . . . 0.497 ' HB2' ' H ' ' A' ' 738' ' ' GLY . 0.0 OUTLIER -93.46 -128.66 0.12 Allowed 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.312 172.061 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 738' ' ' GLY . . . . . 0.497 ' H ' ' HB2' ' A' ' 737' ' ' GLU . . . -80.93 59.33 4.75 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.615 -0.803 . . . . 0.0 112.398 178.155 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 739' ' ' GLN . . . . . 0.483 ' HG2' ' CH2' ' A' ' 710' ' ' TRP . 0.9 OUTLIER -107.37 176.24 5.22 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 -179.049 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 740' ' ' GLU . . . . . 0.419 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 1.1 mt-10 -87.0 141.02 32.91 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.788 -177.918 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 741' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 740' ' ' GLU . 5.4 Cg_endo -87.69 121.39 1.55 Allowed 'Trans proline' 0 N--CA 1.453 -0.888 0 C-N-CA 123.023 2.482 . . . . 0.0 111.585 175.031 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 742' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.16 136.24 20.5 Favored Pre-proline 0 C--N 1.32 -0.708 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.444 -174.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 743' ' ' PRO . . . . . 0.752 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 31.8 Cg_endo -65.89 -9.62 23.79 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 123.045 2.497 . . . . 0.0 112.644 177.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -101.84 -1.1 32.97 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.657 175.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 37.2 m-20 -110.79 150.85 28.52 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.894 0.378 . . . . 0.0 110.911 -174.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 2.4 p -117.23 136.75 53.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.449 -178.057 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 747' ' ' LEU . . . . . 0.474 HD21 ' N ' ' A' ' 748' ' ' ILE . 0.4 OUTLIER -100.45 136.8 39.76 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.015 -0.538 . . . . 0.0 109.984 177.707 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 748' ' ' ILE . . . . . 0.508 HG23 HD11 ' A' ' 722' ' ' LEU . 18.0 mt -120.12 107.69 21.52 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 171.22 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 749' ' ' THR . . . . . 0.514 HG23 ' HB3' ' A' ' 712' ' ' ALA . 0.0 OUTLIER -106.05 164.79 11.69 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.813 -0.631 . . . . 0.0 112.159 -170.536 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 750' ' ' ASP . . . . . 0.691 ' HB3' ' HA ' ' A' ' 713' ' ' VAL . 0.0 OUTLIER -129.01 129.34 45.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.936 173.751 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 751' ' ' GLU . . . . . 0.97 ' HG2' ' H ' ' A' ' 752' ' ' VAL . 20.7 tt0 65.3 -178.44 0.18 Allowed 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.682 0.753 . . . . 0.0 111.697 -179.741 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 752' ' ' VAL . . . . . 0.97 ' H ' ' HG2' ' A' ' 751' ' ' GLU . 4.5 p -61.66 132.55 27.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 114.917 -1.038 . . . . 0.0 111.294 178.176 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 8.1 p -129.69 153.77 39.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.168 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -96.54 40.95 1.12 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.758 0.313 . . . . 0.0 111.559 -177.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 755' ' ' LYS . . . . . 0.413 ' O ' HD11 ' A' ' 772' ' ' ILE . 0.0 OUTLIER -148.08 154.29 40.02 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 177.722 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 756' ' ' LYS . . . . . 0.417 ' O ' ' HB3' ' A' ' 757' ' ' TRP . 3.7 tptp -102.24 -37.6 8.03 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 121.316 -0.154 . . . . 0.0 111.271 -177.182 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 757' ' ' TRP . . . . . 0.513 ' CD1' ' HB ' ' A' ' 762' ' ' VAL . 63.5 t-105 72.1 105.34 0.07 Allowed 'General case' 0 N--CA 1.468 0.432 0 O-C-N 123.88 0.737 . . . . 0.0 111.312 179.273 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 4.9 mm100 -100.27 84.4 2.81 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.061 177.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 759' ' ' GLY . . . . . 0.752 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -144.71 -149.08 4.97 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.574 -0.822 . . . . 0.0 113.134 -177.534 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.97 -53.74 45.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.238 0.542 . . . . 0.0 109.872 -179.566 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -164.04 156.3 17.1 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.068 178.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 762' ' ' VAL . . . . . 0.513 ' HB ' ' CD1' ' A' ' 757' ' ' TRP . 2.4 p -134.39 113.71 17.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 175.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -111.67 105.87 19.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.22 -177.65 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 764' ' ' THR . . . . . 0.414 ' HB ' HG11 ' A' ' 782' ' ' VAL . 68.1 m -99.23 120.48 39.61 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.546 -177.218 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 765' ' ' PHE . . . . . 0.615 ' HE1' HG23 ' A' ' 785' ' ' VAL . 8.8 m-85 -76.64 130.34 37.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.138 175.424 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 766' ' ' CYS . . . . . 0.527 ' O ' ' HA ' ' A' ' 784' ' ' SER . 3.2 m -105.25 131.45 52.69 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-O 120.968 0.413 . . . . 0.0 109.964 176.201 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.6 22.54 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 178.687 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 768' ' ' ARG . . . . . 0.494 ' HB3' ' H ' ' A' ' 769' ' ' HIS . 0.0 OUTLIER -157.66 -104.24 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.8 -1.091 . . . . 0.0 108.424 -177.088 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . 0.494 ' H ' ' HB3' ' A' ' 768' ' ' ARG . 0.2 OUTLIER -111.13 147.77 34.15 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 109.921 -0.399 . . . . 0.0 109.921 171.409 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 770' ' ' ILE . . . . . 0.463 HG23 ' N ' ' A' ' 771' ' ' GLY . 4.6 mt -106.81 154.05 7.86 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.802 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.867 -179.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 771' ' ' GLY . . . . . 0.697 ' HA3' HG23 ' A' ' 752' ' ' VAL . . . -151.09 -39.65 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.871 -0.68 . . . . 0.0 111.765 -179.451 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 772' ' ' ILE . . . . . 0.443 ' HA ' ' HD3' ' A' ' 773' ' ' PRO . 32.9 mm -88.42 131.26 42.76 Favored Pre-proline 0 C--N 1.324 -0.503 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 176.608 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 773' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 772' ' ' ILE . 12.1 Cg_exo -70.64 172.98 12.45 Favored 'Trans proline' 0 N--CA 1.463 -0.316 0 C-N-CA 122.759 2.306 . . . . 0.0 111.936 178.43 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . 0.544 ' HB3' HG23 ' A' ' 782' ' ' VAL . 0.7 OUTLIER -90.16 -152.57 0.26 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.734 -179.045 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 775' ' ' GLU . . . . . 0.528 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 1.2 mp0 -62.21 72.42 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.61 -21.47 30.33 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 168.177 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 777' ' ' ALA . . . . . 0.453 ' HB3' ' HG3' ' A' ' 780' ' ' GLU . . . -143.1 155.35 62.02 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 114.321 -1.309 . . . . 0.0 109.102 179.623 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -65.22 78.08 0.23 Allowed 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.891 2.394 . . . . 0.0 111.731 175.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 163.59 -28.31 0.23 Allowed Glycine 0 N--CA 1.447 -0.604 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.54 -178.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 780' ' ' GLU . . . . . 0.528 ' O ' ' HG3' ' A' ' 775' ' ' GLU . 3.5 mt-10 -89.04 121.95 31.89 Favored 'General case' 0 C--O 1.222 -0.39 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 179.385 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 781' ' ' TRP . . . . . 0.505 ' CZ3' HD13 ' A' ' 794' ' ' LEU . 34.4 m95 -139.38 139.0 37.06 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.929 0.395 . . . . 0.0 110.647 -178.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . 0.544 HG23 ' HB3' ' A' ' 774' ' ' LEU . 28.5 m -138.37 153.52 26.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 169.334 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 783' ' ' HIS . . . . . . . . . . . . . 4.9 t-160 -155.88 120.7 4.71 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.765 0.317 . . . . 0.0 110.454 176.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 784' ' ' SER . . . . . 0.527 ' HA ' ' O ' ' A' ' 766' ' ' CYS . 0.4 OUTLIER -84.73 100.86 11.77 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.059 178.268 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 785' ' ' VAL . . . . . 0.615 HG23 ' HE1' ' A' ' 765' ' ' PHE . 0.0 OUTLIER -162.01 -178.51 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.53 178.548 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -113.8 31.87 6.23 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.79 0.329 . . . . 0.0 110.572 178.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 787' ' ' ALA . . . . . 0.539 ' HB2' ' HG ' ' A' ' 718' ' ' LEU . . . 59.46 73.19 0.7 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.009 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 788' ' ' PRO . . . . . 0.66 ' HD2' ' OE1' ' A' ' 790' ' ' GLU . 12.0 Cg_exo -71.8 -67.91 0.02 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.711 2.274 . . . . 0.0 110.947 173.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 1.4 p-80 176.45 28.48 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 122.784 0.434 . . . . 0.0 110.816 175.246 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 790' ' ' GLU . . . . . 0.66 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -101.25 -43.83 5.85 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.02 0.438 . . . . 0.0 110.265 -177.923 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 791' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.66 -47.47 56.21 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 115.822 -0.627 . . . . 0.0 111.788 179.07 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 792' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_exo -57.25 -33.65 96.4 Favored 'Trans proline' 0 C--N 1.359 1.102 0 C-N-CA 121.701 1.6 . . . . 0.0 111.58 175.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -68.61 -41.76 79.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.584 177.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 794' ' ' LEU . . . . . 0.505 HD13 ' CZ3' ' A' ' 781' ' ' TRP . 0.3 OUTLIER -69.57 -28.43 65.96 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.878 178.431 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 795' ' ' LEU . . . . . 0.441 ' HA ' HD21 ' A' ' 795' ' ' LEU . 0.2 OUTLIER -63.88 -40.5 96.69 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.959 -0.386 . . . . 0.0 109.959 177.521 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -68.71 -34.61 75.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.025 0.44 . . . . 0.0 110.764 176.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.9 -49.05 64.15 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.666 179.681 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -66.09 -31.17 52.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.595 177.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -62.16 -34.4 76.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.024 177.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 4.6 mt 58.47 74.62 0.43 Allowed 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.409 -178.253 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 801' ' ' ILE . . . . . 0.428 HG23 ' HB2' ' A' ' 803' ' ' MET . 3.4 mt -62.74 -36.47 75.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.722 -179.3 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 60.83 45.06 10.2 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.745 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 803' ' ' MET . . . . . 0.428 ' HB2' HG23 ' A' ' 801' ' ' ILE . 0.4 OUTLIER -140.16 139.18 35.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.061 176.541 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 804' ' ' GLU . . . . . 0.483 ' H ' ' HG3' ' A' ' 804' ' ' GLU . 0.0 OUTLIER -82.05 -100.86 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 121.008 -0.277 . . . . 0.0 111.082 -177.155 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 805' ' ' SER . . . . . 0.409 ' H ' ' HB2' ' A' ' 804' ' ' GLU . 0.1 OUTLIER -164.75 172.65 12.74 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.286 0.565 . . . . 0.0 111.911 -176.313 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -130.11 114.62 15.97 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.305 -0.861 . . . . 0.0 108.793 174.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -136.93 101.22 9.54 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-O 120.688 0.28 . . . . 0.0 110.997 -174.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 808' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -80.47 39.21 0.82 Allowed 'Trans proline' 0 N--CA 1.463 -0.312 0 C-N-CA 123.378 2.718 . . . . 0.0 112.155 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -76.75 92.44 3.57 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.952 0.406 . . . . 0.0 111.091 -178.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -161.56 144.72 12.36 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.706 178.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -152.17 169.9 21.29 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.83 0.347 . . . . 0.0 111.394 -177.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -150.53 131.1 7.08 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.732 177.659 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -80.1 164.18 22.36 Favored 'Trans proline' 0 CA--C 1.53 0.298 0 C-N-CA 122.87 2.38 . . . . 0.0 113.367 -177.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -115.36 132.89 56.47 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.898 176.63 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -149.43 129.9 13.9 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.733 -0.212 . . . . 0.0 110.98 -179.026 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -150.01 126.86 11.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.893 0.378 . . . . 0.0 111.211 177.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.24 157.04 44.16 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.549 176.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -160.57 117.57 2.41 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.983 0.421 . . . . 0.0 111.822 -178.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 43.7 t -91.66 119.14 38.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 172.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -117.2 103.35 10.11 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.881 0.372 . . . . 0.0 111.351 -175.055 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -151.79 112.8 4.25 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.069 175.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 822' ' ' ASN . . . . . 0.476 ' HB3' ' H ' ' A' ' 823' ' ' ASP . 10.8 t-20 -94.46 -104.87 0.14 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.303 -176.433 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 823' ' ' ASP . . . . . 0.476 ' H ' ' HB3' ' A' ' 822' ' ' ASN . 12.0 t0 -167.35 162.75 14.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.854 0.359 . . . . 0.0 110.311 -177.404 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -138.31 47.27 2.0 Allowed 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 178.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 2.6 mtt -76.41 120.45 21.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.237 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 826' ' ' MET . . . . . . . . . . . . . 37.0 ttm -94.02 121.36 35.42 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.288 0.566 . . . . 0.0 111.579 -177.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 827' ' ' ILE . . . . . 0.46 HG22 HD12 ' A' ' 827' ' ' ILE . 13.6 mm -112.91 130.74 66.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 114.966 -1.015 . . . . 0.0 109.087 175.292 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 828' ' ' LEU . . . . . 0.57 HD22 HG22 ' A' ' 872' ' ' VAL . 34.6 tp -95.21 114.41 26.2 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.196 0.522 . . . . 0.0 110.024 -179.717 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 829' ' ' VAL . . . . . 0.857 ' HB ' ' HD2' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -103.09 107.31 21.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.033 -178.94 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 830' ' ' VAL . . . . . 0.6 HG22 ' HB2' ' A' ' 854' ' ' ALA . 8.9 t -109.2 130.85 61.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.197 179.59 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 831' ' ' ASP . . . . . 0.747 ' HB2' ' NE ' ' A' ' 837' ' ' ARG . 8.6 t0 -135.97 146.01 46.79 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 175.036 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.49 -17.9 62.32 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.234 0.54 . . . . 0.0 109.802 173.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 7.6 m80 -108.25 103.43 50.51 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.393 175.247 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_exo -57.34 -48.85 15.73 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 123.123 2.548 . . . . 0.0 113.984 -173.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 835' ' ' ILE . . . . . 0.417 HD11 ' HA ' ' A' ' 835' ' ' ILE . 0.3 OUTLIER -63.94 -35.62 74.0 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-O 120.957 0.408 . . . . 0.0 110.185 -178.164 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 836' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -62.46 -49.02 77.09 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.62 177.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 837' ' ' ARG . . . . . 0.857 ' HD2' ' HB ' ' A' ' 829' ' ' VAL . 0.0 OUTLIER -60.27 -47.0 87.87 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.633 -178.915 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.79 -31.11 72.18 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 123.112 0.258 . . . . 0.0 111.144 -176.256 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 839' ' ' LEU . . . . . 0.435 ' HA ' HD23 ' A' ' 839' ' ' LEU . 0.2 OUTLIER -76.82 -47.43 21.48 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.388 -176.19 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 840' ' ' LEU . . . . . . . . . . . . . 2.6 pp -73.36 -26.1 60.87 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.537 178.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -67.61 -29.7 69.1 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 173.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -64.57 -43.34 94.2 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 174.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 843' ' ' GLN . . . . . 0.522 ' HB3' HD21 ' A' ' 929' ' ' LEU . 8.1 mm-40 -61.24 -41.23 96.53 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.413 175.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 844' ' ' LEU . . . . . 0.606 HD12 HD11 ' A' ' 932' ' ' ILE . 0.1 OUTLIER -58.88 -35.14 72.52 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.373 175.397 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -71.27 -35.22 63.83 Favored Glycine 0 N--CA 1.449 -0.468 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.053 177.072 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.62 -16.73 63.44 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 120.958 0.408 . . . . 0.0 110.431 176.715 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 847' ' ' LEU . . . . . 0.432 HD23 ' HG3' ' A' ' 933' ' ' LYS . 24.3 mt -80.19 -12.42 59.64 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.588 176.03 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 92.4 19.8 37.28 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 121.018 -0.61 . . . . 0.0 112.784 178.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 31.1 m-85 -110.82 163.28 13.95 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.632 0.253 . . . . 0.0 110.611 -179.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.81 108.06 20.66 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.255 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -98.77 135.74 39.81 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.669 -178.08 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.71 128.06 55.6 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 173.537 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.66 131.86 40.0 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.291 0.567 . . . . 0.0 112.19 -173.237 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 854' ' ' ALA . . . . . 0.6 ' HB2' HG22 ' A' ' 830' ' ' VAL . . . -140.01 156.95 46.38 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.631 175.379 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 855' ' ' ASN . . . . . 0.593 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 0.1 OUTLIER -146.04 71.77 1.27 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.229 0.537 . . . . 0.0 111.667 -179.149 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 856' ' ' ASP . . . . . 0.593 ' HB2' ' O ' ' A' ' 855' ' ' ASN . 3.9 t70 162.96 174.52 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.209 1.004 . . . . 0.0 108.769 175.191 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 857' ' ' GLY . . . . . 0.467 ' CA ' HD13 ' A' ' 886' ' ' LEU . . . -83.93 -39.19 9.58 Favored Glycine 0 N--CA 1.446 -0.684 0 N-CA-C 110.878 -0.889 . . . . 0.0 110.878 175.787 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 858' ' ' VAL . . . . . 0.418 ' O ' ' HB2' ' A' ' 862' ' ' ASN . 6.7 m -73.41 -31.56 33.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.811 0.338 . . . . 0.0 110.297 177.488 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -65.59 -48.72 71.37 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.521 178.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -62.66 -42.42 99.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.411 -179.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 861' ' ' LEU . . . . . 0.413 HD12 ' HA ' ' A' ' 890' ' ' ILE . 56.3 tp -69.26 -38.19 78.29 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.877 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 862' ' ' ASN . . . . . 0.418 ' HB2' ' O ' ' A' ' 858' ' ' VAL . 33.7 t30 -57.83 -54.93 41.35 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.9 -179.29 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 863' ' ' VAL . . . . . 0.429 HG11 ' N ' ' A' ' 864' ' ' LEU . 8.1 p -63.09 -31.49 52.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.646 179.515 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 864' ' ' LEU . . . . . 0.571 HD21 HD21 ' A' ' 897' ' ' LEU . 0.6 OUTLIER -64.39 -36.69 84.96 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.02 178.673 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -76.3 -24.73 54.38 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.263 0.554 . . . . 0.0 110.255 179.627 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.44 -53.21 8.44 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.015 179.413 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -135.31 144.57 46.81 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.207 -175.786 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -70.4 138.24 51.13 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.184 0.516 . . . . 0.0 111.792 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 869' ' ' ILE . . . . . 0.468 HD11 HD23 ' A' ' 864' ' ' LEU . 5.6 mt -131.69 139.42 50.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 175.514 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -77.06 -59.39 2.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.863 0.363 . . . . 0.0 111.197 -173.936 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 871' ' ' ILE . . . . . . . . . . . . . 1.1 mp -117.95 130.46 72.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 CA-C-O 120.908 0.385 . . . . 0.0 110.141 -179.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 872' ' ' VAL . . . . . 0.57 HG22 HD22 ' A' ' 828' ' ' LEU . 53.8 t -123.42 125.11 71.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.21 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 873' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -118.74 131.63 56.13 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.9 0.381 . . . . 0.0 110.268 178.391 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -109.8 101.2 10.09 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.699 -178.125 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 875' ' ' ASP . . . . . 0.543 ' OD1' HG22 ' A' ' 902' ' ' VAL . 0.3 OUTLIER -90.48 118.15 29.73 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.466 -179.368 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -131.58 117.04 33.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-O 120.883 0.373 . . . . 0.0 111.229 179.13 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -62.61 -61.03 2.71 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 172.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.43 123.9 15.68 Favored Pre-proline 0 C--N 1.319 -0.749 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 168.202 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 879' ' ' PRO . . . . . 0.602 ' HB2' ' HA3' ' A' ' 883' ' ' GLY . 57.9 Cg_endo -72.16 49.8 1.41 Allowed 'Trans proline' 0 CA--C 1.532 0.385 0 C-N-CA 122.781 2.321 . . . . 0.0 113.419 -176.3 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 60.4 t30 63.14 -84.04 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.309 0.644 . . . . 0.0 111.119 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -179.22 -36.59 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 882' ' ' ASP . . . . . 0.479 ' O ' ' HB3' ' A' ' 885' ' ' ARG . 5.1 p-10 -101.68 28.41 5.63 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.53 -1.214 . . . . 0.0 110.08 176.706 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 883' ' ' GLY . . . . . 0.602 ' HA3' ' HB2' ' A' ' 879' ' ' PRO . . . -59.46 -17.83 41.55 Favored Glycine 0 C--N 1.333 0.367 0 CA-C-N 115.593 -0.73 . . . . 0.0 113.717 -174.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 884' ' ' TYR . . . . . 0.775 ' HH ' HE21 ' A' ' 888' ' ' GLN . 0.0 OUTLIER -59.27 -28.89 67.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.5 0.667 . . . . 0.0 109.562 176.68 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 885' ' ' ARG . . . . . 0.479 ' HB3' ' O ' ' A' ' 882' ' ' ASP . 0.0 OUTLIER -61.02 -31.68 71.3 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.144 -0.934 . . . . 0.0 110.728 -179.275 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 886' ' ' LEU . . . . . 0.47 ' N ' ' HD2' ' A' ' 885' ' ' ARG . 0.0 OUTLIER -67.7 -47.63 68.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.748 0.308 . . . . 0.0 110.299 -178.768 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 887' ' ' THR . . . . . 0.417 ' N ' ' HG ' ' A' ' 886' ' ' LEU . 0.0 OUTLIER -69.53 -38.46 77.52 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.311 0.577 . . . . 0.0 110.655 -178.704 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 888' ' ' GLN . . . . . 0.775 HE21 ' HH ' ' A' ' 884' ' ' TYR . 5.5 tp-100 -62.83 -51.29 67.6 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.745 177.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 889' ' ' ARG . . . . . 0.457 ' HB2' ' O ' ' A' ' 885' ' ' ARG . 0.0 OUTLIER -62.48 -42.78 99.72 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.988 -174.432 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 890' ' ' ILE . . . . . 0.413 ' HA ' HD12 ' A' ' 861' ' ' LEU . 1.4 tt -67.96 -41.27 84.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 120.857 -0.337 . . . . 0.0 111.411 -176.298 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 891' ' ' ARG . . . . . 0.43 ' HA ' HD21 ' A' ' 895' ' ' LEU . 0.1 OUTLIER -75.31 -27.03 59.14 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.675 0.274 . . . . 0.0 111.26 179.717 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 30.4 tp60 -77.63 -37.16 50.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.046 -179.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 893' ' ' LEU . . . . . 0.408 ' HB2' HD21 ' A' ' 861' ' ' LEU . 0.5 OUTLIER -73.97 -32.35 63.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.751 179.764 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 121.91 83.11 0.67 Allowed Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.877 176.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 895' ' ' LEU . . . . . 0.54 HD13 HG21 ' A' ' 899' ' ' VAL . 0.2 OUTLIER -89.09 135.99 33.26 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 110.236 -0.283 . . . . 0.0 110.236 178.035 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -131.48 26.5 4.76 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.919 0.39 . . . . 0.0 111.532 -177.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 897' ' ' LEU . . . . . 0.571 HD21 HD21 ' A' ' 864' ' ' LEU . 0.0 OUTLIER -145.56 154.65 52.8 Favored Pre-proline 0 C--N 1.323 -0.56 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.311 -175.784 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -63.67 110.6 1.3 Allowed 'Trans proline' 0 C--O 1.236 0.41 0 C-N-CA 122.72 2.28 . . . . 0.0 112.16 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 899' ' ' VAL . . . . . 0.54 HG21 HD13 ' A' ' 895' ' ' LEU . 26.7 t -100.95 112.94 35.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.44 0.638 . . . . 0.0 110.643 177.783 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 900' ' ' ILE . . . . . 0.678 HG21 ' HB2' ' A' ' 921' ' ' SER . 2.0 mt -90.45 106.63 17.55 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.812 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.303 179.512 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 901' ' ' GLY . . . . . 0.58 ' O ' ' HA ' ' A' ' 922' ' ' CYS . . . -85.91 119.09 5.01 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 120.755 -0.736 . . . . 0.0 111.511 178.679 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 902' ' ' VAL . . . . . 0.543 HG22 ' OD1' ' A' ' 875' ' ' ASP . 0.1 OUTLIER -124.12 119.5 56.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-O 121.084 0.468 . . . . 0.0 110.251 -178.203 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 903' ' ' THR . . . . . 0.43 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.0 OUTLIER -120.02 160.05 23.56 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.981 -176.193 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 904' ' ' ALA . . . . . 0.588 ' HA ' ' HB2' ' A' ' 925' ' ' LYS . . . -72.48 139.41 47.63 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 173.13 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -64.68 105.36 0.97 Allowed 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.091 0.472 . . . . 0.0 110.451 -177.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -117.99 -42.93 2.78 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.509 -0.769 . . . . 0.0 111.195 -174.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -158.76 -73.97 0.08 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.363 -176.136 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -161.58 55.22 0.27 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.308 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 909' ' ' GLU . . . . . 0.404 ' HG3' ' H ' ' A' ' 909' ' ' GLU . 0.0 OUTLIER -65.88 -29.84 70.34 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.456 -177.232 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 910' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.67 -37.49 76.13 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.537 174.924 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -67.77 -41.57 83.06 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.303 178.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -62.28 -37.14 84.35 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.405 177.414 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.17 -37.37 85.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.508 177.288 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 76.9 m -65.97 -33.54 76.05 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.321 176.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.97 -39.69 75.82 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.637 176.451 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -66.22 -52.02 51.93 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.138 -178.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 46.6 48.18 14.34 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -133.0 -33.41 0.37 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.937 176.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 919' ' ' MET . . . . . 0.534 ' O ' ' HB2' ' A' ' 920' ' ' ASP . 12.8 mtt -65.76 -80.96 0.03 OUTLIER 'General case' 0 C--O 1.236 0.394 0 CA-C-O 120.654 0.264 . . . . 0.0 111.386 179.254 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 920' ' ' ASP . . . . . 0.534 ' HB2' ' O ' ' A' ' 919' ' ' MET . 12.4 t70 168.54 -85.53 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.788 177.067 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 921' ' ' SER . . . . . 0.678 ' HB2' HG21 ' A' ' 900' ' ' ILE . 0.0 OUTLIER -109.33 175.79 5.32 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.151 -173.562 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 922' ' ' CYS . . . . . 0.58 ' HA ' ' O ' ' A' ' 901' ' ' GLY . 0.0 OUTLIER -146.43 137.54 24.34 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 120.753 0.311 . . . . 0.0 111.501 -179.925 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 923' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -143.0 -175.81 4.66 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.846 175.387 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 924' ' ' SER . . . . . 0.578 ' HB3' ' HD2' ' A' ' 926' ' ' PRO . 0.5 OUTLIER -114.35 150.53 34.43 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.744 0.307 . . . . 0.0 110.776 -179.644 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 925' ' ' LYS . . . . . 0.588 ' HB2' ' HA ' ' A' ' 904' ' ' ALA . 0.0 OUTLIER -50.56 -40.29 59.5 Favored Pre-proline 0 CA--C 1.54 0.579 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 -175.515 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 926' ' ' PRO . . . . . 0.578 ' HD2' ' HB3' ' A' ' 924' ' ' SER . 40.8 Cg_exo -61.08 72.33 0.08 OUTLIER 'Trans proline' 0 C--N 1.361 1.187 0 C-N-CA 121.892 1.728 . . . . 0.0 113.286 174.503 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 927' ' ' VAL . . . . . 0.681 HG12 HG12 ' A' ' 931' ' ' VAL . 3.8 t -107.44 124.75 63.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.92 177.08 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 928' ' ' THR . . . . . 0.537 ' OG1' ' HB ' ' A' ' 931' ' ' VAL . 3.0 p -88.89 171.0 10.23 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.162 -179.345 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 929' ' ' LEU . . . . . 0.522 HD21 ' HB3' ' A' ' 843' ' ' GLN . 1.3 tm? -63.47 -46.33 86.68 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.864 0.364 . . . . 0.0 110.087 176.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -63.76 -42.15 97.86 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.832 0.348 . . . . 0.0 110.858 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 931' ' ' VAL . . . . . 0.681 HG12 HG12 ' A' ' 927' ' ' VAL . 0.8 OUTLIER -68.37 -32.41 55.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.656 179.618 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 932' ' ' ILE . . . . . 0.629 ' O ' ' HB2' ' A' ' 936' ' ' LEU . 0.4 OUTLIER -64.68 -40.06 87.77 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.255 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 175.565 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 933' ' ' LYS . . . . . 0.432 ' HG3' HD23 ' A' ' 847' ' ' LEU . 5.2 ttmt -66.17 -45.95 79.09 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.545 178.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -61.5 -53.81 51.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.24 -179.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 3.6 m -65.07 -39.35 93.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.189 -177.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 936' ' ' LEU . . . . . 0.629 ' HB2' ' O ' ' A' ' 932' ' ' ILE . 4.9 tp -60.85 -48.15 83.14 Favored 'General case' 0 C--O 1.223 -0.308 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.316 177.368 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 93.2 m -62.93 -41.58 99.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.169 -179.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.66 -46.89 87.67 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.105 0.478 . . . . 0.0 111.456 -179.362 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -78.51 -32.84 48.31 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.218 -177.443 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 940' ' ' ALA . . . . . 0.478 ' O ' ' HB2' ' A' ' 944' ' ' ARG . . . -66.94 -41.41 87.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.945 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 941' ' ' GLU . . . . . 0.576 ' HG3' ' N ' ' A' ' 942' ' ' ARG . 0.2 OUTLIER -66.94 -35.78 80.74 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.84 -0.429 . . . . 0.0 109.84 176.795 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 942' ' ' ARG . . . . . 0.576 ' N ' ' HG3' ' A' ' 941' ' ' GLU . 0.0 OUTLIER -60.23 -48.43 81.78 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.855 -179.764 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 13.7 m -76.11 -30.21 20.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.021 -179.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 944' ' ' ARG . . . . . 0.478 ' HB2' ' O ' ' A' ' 940' ' ' ALA . 0.0 OUTLIER -65.47 -41.26 93.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.178 179.67 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 945' ' ' LYS . . . . . 0.451 ' HG2' ' O ' ' A' ' 942' ' ' ARG . 4.4 pttt -71.9 -31.31 66.27 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.706 179.615 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 15.0 m -68.96 -35.51 76.84 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 120.879 0.371 . . . . 0.0 110.952 174.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 3.1 ttm180 -77.52 -19.89 55.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.531 178.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 15.3 t0 63.04 54.34 2.15 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.129 177.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.074 -0.965 . . . . 0.0 109.772 178.046 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 1.7 ttm . . . . . 0 N--CA 1.478 0.953 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 126.24 -35.37 2.98 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.15 -179.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . 84.06 -166.91 43.06 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.696 178.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 4.2 m -119.55 152.37 37.1 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.775 0.321 . . . . 0.0 110.288 -178.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . -92.82 -145.64 17.23 Favored Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.726 -177.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . 0.449 ' H ' HG21 ' A' ' 701' ' ' VAL . 0.2 OUTLIER -90.98 165.25 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.137 0.494 . . . . 0.0 111.135 -176.437 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -141.6 -74.47 0.31 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.646 -0.707 . . . . 0.0 109.286 175.847 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . -176.63 157.05 22.13 Favored Glycine 0 N--CA 1.446 -0.689 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 177.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.501 ' HB3' HD12 ' A' ' 731' ' ' ILE . 0.2 OUTLIER -103.71 6.52 36.96 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 121.184 0.516 . . . . 0.0 110.471 179.994 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 705' ' ' SER . . . . . 0.405 ' HA ' ' O ' ' A' ' 730' ' ' GLY . 0.0 OUTLIER -74.95 72.4 2.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.854 178.06 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 706' ' ' GLY . . . . . 0.499 ' HA2' ' HD3' ' A' ' 808' ' ' PRO . . . -157.31 -0.66 0.1 OUTLIER Glycine 0 N--CA 1.445 -0.702 0 C-N-CA 120.295 -0.955 . . . . 0.0 113.428 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 707' ' ' LYS . . . . . 0.487 ' HG2' ' N ' ' A' ' 708' ' ' ARG . 0.0 OUTLIER -131.88 154.75 48.89 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 117.487 0.644 . . . . 0.0 110.039 179.699 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 708' ' ' ARG . . . . . 0.487 ' N ' ' HG2' ' A' ' 707' ' ' LYS . 0.0 OUTLIER -108.92 154.87 21.54 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.687 -175.18 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 709' ' ' CYS . . . . . 0.429 ' O ' ' HA ' ' A' ' 733' ' ' VAL . 74.6 m -142.73 143.93 32.45 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.773 175.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 710' ' ' TRP . . . . . 0.538 ' CZ3' ' HG3' ' A' ' 739' ' ' GLN . 86.0 m95 -111.36 143.79 41.6 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 120.939 0.4 . . . . 0.0 110.577 -179.868 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 711' ' ' LEU . . . . . 0.429 ' CD1' ' HB2' ' A' ' 719' ' ' CYS . 0.3 OUTLIER -133.51 132.86 41.47 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.46 0.648 . . . . 0.0 110.806 179.178 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -127.24 60.22 1.4 Allowed 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.326 176.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 713' ' ' VAL . . . . . 0.659 HG13 ' HB3' ' A' ' 750' ' ' ASP . 28.8 t -108.47 120.8 60.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.745 179.588 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 4.0 mtm180 -79.7 -27.47 40.72 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.06 -177.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -72.43 111.8 7.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.907 175.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 716' ' ' ALA . . . . . 0.527 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -66.42 -35.37 80.13 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.55 -174.197 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.78 -45.1 87.74 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.063 0.459 . . . . 0.0 110.631 178.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.03 -45.1 64.51 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.868 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 719' ' ' CYS . . . . . 0.527 ' SG ' ' HA ' ' A' ' 716' ' ' ALA . 2.4 p -65.5 -43.61 89.6 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.821 -177.011 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 720' ' ' GLN . . . . . 0.608 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 19.0 tp60 -63.3 -39.74 95.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.942 -179.589 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -55.91 -54.85 39.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.895 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 6.7 mt -68.17 -48.35 65.53 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.19 -178.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 723' ' ' GLU . . . . . 0.608 ' HG2' ' HA ' ' A' ' 720' ' ' GLN . 0.2 OUTLIER -64.07 -38.13 89.96 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.675 -173.439 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 724' ' ' THR . . . . . 0.546 ' N ' ' HG3' ' A' ' 723' ' ' GLU . 4.1 m -71.77 -40.27 69.38 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 120.601 0.239 . . . . 0.0 110.728 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 20.1 m -62.06 -38.57 89.27 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.465 178.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 726' ' ' LEU . . . . . 0.412 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 49.5 mt -67.55 -48.95 65.47 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.454 177.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 727' ' ' GLN . . . . . 0.574 HE21 HG12 ' A' ' 733' ' ' VAL . 24.0 mt-30 -59.65 -27.28 66.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.233 -179.298 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.42 -24.57 67.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.542 -179.321 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 72.1 m -103.19 7.09 38.63 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.946 0.403 . . . . 0.0 111.23 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 730' ' ' GLY . . . . . 0.405 ' O ' ' HA ' ' A' ' 705' ' ' SER . . . 92.26 1.46 69.37 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.774 177.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 731' ' ' ILE . . . . . 0.501 HD12 ' HB3' ' A' ' 704' ' ' LEU . 11.9 mm -66.91 127.21 28.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 120.647 0.261 . . . . 0.0 110.33 177.856 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 732' ' ' VAL . . . . . 0.466 ' O ' ' HG2' ' A' ' 708' ' ' ARG . 0.7 OUTLIER -88.73 104.59 14.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.461 0.648 . . . . 0.0 109.856 179.888 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 733' ' ' VAL . . . . . 0.574 HG12 HE21 ' A' ' 727' ' ' GLN . 1.6 p -99.53 141.7 16.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.385 -179.714 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 734' ' ' THR . . . . . 0.439 ' HB ' ' CZ3' ' A' ' 710' ' ' TRP . 0.2 OUTLIER -136.93 138.49 40.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.493 178.974 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.6 136.18 52.63 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.418 176.137 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -78.49 79.98 4.9 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.224 -176.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -70.18 -79.36 0.06 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.768 177.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -151.77 61.0 0.4 Allowed Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 121.149 -0.548 . . . . 0.0 111.828 179.216 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 739' ' ' GLN . . . . . 0.538 ' HG3' ' CZ3' ' A' ' 710' ' ' TRP . 1.1 mm-40 -114.45 176.24 5.13 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.824 0.345 . . . . 0.0 110.557 -177.413 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 740' ' ' GLU . . . . . 0.461 ' HG3' ' HD2' ' A' ' 741' ' ' PRO . 0.8 OUTLIER -93.42 141.13 23.52 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.866 -179.683 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 741' ' ' PRO . . . . . 0.605 ' HA ' ' CZ3' ' A' ' 757' ' ' TRP . 15.7 Cg_endo -58.45 132.38 48.2 Favored 'Trans proline' 0 C--O 1.234 0.291 0 C-N-CA 123.014 2.476 . . . . 0.0 112.219 176.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 742' ' ' THR . . . . . 0.556 ' HB ' ' HB2' ' A' ' 745' ' ' ASP . 0.2 OUTLIER -105.92 131.8 21.43 Favored Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.611 179.631 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 743' ' ' PRO . . . . . 0.424 ' HD2' HG22 ' A' ' 742' ' ' THR . 36.6 Cg_endo -66.12 -17.99 55.72 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 123.363 2.709 . . . . 0.0 113.391 -175.782 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -105.41 4.15 30.42 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.691 0.281 . . . . 0.0 110.531 178.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 745' ' ' ASP . . . . . 0.556 ' HB2' ' HB ' ' A' ' 742' ' ' THR . 14.0 m-20 -115.37 156.86 24.77 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.158 -174.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 746' ' ' VAL . . . . . 0.425 HG11 ' HB1' ' A' ' 761' ' ' ALA . 29.4 m -119.97 148.11 23.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.922 -177.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 747' ' ' LEU . . . . . 0.548 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 0.0 OUTLIER -112.76 118.48 35.09 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.627 -0.261 . . . . 0.0 110.367 178.062 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 4.3 mt -104.47 107.24 21.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 173.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 749' ' ' THR . . . . . 0.408 ' OG1' HG22 ' A' ' 753' ' ' VAL . 1.5 t -117.42 163.8 15.83 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.59 0.233 . . . . 0.0 110.851 -175.858 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 750' ' ' ASP . . . . . 0.659 ' HB3' HG13 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -121.02 130.21 53.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.172 0.51 . . . . 0.0 110.902 -179.797 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 67.06 177.93 0.23 Allowed 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 114.656 -1.156 . . . . 0.0 111.297 -175.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 752' ' ' VAL . . . . . . . . . . . . . 69.9 t -80.68 91.82 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.411 0.624 . . . . 0.0 110.939 -176.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 753' ' ' VAL . . . . . 0.408 HG22 ' OG1' ' A' ' 749' ' ' THR . 2.0 t -86.9 -6.62 10.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.421 176.081 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 3.6 m 59.26 39.81 22.15 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.635 179.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.83 133.91 44.6 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.257 -0.428 . . . . 0.0 109.988 176.782 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 756' ' ' LYS . . . . . 0.501 ' HA ' ' HD2' ' A' ' 756' ' ' LYS . 4.9 mmmt -100.8 81.4 2.28 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.138 0.494 . . . . 0.0 110.326 -179.682 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 757' ' ' TRP . . . . . 0.605 ' CZ3' ' HA ' ' A' ' 741' ' ' PRO . 65.7 t-105 -75.96 95.5 3.58 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.378 178.628 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -94.6 59.83 2.51 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.336 0.588 . . . . 0.0 110.025 175.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 759' ' ' GLY . . . . . . . . . . . . . . . -108.07 -127.01 5.55 Favored Glycine 0 N--CA 1.446 -0.647 0 N-CA-C 111.187 -0.765 . . . . 0.0 111.187 176.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 32.0 ttt85 -77.47 -58.83 3.06 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.15 0.5 . . . . 0.0 109.83 175.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 761' ' ' ALA . . . . . 0.425 ' HB1' HG11 ' A' ' 746' ' ' VAL . . . -156.64 152.95 27.78 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.525 -0.762 . . . . 0.0 109.749 179.141 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 762' ' ' VAL . . . . . 0.472 ' HB ' ' HB3' ' A' ' 757' ' ' TRP . 2.1 p -131.82 123.41 51.6 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-O 121.171 0.51 . . . . 0.0 110.421 178.359 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 763' ' ' VAL . . . . . 0.452 HG21 HD23 ' A' ' 795' ' ' LEU . 84.3 t -105.92 115.15 47.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.091 178.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 764' ' ' THR . . . . . 0.476 ' O ' ' HA ' ' A' ' 782' ' ' VAL . 9.2 m -106.99 110.87 23.12 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.175 -178.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 765' ' ' PHE . . . . . 0.447 ' HB2' ' HA ' ' A' ' 750' ' ' ASP . 40.5 m-85 -70.73 152.72 43.51 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 171.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 766' ' ' CYS . . . . . 0.46 ' SG ' ' HB ' ' A' ' 782' ' ' VAL . 0.0 OUTLIER -157.5 133.56 9.49 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 178.32 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 767' ' ' ARG . . . . . 0.408 ' HB2' ' HE ' ' A' ' 767' ' ' ARG . 0.0 OUTLIER -126.1 -8.97 6.51 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.775 177.105 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 768' ' ' ARG . . . . . 0.522 ' HA ' ' HD2' ' A' ' 768' ' ' ARG . 2.3 mmm-85 -122.45 -72.89 0.66 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.013 0.435 . . . . 0.0 110.983 179.441 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -103.29 129.94 50.42 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.222 -0.658 . . . . 0.0 109.222 -178.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -114.65 12.51 8.02 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 CA-C-O 121.645 0.736 . . . . 0.0 111.328 -173.241 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -76.15 41.83 1.58 Allowed Glycine 0 CA--C 1.521 0.411 0 CA-C-N 115.542 -0.753 . . . . 0.0 113.291 -177.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 772' ' ' ILE . . . . . 0.59 HD12 ' HD2' ' A' ' 773' ' ' PRO . 1.1 mm -105.84 145.01 30.04 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 174.514 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 773' ' ' PRO . . . . . 0.59 ' HD2' HD12 ' A' ' 772' ' ' ILE . 54.3 Cg_exo -51.11 107.77 0.19 Allowed 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.165 1.91 . . . . 0.0 111.817 173.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . 0.791 ' HB3' HG12 ' A' ' 782' ' ' VAL . 0.5 OUTLIER -101.99 -155.37 0.52 Allowed 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.255 179.618 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 775' ' ' GLU . . . . . 0.425 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 1.8 mp0 -66.35 10.0 0.14 Allowed 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -179.085 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . 0.59 ' HG2' ' HG ' ' A' ' 774' ' ' LEU . 8.9 ptpt -71.03 -18.32 62.58 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 166.272 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -121.06 136.23 25.49 Favored Pre-proline 0 N--CA 1.451 -0.421 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.325 174.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -65.28 111.82 1.91 Allowed 'Trans proline' 0 CA--C 1.529 0.24 0 C-N-CA 122.587 2.191 . . . . 0.0 112.59 -177.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 110.14 -8.66 31.21 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.907 -0.663 . . . . 0.0 112.024 179.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 780' ' ' GLU . . . . . 0.485 ' HG2' ' HB2' ' A' ' 773' ' ' PRO . 0.1 OUTLIER -107.59 134.76 50.12 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 179.954 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 30.4 m95 -135.79 148.73 48.87 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.245 -0.28 . . . . 0.0 110.245 -178.086 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . 0.791 HG12 ' HB3' ' A' ' 774' ' ' LEU . 19.3 m -132.1 165.23 32.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 168.215 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 783' ' ' HIS . . . . . 0.403 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.2 OUTLIER -171.29 134.16 0.88 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.973 0.416 . . . . 0.0 111.502 177.038 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 784' ' ' SER . . . . . 0.445 ' O ' HG13 ' A' ' 785' ' ' VAL . 0.0 OUTLIER -98.81 99.25 10.31 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.515 178.208 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 785' ' ' VAL . . . . . 0.445 HG13 ' O ' ' A' ' 784' ' ' SER . 0.0 OUTLIER -171.39 -179.3 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 C-N-CA 122.796 0.438 . . . . 0.0 110.17 178.816 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -107.95 22.24 16.23 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.696 -0.683 . . . . 0.0 109.92 171.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 787' ' ' ALA . . . . . 0.415 ' HB2' ' HZ ' ' A' ' 765' ' ' PHE . . . 58.98 63.11 3.9 Favored Pre-proline 0 N--CA 1.468 0.43 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.973 -178.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 788' ' ' PRO . . . . . 0.439 ' HD2' ' OE1' ' A' ' 790' ' ' GLU . 24.3 Cg_exo -63.71 -53.46 1.32 Allowed 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.569 2.179 . . . . 0.0 112.844 -178.151 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 8.2 p-80 -172.13 25.71 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 790' ' ' GLU . . . . . 0.439 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -121.9 -46.81 2.2 Favored 'General case' 0 C--N 1.323 -0.578 0 O-C-N 122.034 -0.416 . . . . 0.0 111.091 -179.963 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 791' ' ' LEU . . . . . 0.513 ' HA ' HD22 ' A' ' 791' ' ' LEU . 0.5 OUTLIER -57.85 -54.61 53.59 Favored Pre-proline 0 CA--C 1.537 0.48 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -178.826 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 792' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -60.59 -26.74 83.51 Favored 'Trans proline' 0 C--N 1.355 0.915 0 C-N-CA 121.432 1.421 . . . . 0.0 112.019 178.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -70.43 -43.54 69.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.955 0.407 . . . . 0.0 110.264 177.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 794' ' ' LEU . . . . . 0.525 ' O ' ' HB ' ' A' ' 798' ' ' ILE . 0.1 OUTLIER -61.91 -37.82 86.08 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.332 177.537 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 795' ' ' LEU . . . . . 0.452 HD23 HG21 ' A' ' 763' ' ' VAL . 1.3 mm? -63.04 -49.9 72.78 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.156 0.503 . . . . 0.0 110.816 179.477 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -59.99 -48.33 82.16 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.185 -179.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 797' ' ' ARG . . . . . 0.424 ' HG2' ' HA ' ' A' ' 794' ' ' LEU . 0.3 OUTLIER -71.99 -20.83 61.66 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.667 -178.288 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 798' ' ' ILE . . . . . 0.525 ' HB ' ' O ' ' A' ' 794' ' ' LEU . 0.1 OUTLIER -72.01 -31.19 39.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.959 0.409 . . . . 0.0 110.247 178.442 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -85.37 -56.22 3.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.216 175.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 800' ' ' LEU . . . . . 0.429 HD21 ' HA ' ' A' ' 800' ' ' LEU . 4.8 mt 47.26 60.53 3.39 Favored 'General case' 0 N--CA 1.467 0.391 0 O-C-N 123.934 0.771 . . . . 0.0 112.562 178.078 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 801' ' ' ILE . . . . . . . . . . . . . 17.7 mt -105.15 -53.42 6.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 176.494 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 64.96 -2.3 0.73 Allowed 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 114.979 -1.009 . . . . 0.0 113.088 171.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 803' ' ' MET . . . . . . . . . . . . . 12.2 ptm -160.4 99.66 1.31 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.398 0.618 . . . . 0.0 110.457 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 804' ' ' GLU . . . . . 0.411 ' HB2' ' HA3' ' A' ' 706' ' ' GLY . 0.2 OUTLIER -132.33 -72.4 0.53 Allowed 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.573 179.157 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 7.8 m 56.77 46.18 20.42 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 112.902 0.704 . . . . 0.0 112.902 172.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -87.36 -28.93 21.9 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 171.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 807' ' ' ASP . . . . . 0.452 ' N ' ' HD3' ' A' ' 808' ' ' PRO . 27.8 t70 64.47 66.14 1.01 Allowed Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 114.602 -1.181 . . . . 0.0 111.621 -176.167 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 808' ' ' PRO . . . . . 0.499 ' HD3' ' HA2' ' A' ' 706' ' ' GLY . 35.9 Cg_endo -95.26 51.25 0.2 Allowed 'Trans proline' 0 N--CA 1.449 -1.127 0 C-N-CA 123.495 2.796 . . . . 0.0 110.547 172.892 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -90.87 31.14 1.1 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.29 -174.145 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -98.32 127.23 44.16 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 174.405 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -166.9 98.04 0.54 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.172 -178.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 1.4 pp -73.23 134.0 80.65 Favored Pre-proline 0 C--N 1.325 -0.459 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -71.86 88.31 0.8 Allowed 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.91 2.407 . . . . 0.0 111.915 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.56 96.35 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.259 175.387 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.8 102.84 15.44 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.547 -173.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -81.64 168.3 18.29 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.673 175.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.12 136.17 33.02 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 179.2 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -54.24 -49.14 70.17 Favored 'General case' 0 C--O 1.232 0.18 0 O-C-N 123.59 0.556 . . . . 0.0 110.384 179.156 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 72.1 t -90.5 136.5 23.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 173.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 4.5 m -67.25 84.15 0.14 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.298 0.57 . . . . 0.0 110.788 179.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -139.35 144.46 38.24 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.67 -178.729 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -147.41 12.81 1.06 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.931 0.396 . . . . 0.0 110.746 -178.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -132.11 134.39 45.41 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.653 0.739 . . . . 0.0 111.784 -174.583 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 824' ' ' ASP . . . . . 0.41 ' HB3' ' HE1' ' A' ' 849' ' ' TYR . 25.1 t70 -153.91 -69.87 0.14 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.925 -1.034 . . . . 0.0 108.667 175.636 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -106.78 124.57 49.8 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.457 173.092 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 826' ' ' MET . . . . . . . . . . . . . 2.9 ttt -96.64 113.26 24.81 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.456 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 827' ' ' ILE . . . . . 0.488 HG13 HD11 ' A' ' 936' ' ' LEU . 9.4 mm -113.13 134.46 55.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.281 -179.548 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 828' ' ' LEU . . . . . 0.776 HD21 HG12 ' A' ' 869' ' ' ILE . 0.3 OUTLIER -101.06 120.42 40.18 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.897 178.215 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 829' ' ' VAL . . . . . 0.457 HG22 ' O ' ' A' ' 852' ' ' LYS . 0.0 OUTLIER -102.85 95.78 4.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.209 0.528 . . . . 0.0 110.088 178.828 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 830' ' ' VAL . . . . . 0.578 HG12 ' HB2' ' A' ' 854' ' ' ALA . 1.7 t -113.16 109.13 27.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.346 -177.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 831' ' ' ASP . . . . . 0.715 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 18.8 t70 -124.88 159.46 31.07 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 110.22 -0.289 . . . . 0.0 110.22 179.073 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 832' ' ' ASP . . . . . 0.682 ' HB3' ' HB3' ' A' ' 877' ' ' ASN . 35.0 t70 -75.0 -27.55 60.19 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.954 -176.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 6.6 m170 -120.47 111.32 34.96 Favored Pre-proline 0 C--N 1.326 -0.421 0 O-C-N 122.322 -0.236 . . . . 0.0 111.053 -174.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 834' ' ' PRO . . . . . 0.444 ' HA ' ' HD2' ' A' ' 837' ' ' ARG . 87.6 Cg_exo -43.59 -36.89 7.59 Favored 'Trans proline' 0 CA--C 1.532 0.407 0 C-N-CA 123.643 2.895 . . . . 0.0 114.369 -176.052 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 835' ' ' ILE . . . . . 0.502 ' O ' ' HG3' ' A' ' 838' ' ' ARG . 1.1 pp -66.13 -44.46 91.72 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 CA-C-O 120.888 0.375 . . . . 0.0 111.214 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 836' ' ' ASN . . . . . 0.471 HD21 ' CG ' ' A' ' 831' ' ' ASP . 42.5 t30 -72.14 -41.87 66.65 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 177.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 837' ' ' ARG . . . . . 0.715 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 0.1 OUTLIER -53.8 -46.07 70.97 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.733 -1.121 . . . . 0.0 111.437 179.044 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 838' ' ' ARG . . . . . 0.502 ' HG3' ' O ' ' A' ' 835' ' ' ILE . 0.0 OUTLIER -72.76 -29.05 63.0 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 121.0 -0.28 . . . . 0.0 110.88 179.265 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.34 -47.11 83.53 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.645 -0.252 . . . . 0.0 111.371 -178.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 840' ' ' LEU . . . . . 0.474 ' H ' ' HG ' ' A' ' 840' ' ' LEU . 0.0 OUTLIER -71.35 -32.72 68.86 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.952 0.406 . . . . 0.0 110.254 178.188 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -63.64 -33.98 76.83 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.327 0.584 . . . . 0.0 110.39 177.047 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -65.53 -44.63 86.33 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.396 177.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 843' ' ' GLN . . . . . 0.47 ' HG3' HD22 ' A' ' 929' ' ' LEU . 1.2 mp0 -64.75 -41.69 95.73 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.542 179.012 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 844' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.66 -31.82 72.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.419 175.587 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -61.8 -43.12 99.65 Favored Glycine 0 N--CA 1.451 -0.329 0 CA-C-N 115.771 -0.649 . . . . 0.0 112.301 176.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -31.48 72.7 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.849 0.356 . . . . 0.0 110.626 176.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 14.8 mt -66.77 -32.65 74.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.63 177.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 87.65 27.55 26.67 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.639 177.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 849' ' ' TYR . . . . . 0.462 ' HD1' ' HA ' ' A' ' 849' ' ' TYR . 0.1 OUTLIER -114.45 167.11 11.0 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 122.804 -0.233 . . . . 0.0 110.674 -179.261 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -71.01 118.64 14.05 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.481 -175.852 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -123.54 107.82 11.96 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.456 179.287 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 852' ' ' LYS . . . . . 0.457 ' O ' HG22 ' A' ' 829' ' ' VAL . 0.0 OUTLIER -96.58 119.4 35.0 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 177.048 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.13 110.19 21.22 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.074 0.464 . . . . 0.0 111.709 -171.201 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 854' ' ' ALA . . . . . 0.578 ' HB2' HG12 ' A' ' 830' ' ' VAL . . . -121.78 155.93 34.26 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.897 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -137.23 79.07 1.73 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.341 -177.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 856' ' ' ASP . . . . . 0.483 ' CG ' ' H ' ' A' ' 857' ' ' GLY . 7.5 t70 -175.61 -166.92 0.22 Allowed 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.1 177.074 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 857' ' ' GLY . . . . . 0.483 ' H ' ' CG ' ' A' ' 856' ' ' ASP . . . -124.14 -53.61 0.19 Allowed Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 121.226 -0.511 . . . . 0.0 111.907 178.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -71.7 -31.02 40.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.899 0.381 . . . . 0.0 110.757 -177.346 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.76 -19.91 65.16 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.973 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 860' ' ' ALA . . . . . 0.461 ' O ' ' HG ' ' A' ' 864' ' ' LEU . . . -64.73 -51.06 64.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.753 0.311 . . . . 0.0 110.203 176.077 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 861' ' ' LEU . . . . . 0.916 HD23 HG13 ' A' ' 890' ' ' ILE . 1.4 tm? -58.87 -39.78 82.4 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.375 0.607 . . . . 0.0 109.636 175.275 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 28.7 t30 -55.02 -42.31 72.45 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.027 177.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 863' ' ' VAL . . . . . 0.478 HG13 ' HG ' ' A' ' 828' ' ' LEU . 0.4 OUTLIER -71.16 -32.34 47.36 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.71 -177.497 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 864' ' ' LEU . . . . . 0.796 HD13 HD21 ' A' ' 897' ' ' LEU . 4.4 mt -68.02 -37.59 81.57 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.409 0.623 . . . . 0.0 110.5 178.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 1.4 m -78.92 -16.14 57.39 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.317 179.254 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 1.4 mtmm -81.53 -57.49 3.44 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.514 177.169 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -139.53 151.32 46.03 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.448 -178.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 80.3 t60 -78.24 105.52 9.53 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.286 0.565 . . . . 0.0 111.156 -177.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 869' ' ' ILE . . . . . 0.776 HG12 HD21 ' A' ' 828' ' ' LEU . 1.5 mp -93.86 146.24 6.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 171.846 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -84.06 -52.34 6.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.817 0.341 . . . . 0.0 110.884 -175.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 871' ' ' ILE . . . . . 0.474 ' HA ' HD13 ' A' ' 871' ' ' ILE . 12.9 mm -124.59 122.46 63.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.14 -179.237 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 872' ' ' VAL . . . . . 0.629 ' HB ' HG13 ' A' ' 899' ' ' VAL . 2.5 t -103.54 124.94 58.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.863 178.147 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 873' ' ' LEU . . . . . . . . . . . . . 67.7 mt -107.25 110.29 22.29 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 176.186 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -113.62 99.7 7.93 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.679 -179.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 875' ' ' ASP . . . . . 0.46 ' CG ' ' HZ2' ' A' ' 925' ' ' LYS . 47.2 t0 -97.48 113.26 24.91 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.219 -178.736 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -103.86 103.53 15.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.868 -178.004 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 877' ' ' ASN . . . . . 0.682 ' HB3' ' HB3' ' A' ' 832' ' ' ASP . 0.4 OUTLIER -65.45 -42.6 92.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.623 178.129 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 878' ' ' MET . . . . . 0.482 ' HG2' ' HB2' ' A' ' 880' ' ' ASN . 10.1 ttp -140.28 102.61 6.71 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.942 -177.561 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 879' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_exo -74.27 -60.74 0.04 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 122.557 2.171 . . . . 0.0 110.379 170.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 880' ' ' ASN . . . . . 0.482 ' HB2' ' HG2' ' A' ' 878' ' ' MET . 0.8 OUTLIER 46.03 64.31 1.52 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.464 -0.789 . . . . 0.0 112.31 175.438 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 5.1 tpt 78.42 -20.6 0.38 Allowed 'General case' 0 N--CA 1.471 0.605 0 O-C-N 123.923 0.764 . . . . 0.0 112.038 175.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 29.4 t0 -95.58 171.47 8.66 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 177.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . 103.43 -17.92 49.52 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.916 -0.659 . . . . 0.0 111.504 -176.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.63 -33.21 75.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.208 0.527 . . . . 0.0 109.754 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 885' ' ' ARG . . . . . 0.448 ' H ' ' HG3' ' A' ' 885' ' ' ARG . 0.6 OUTLIER -72.56 -31.33 65.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.528 176.919 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.59 -51.05 62.67 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.808 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 887' ' ' THR . . . . . 0.561 ' O ' HG22 ' A' ' 890' ' ' ILE . 44.4 m -63.52 -41.48 98.48 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.037 0.446 . . . . 0.0 111.007 178.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 888' ' ' GLN . . . . . 0.457 ' O ' ' HB2' ' A' ' 892' ' ' GLN . 1.5 tp60 -63.2 -41.7 99.2 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.765 178.757 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.09 -43.39 87.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.264 -178.227 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 890' ' ' ILE . . . . . 0.916 HG13 HD23 ' A' ' 861' ' ' LEU . 13.0 tt -66.37 -41.1 88.28 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.502 -176.753 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 891' ' ' ARG . . . . . 0.431 ' HG3' ' N ' ' A' ' 892' ' ' GLN . 0.2 OUTLIER -75.4 -29.09 59.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.541 0.21 . . . . 0.0 111.153 179.413 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 892' ' ' GLN . . . . . 0.457 ' HB2' ' O ' ' A' ' 888' ' ' GLN . 1.2 tp60 -73.31 -50.36 22.53 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 120.83 0.348 . . . . 0.0 111.389 -177.545 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.12 -38.16 78.73 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.725 -177.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 121.95 82.39 0.64 Allowed Glycine 0 N--CA 1.445 -0.752 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.656 177.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 895' ' ' LEU . . . . . 0.556 ' HG ' ' O ' ' A' ' 895' ' ' LEU . 0.1 OUTLIER -59.73 130.85 48.84 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 175.793 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -117.96 13.27 13.94 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.57 0.582 . . . . 0.0 112.57 -171.547 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 897' ' ' LEU . . . . . 0.796 HD21 HD13 ' A' ' 864' ' ' LEU . 0.0 OUTLIER -157.31 166.52 16.44 Favored Pre-proline 0 C--N 1.321 -0.645 0 CA-C-N 116.616 -0.266 . . . . 0.0 111.331 -174.38 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_exo -71.06 108.55 2.35 Favored 'Trans proline' 0 C--O 1.239 0.545 0 C-N-CA 122.492 2.128 . . . . 0.0 111.622 173.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 899' ' ' VAL . . . . . 0.629 HG13 ' HB ' ' A' ' 872' ' ' VAL . 2.4 t -97.54 121.32 47.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.868 176.539 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 900' ' ' ILE . . . . . . . . . . . . . 2.7 mp -103.48 106.27 19.87 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-O 121.242 0.544 . . . . 0.0 109.987 178.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -94.61 97.73 2.2 Favored Glycine 0 N--CA 1.443 -0.897 0 CA-C-N 115.458 -0.792 . . . . 0.0 112.203 -178.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 902' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -79.86 123.77 37.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 175.098 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -118.68 143.73 46.66 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.015 0.436 . . . . 0.0 111.094 -174.111 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 904' ' ' ALA . . . . . 0.546 ' HA ' ' HB2' ' A' ' 925' ' ' LYS . . . -82.22 119.23 23.82 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.198 178.7 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 62.8 56.68 1.87 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.985 174.412 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 906' ' ' ALA . . . . . 0.445 ' HB1' ' HG3' ' A' ' 909' ' ' GLU . . . -107.46 -39.08 5.75 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.232 174.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 72.48 -65.68 0.34 Allowed 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.797 177.673 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -82.86 53.93 2.56 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.077 0.465 . . . . 0.0 109.791 176.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 909' ' ' GLU . . . . . 0.529 ' O ' ' HB2' ' A' ' 922' ' ' CYS . 3.4 mp0 -62.63 -35.24 78.95 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.928 -177.667 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 910' ' ' GLU . . . . . 0.51 ' H ' ' HG3' ' A' ' 910' ' ' GLU . 0.0 OUTLIER -62.62 -45.29 93.53 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.421 0.629 . . . . 0.0 110.194 176.289 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 911' ' ' LYS . . . . . 0.511 ' HE2' HD13 ' A' ' 915' ' ' LEU . 1.1 tttt -63.69 -37.21 86.49 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.489 177.326 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 18.6 tt0 -60.57 -42.58 96.95 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.471 177.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.88 -40.34 76.03 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.563 178.542 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 3.9 m -75.58 -31.16 59.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.037 179.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 915' ' ' LEU . . . . . 0.511 HD13 ' HE2' ' A' ' 911' ' ' LYS . 0.2 OUTLIER -70.73 -52.73 18.98 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.664 -175.767 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 916' ' ' GLU . . . . . 0.476 ' HB2' HG22 ' A' ' 887' ' ' THR . 0.2 OUTLIER -79.23 -44.68 21.33 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.457 -177.341 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 67.4 m 50.72 45.4 27.12 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 123.257 0.348 . . . . 0.0 111.852 -176.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -122.23 -33.56 0.89 Allowed Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.561 -0.828 . . . . 0.0 112.133 -179.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 919' ' ' MET . . . . . 0.739 ' HE1' HG21 ' A' ' 890' ' ' ILE . 5.4 mmt -90.9 -71.82 0.61 Allowed 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 176.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 920' ' ' ASP . . . . . 0.433 ' HB2' ' O ' ' A' ' 919' ' ' MET . 13.6 t70 158.59 -67.34 0.0 OUTLIER 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 114.399 -1.273 . . . . 0.0 108.959 175.135 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -118.9 167.71 11.46 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.26 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 922' ' ' CYS . . . . . 0.529 ' HB2' ' O ' ' A' ' 909' ' ' GLU . 85.0 m -143.47 133.71 24.51 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.225 -0.443 . . . . 0.0 109.985 177.221 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 923' ' ' LEU . . . . . 0.441 HD11 HG21 ' A' ' 935' ' ' THR . 56.0 mt -120.93 169.4 10.5 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.9 -178.788 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 924' ' ' SER . . . . . 0.415 ' O ' HG21 ' A' ' 927' ' ' VAL . 0.7 OUTLIER -84.66 150.4 25.17 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.4 177.066 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 925' ' ' LYS . . . . . 0.546 ' HB2' ' HA ' ' A' ' 904' ' ' ALA . 0.0 OUTLIER -58.38 -40.82 85.69 Favored Pre-proline 0 CA--C 1.541 0.621 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -179.432 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -64.8 73.83 0.22 Allowed 'Trans proline' 0 C--N 1.357 0.999 0 C-N-CA 122.102 1.868 . . . . 0.0 112.757 173.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 927' ' ' VAL . . . . . 0.415 HG21 ' O ' ' A' ' 924' ' ' SER . 8.9 t -100.94 114.54 40.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 121.12 0.486 . . . . 0.0 109.828 174.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.53 177.46 7.74 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.251 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 929' ' ' LEU . . . . . 0.509 HD21 ' HA ' ' A' ' 929' ' ' LEU . 1.6 tm? -57.82 -45.45 86.15 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.804 0.335 . . . . 0.0 110.401 177.723 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 930' ' ' ASP . . . . . 0.44 ' O ' ' HG2' ' A' ' 934' ' ' GLN . 3.4 t0 -66.5 -40.65 89.37 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.665 -178.452 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 50.8 t -64.7 -47.9 86.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.868 -179.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 932' ' ' ILE . . . . . 0.503 HG22 ' N ' ' A' ' 933' ' ' LYS . 0.0 OUTLIER -64.95 -31.97 56.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.936 0.398 . . . . 0.0 110.09 178.673 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 933' ' ' LYS . . . . . 0.503 ' N ' HG22 ' A' ' 932' ' ' ILE . 4.8 ttmt -65.74 -48.31 72.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.242 177.36 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 934' ' ' GLN . . . . . 0.453 ' O ' ' HB3' ' A' ' 938' ' ' LEU . 56.5 mm-40 -60.54 -48.77 80.29 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.447 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 935' ' ' THR . . . . . 0.441 HG21 HD11 ' A' ' 923' ' ' LEU . 13.4 m -59.62 -51.85 68.06 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.371 -178.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 936' ' ' LEU . . . . . 0.488 HD11 HG13 ' A' ' 827' ' ' ILE . 0.3 OUTLIER -63.65 -47.19 82.28 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.208 -177.76 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 32.3 m -63.53 -50.29 70.15 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -178.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 938' ' ' LEU . . . . . 0.453 ' HB3' ' O ' ' A' ' 934' ' ' GLN . 0.0 OUTLIER -66.32 -36.33 82.66 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.466 -0.333 . . . . 0.0 111.232 -175.832 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -76.03 -37.66 58.11 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.843 -0.343 . . . . 0.0 111.03 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -65.07 -37.77 88.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.947 0.403 . . . . 0.0 110.713 178.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 941' ' ' GLU . . . . . 0.623 ' O ' ' HG2' ' A' ' 945' ' ' LYS . 2.2 pt-20 -75.76 -29.01 58.69 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.678 -0.409 . . . . 0.0 110.52 177.385 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 942' ' ' ARG . . . . . . . . . . . . . 1.4 tpt85 -66.59 -47.49 72.56 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.567 179.09 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 27.9 m -67.24 -29.16 44.96 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 121.283 0.563 . . . . 0.0 109.861 176.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.91 -24.93 66.15 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.804 175.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 945' ' ' LYS . . . . . 0.623 ' HG2' ' O ' ' A' ' 941' ' ' GLU . 9.6 mmtt -73.87 -43.63 58.0 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 120.855 0.36 . . . . 0.0 110.183 176.821 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.32 -30.89 71.92 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.743 177.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.39 -19.31 46.6 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.248 174.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 29.6 t70 73.18 -95.24 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.957 -1.02 . . . . 0.0 111.538 177.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.252 1.225 0 CA-C-O 117.935 -1.031 . . . . 0.0 109.817 -178.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 2.7 ptt? . . . . . 0 N--CA 1.477 0.891 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 73.49 61.94 3.22 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.876 -0.678 . . . . 0.0 111.814 -176.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . -109.56 120.6 5.81 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 120.862 -0.685 . . . . 0.0 111.809 -179.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.08 -57.6 10.97 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.694 0.283 . . . . 0.0 111.029 -179.51 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . 72.59 -143.26 33.66 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.685 -0.769 . . . . 0.0 111.915 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . 0.419 ' H ' HG22 ' A' ' 701' ' ' VAL . 9.9 m -94.99 141.21 15.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.011 0.434 . . . . 0.0 111.072 -179.27 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -128.6 -132.27 0.22 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.118 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . 91.29 -65.62 2.49 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 121.013 -0.613 . . . . 0.0 113.343 175.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 8.8 mt -80.55 -56.78 3.93 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.925 0.393 . . . . 0.0 111.416 -175.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 3.3 m -66.1 131.21 45.66 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.368 -176.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 106.75 -12.71 42.18 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.76 175.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -75.48 132.0 40.49 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 174.618 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 708' ' ' ARG . . . . . 0.715 ' HG3' ' HB ' ' A' ' 732' ' ' VAL . 2.8 ttt180 -97.3 152.78 18.55 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.19 0.519 . . . . 0.0 111.445 -171.586 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 709' ' ' CYS . . . . . 0.483 ' SG ' HD13 ' A' ' 726' ' ' LEU . 0.0 OUTLIER -130.18 117.84 20.51 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.947 176.502 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 710' ' ' TRP . . . . . . . . . . . . . 47.2 m95 -94.82 120.19 34.65 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.56 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 711' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -122.36 132.38 54.35 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.393 0.616 . . . . 0.0 111.199 -177.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -125.76 70.4 1.2 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.422 176.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 60.8 t -128.15 120.58 53.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.114 -0.948 . . . . 0.0 109.952 -176.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 714' ' ' ARG . . . . . 0.568 ' HD2' ' OD2' ' A' ' 750' ' ' ASP . 0.3 OUTLIER -91.94 -8.99 44.71 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.385 -175.734 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -83.23 113.65 20.82 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 176.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -58.0 -43.95 86.93 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.49 -173.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.34 -45.66 86.89 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.009 0.433 . . . . 0.0 110.331 -179.171 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 718' ' ' LEU . . . . . 0.71 ' HG ' ' HB2' ' A' ' 787' ' ' ALA . 0.3 OUTLIER -67.15 -50.55 60.8 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.235 -179.396 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 719' ' ' CYS . . . . . . . . . . . . . 13.9 p -67.13 -44.9 78.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.221 -174.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 720' ' ' GLN . . . . . 0.631 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 0.3 OUTLIER -65.51 -37.87 88.04 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 121.002 -0.279 . . . . 0.0 111.173 -177.016 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 39.2 t80 -60.59 -48.16 83.02 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 121.013 -0.275 . . . . 0.0 110.692 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 722' ' ' LEU . . . . . 0.455 HD12 HD23 ' A' ' 718' ' ' LEU . 15.9 mt -66.16 -48.78 69.62 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.628 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 723' ' ' GLU . . . . . 0.729 ' HB2' HG12 ' A' ' 733' ' ' VAL . 8.7 pt-20 -61.88 -37.49 84.75 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.721 -175.181 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 724' ' ' THR . . . . . 0.515 ' HA ' ' HG2' ' A' ' 727' ' ' GLN . 26.2 m -68.96 -38.23 79.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.92 0.391 . . . . 0.0 110.797 179.226 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 24.3 m -70.71 -28.41 64.71 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.11 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 726' ' ' LEU . . . . . 0.483 HD13 ' SG ' ' A' ' 709' ' ' CYS . 18.3 mt -80.14 -44.21 20.3 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.98 0.419 . . . . 0.0 110.747 179.142 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 727' ' ' GLN . . . . . 0.515 ' HG2' ' HA ' ' A' ' 724' ' ' THR . 12.2 pt20 -72.03 -7.89 51.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.957 0.408 . . . . 0.0 110.705 178.183 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.74 -29.06 70.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.922 178.104 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 2.1 p -104.66 -88.55 0.43 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.065 0.459 . . . . 0.0 110.553 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 730' ' ' GLY . . . . . . . . . . . . . . . -158.05 19.68 0.35 Allowed Glycine 0 N--CA 1.445 -0.751 0 N-CA-C 111.343 -0.703 . . . . 0.0 111.343 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 731' ' ' ILE . . . . . . . . . . . . . 35.0 mm -79.35 128.09 38.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 120.886 0.374 . . . . 0.0 110.601 -179.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 732' ' ' VAL . . . . . 0.715 ' HB ' ' HG3' ' A' ' 708' ' ' ARG . 0.1 OUTLIER -79.15 89.26 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.554 -179.525 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 733' ' ' VAL . . . . . 0.729 HG12 ' HB2' ' A' ' 723' ' ' GLU . 94.7 t -66.09 114.43 3.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.015 176.416 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 734' ' ' THR . . . . . 0.549 HG22 HH21 ' A' ' 708' ' ' ARG . 0.7 OUTLIER -130.13 133.41 46.62 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.15 0.5 . . . . 0.0 110.862 -178.703 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.8 124.15 20.74 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.926 178.532 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -85.09 96.29 9.39 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.296 0.57 . . . . 0.0 110.556 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -107.95 -10.81 15.45 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.299 178.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 148.27 57.1 0.01 OUTLIER Glycine 0 CA--C 1.51 -0.25 0 N-CA-C 111.199 -0.76 . . . . 0.0 111.199 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 17.2 mp0 -106.81 173.99 6.08 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.953 0.406 . . . . 0.0 111.59 -173.069 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 740' ' ' GLU . . . . . 0.417 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 6.2 mm-40 -75.38 141.52 73.6 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.557 -177.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 741' ' ' PRO . . . . . 0.631 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 1.9 Cg_endo -84.72 123.52 2.88 Favored 'Trans proline' 0 N--CA 1.455 -0.744 0 C-N-CA 123.108 2.539 . . . . 0.0 112.415 176.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 742' ' ' THR . . . . . 0.464 HG23 ' HD2' ' A' ' 743' ' ' PRO . 0.0 OUTLIER -111.95 138.26 21.62 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.468 177.564 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 743' ' ' PRO . . . . . 0.464 ' HD2' HG23 ' A' ' 742' ' ' THR . 40.5 Cg_endo -67.12 -6.65 16.63 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 123.166 2.578 . . . . 0.0 113.916 -175.236 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -109.13 1.12 20.16 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.8 0.333 . . . . 0.0 110.895 178.044 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 82.7 m-20 -117.01 157.51 25.69 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-N 116.279 -0.419 . . . . 0.0 109.979 -175.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 746' ' ' VAL . . . . . 0.436 HG21 HD11 ' A' ' 795' ' ' LEU . 0.8 OUTLIER -123.6 149.08 27.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 120.915 0.388 . . . . 0.0 111.156 -177.809 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 747' ' ' LEU . . . . . 0.413 ' HB2' ' CE2' ' A' ' 757' ' ' TRP . 0.0 OUTLIER -105.82 112.56 25.68 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.877 176.191 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 17.9 mt -98.88 114.19 35.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 176.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 34.8 p -115.01 148.99 38.14 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.685 0.279 . . . . 0.0 111.253 -174.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 750' ' ' ASP . . . . . 0.568 ' OD2' ' HD2' ' A' ' 714' ' ' ARG . 0.0 OUTLIER -98.82 123.28 42.97 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 171.303 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 751' ' ' GLU . . . . . 0.455 ' HB3' ' H ' ' A' ' 752' ' ' VAL . 10.2 mm-40 57.89 -156.48 0.32 Allowed 'General case' 0 C--O 1.236 0.361 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.356 -175.419 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 752' ' ' VAL . . . . . 0.945 HG11 ' HA3' ' A' ' 771' ' ' GLY . 4.9 t -87.55 141.06 14.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 121.103 0.478 . . . . 0.0 111.422 -174.251 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 15.6 m -125.29 160.54 30.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.908 177.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -84.66 56.56 3.92 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.948 0.404 . . . . 0.0 110.9 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.72 176.3 12.14 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.415 179.304 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.53 -39.24 2.03 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.411 -179.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 757' ' ' TRP . . . . . 0.631 ' CH2' ' HA ' ' A' ' 741' ' ' PRO . 76.0 t-105 70.46 158.88 0.19 Allowed 'General case' 0 CA--C 1.537 0.462 0 O-C-N 123.702 0.626 . . . . 0.0 111.576 177.701 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -134.15 -85.45 0.42 Allowed 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 172.175 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 759' ' ' GLY . . . . . . . . . . . . . . . 50.25 -136.44 26.03 Favored Glycine 0 C--N 1.334 0.452 0 CA-C-N 116.394 -0.366 . . . . 0.0 112.946 176.289 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 30.7 ttm-85 -85.29 -50.58 7.23 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.241 0.543 . . . . 0.0 109.587 172.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -166.54 158.85 13.8 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.028 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 762' ' ' VAL . . . . . 0.484 ' HB ' ' CD1' ' A' ' 757' ' ' TRP . 2.4 p -120.41 128.09 75.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 174.334 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 763' ' ' VAL . . . . . 0.648 HG11 HD21 ' A' ' 791' ' ' LEU . 11.9 t -112.06 104.71 17.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 121.085 0.469 . . . . 0.0 110.273 -178.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 764' ' ' THR . . . . . . . . . . . . . 36.7 m -98.38 125.25 43.45 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.043 -179.088 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 765' ' ' PHE . . . . . 0.418 ' CE2' HG21 ' A' ' 785' ' ' VAL . 14.8 m-85 -83.12 112.99 20.32 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.661 175.275 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -95.1 133.03 39.36 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.161 -178.172 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 767' ' ' ARG . . . . . 0.469 ' HA ' ' HD2' ' A' ' 767' ' ' ARG . 13.6 mmm-85 -118.55 -48.37 2.5 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.731 0.301 . . . . 0.0 110.233 178.153 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.41 -19.13 1.25 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.941 -178.04 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -138.09 144.3 40.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.921 0.391 . . . . 0.0 111.013 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 16.2 mt -124.25 87.59 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.573 -178.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 771' ' ' GLY . . . . . 0.945 ' HA3' HG11 ' A' ' 752' ' ' VAL . . . -85.7 -33.88 14.93 Favored Glycine 0 N--CA 1.45 -0.378 0 N-CA-C 111.207 -0.757 . . . . 0.0 111.207 175.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 772' ' ' ILE . . . . . 0.45 ' HA ' ' HD3' ' A' ' 773' ' ' PRO . 0.9 OUTLIER -98.5 116.17 65.54 Favored Pre-proline 0 C--N 1.322 -0.596 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 173.118 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 773' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 772' ' ' ILE . 6.0 Cg_exo -77.51 -177.98 4.25 Favored 'Trans proline' 0 N--CA 1.461 -0.439 0 C-N-CA 123.101 2.534 . . . . 0.0 113.41 -174.432 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . 0.448 ' O ' ' HB3' ' A' ' 780' ' ' GLU . 1.7 pt? -88.06 -161.2 0.7 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.464 179.374 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 775' ' ' GLU . . . . . 0.5 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 9.8 mp0 -65.37 62.95 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 113.632 0.975 . . . . 0.0 113.632 -176.897 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . 0.421 ' HD3' ' CB ' ' A' ' 773' ' ' PRO . 0.1 OUTLIER -108.42 0.85 21.3 Favored 'General case' 0 C--N 1.309 -1.171 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 168.963 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -132.17 164.55 42.41 Favored Pre-proline 0 N--CA 1.447 -0.601 0 CA-C-N 113.833 -1.53 . . . . 0.0 108.435 177.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_endo -55.91 -17.96 20.59 Favored 'Trans proline' 0 CA--C 1.534 0.476 0 C-N-CA 123.087 2.525 . . . . 0.0 114.577 -173.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . -158.54 34.57 0.5 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 119.71 -1.234 . . . . 0.0 113.397 -177.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 780' ' ' GLU . . . . . 0.5 ' O ' ' HG3' ' A' ' 775' ' ' GLU . 0.1 OUTLIER -97.99 122.66 41.38 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.95 0.375 . . . . 0.0 110.043 178.622 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 16.4 m95 -131.46 146.71 52.37 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.521 -178.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 4.8 m -139.18 153.89 24.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.553 176.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 783' ' ' HIS . . . . . 0.4 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.9 OUTLIER -155.66 127.5 7.46 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.979 0.419 . . . . 0.0 110.688 173.056 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -95.0 99.93 11.86 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.633 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 785' ' ' VAL . . . . . 0.435 ' HB ' ' HD3' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -166.96 -173.57 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.931 179.629 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -124.39 48.19 1.98 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.904 0.383 . . . . 0.0 110.658 175.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 787' ' ' ALA . . . . . 0.71 ' HB2' ' HG ' ' A' ' 718' ' ' LEU . . . 54.05 66.17 4.63 Favored Pre-proline 0 N--CA 1.467 0.386 0 CA-C-N 115.248 -0.887 . . . . 0.0 112.547 178.547 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 788' ' ' PRO . . . . . 0.761 ' HD2' ' OE1' ' A' ' 790' ' ' GLU . 17.0 Cg_exo -68.75 -61.75 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.655 2.236 . . . . 0.0 111.673 175.653 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 789' ' ' HIS . . . . . 0.491 ' HB3' ' O ' ' A' ' 788' ' ' PRO . 0.1 OUTLIER 175.79 10.47 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 O-C-N 123.32 0.388 . . . . 0.0 111.881 178.235 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 790' ' ' GLU . . . . . 0.761 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -93.77 -41.95 9.4 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.812 0.339 . . . . 0.0 110.6 -175.724 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 791' ' ' LEU . . . . . 0.648 HD21 HG11 ' A' ' 763' ' ' VAL . 0.2 OUTLIER -62.86 -49.17 83.29 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.667 -179.976 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 792' ' ' PRO . . . . . 0.522 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 10.7 Cg_endo -56.12 -30.94 81.35 Favored 'Trans proline' 0 C--N 1.354 0.864 0 C-N-CA 121.8 1.667 . . . . 0.0 112.042 175.402 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -72.91 -44.72 60.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.772 178.097 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 794' ' ' LEU . . . . . 0.408 ' HA ' HD22 ' A' ' 794' ' ' LEU . 2.1 tm? -61.68 -38.18 86.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.181 177.05 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 795' ' ' LEU . . . . . 0.436 HD11 HG21 ' A' ' 746' ' ' VAL . 0.4 OUTLIER -66.68 -42.65 86.19 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.886 -179.774 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -63.85 -38.34 90.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.117 0.484 . . . . 0.0 110.481 176.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.17 -44.6 87.98 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.74 178.239 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -69.05 -22.15 25.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.525 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.741 -176.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -85.3 0.35 52.29 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.03 0.443 . . . . 0.0 110.126 176.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 6.6 mt 68.1 71.8 0.31 Allowed 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 114.847 -1.069 . . . . 0.0 112.521 171.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 801' ' ' ILE . . . . . . . . . . . . . 59.2 mt -97.52 -66.37 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 171.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 51.19 51.73 16.35 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.274 -0.875 . . . . 0.0 113.084 170.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 803' ' ' MET . . . . . . . . . . . . . 7.2 ptp -149.88 124.67 9.84 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.422 175.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 804' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -153.91 148.79 26.61 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.462 179.066 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.73 76.33 9.59 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.192 0.52 . . . . 0.0 110.557 177.635 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -114.18 108.33 16.81 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.672 -178.203 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 28.3 t0 -142.87 85.16 10.15 Favored Pre-proline 0 C--N 1.326 -0.427 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.619 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 808' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_exo -71.57 137.53 30.54 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 123.201 2.6 . . . . 0.0 112.321 -179.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -95.88 144.43 26.22 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.7 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -147.56 143.29 27.67 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.095 -179.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -132.32 102.25 5.68 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.721 0.296 . . . . 0.0 111.105 -179.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -128.63 86.07 58.62 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-O 120.894 0.378 . . . . 0.0 110.238 176.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -85.8 162.82 10.56 Favored 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 123.043 2.495 . . . . 0.0 113.283 -176.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -132.13 137.67 47.77 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.3 176.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.97 116.52 10.19 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.026 0.441 . . . . 0.0 111.825 -177.726 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -132.3 118.45 19.47 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.714 178.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 2.5 ttpm? -129.76 95.34 3.95 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.36 -178.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -125.19 103.92 8.23 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.058 179.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -138.76 141.9 35.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.111 178.635 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -138.88 116.83 11.62 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.927 0.394 . . . . 0.0 111.245 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -78.84 144.54 34.92 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 173.226 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -143.1 -64.89 0.39 Allowed 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 113.426 0.898 . . . . 0.0 113.426 -168.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -67.25 125.72 26.98 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -168.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -163.3 90.81 0.67 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.866 -1.061 . . . . 0.0 109.74 174.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -116.68 120.36 38.37 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.834 178.27 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 826' ' ' MET . . . . . 0.481 ' O ' HG23 ' A' ' 869' ' ' ILE . 18.9 ttm -95.13 118.58 32.17 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.349 0.595 . . . . 0.0 112.193 -172.163 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 827' ' ' ILE . . . . . 0.753 HD11 ' HB ' ' A' ' 871' ' ' ILE . 2.5 mm -115.9 135.82 54.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.779 177.404 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 828' ' ' LEU . . . . . 0.43 HD21 HG12 ' A' ' 872' ' ' VAL . 2.7 tp -117.28 128.99 55.61 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.111 0.481 . . . . 0.0 111.094 -177.698 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 829' ' ' VAL . . . . . 0.81 HG11 HD12 ' A' ' 873' ' ' LEU . 0.0 OUTLIER -110.1 110.38 31.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.269 179.511 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 830' ' ' VAL . . . . . 0.746 HG11 ' HB3' ' A' ' 854' ' ' ALA . 0.0 OUTLIER -113.07 101.63 12.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.594 -179.261 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 831' ' ' ASP . . . . . 0.684 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 5.7 t70 -104.76 157.18 17.38 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 110.089 -0.337 . . . . 0.0 110.089 178.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -90.06 -21.42 22.33 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.053 177.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 25.7 m170 -111.79 123.04 35.57 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.592 -178.42 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_exo -52.25 -44.72 44.3 Favored 'Trans proline' 0 C--O 1.237 0.446 0 C-N-CA 123.666 2.911 . . . . 0.0 114.191 -173.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -71.87 -40.14 68.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.637 0.256 . . . . 0.0 111.082 -176.119 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 836' ' ' ASN . . . . . 0.426 ' ND2' HD21 ' A' ' 840' ' ' LEU . 5.1 t30 -68.31 -37.04 80.21 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 178.134 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 837' ' ' ARG . . . . . 0.684 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 4.3 ttp85 -54.12 -44.09 71.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.736 176.2 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 838' ' ' ARG . . . . . 0.455 ' HD2' ' O ' ' A' ' 838' ' ' ARG . 0.0 OUTLIER -65.26 -37.66 87.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.217 178.676 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 839' ' ' LEU . . . . . 0.436 ' HG ' ' NE2' ' A' ' 843' ' ' GLN . 9.2 tp -61.1 -49.8 75.84 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.645 -176.588 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 840' ' ' LEU . . . . . 0.51 ' H ' ' HG ' ' A' ' 840' ' ' LEU . 0.0 OUTLIER -70.32 -35.57 73.73 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.778 179.564 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -62.79 -39.51 94.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.109 0.48 . . . . 0.0 110.772 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -70.23 -42.62 72.0 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.562 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 843' ' ' GLN . . . . . 0.473 ' HG2' ' CD1' ' A' ' 929' ' ' LEU . 20.8 mt-30 -55.98 -49.51 73.4 Favored 'General case' 0 C--O 1.23 0.078 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.363 176.321 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 844' ' ' LEU . . . . . 0.555 HD23 ' HB ' ' A' ' 827' ' ' ILE . 0.2 OUTLIER -59.65 -40.38 87.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.018 178.329 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -68.07 -24.05 74.56 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 121.069 -0.586 . . . . 0.0 112.502 179.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 5.4 m -86.31 -25.94 25.18 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.911 0.386 . . . . 0.0 110.591 178.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 847' ' ' LEU . . . . . 0.516 HD21 ' HA ' ' A' ' 933' ' ' LYS . 0.2 OUTLIER -67.54 -31.76 72.07 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.87 179.209 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 96.76 52.04 1.58 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.473 178.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 54.0 m-85 -133.65 174.56 10.31 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 178.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.4 107.89 13.57 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 175.477 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 851' ' ' CYS . . . . . 0.546 ' HB3' HD22 ' A' ' 844' ' ' LEU . 0.0 OUTLIER -97.57 129.85 44.67 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.618 -174.268 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 852' ' ' LYS . . . . . 0.45 ' HE2' ' SD ' ' A' ' 826' ' ' MET . 1.5 mptt -125.11 122.7 37.9 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 171.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 853' ' ' THR . . . . . 0.672 HG21 HG23 ' A' ' 829' ' ' VAL . 0.2 OUTLIER -110.6 144.28 39.72 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.911 0.386 . . . . 0.0 111.905 -175.083 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 854' ' ' ALA . . . . . 0.746 ' HB3' HG11 ' A' ' 830' ' ' VAL . . . -148.51 151.25 34.81 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.705 174.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 855' ' ' ASN . . . . . 0.474 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 1.1 t30 -130.69 74.56 1.6 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.318 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 856' ' ' ASP . . . . . 0.583 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 24.2 t0 171.26 146.65 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.34 0 O-C-N 123.595 0.559 . . . . 0.0 110.467 -178.554 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -75.3 -35.16 49.14 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.622 -0.799 . . . . 0.0 111.278 175.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 858' ' ' VAL . . . . . 0.403 ' H ' HG23 ' A' ' 858' ' ' VAL . 0.6 OUTLIER -68.65 -34.58 65.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 120.95 0.405 . . . . 0.0 110.415 178.077 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 859' ' ' ASP . . . . . 0.583 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 1.2 t70 -71.1 -30.11 66.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.455 179.36 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -64.5 -39.15 93.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.337 176.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 861' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.79 -40.23 83.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.181 175.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -59.53 -52.95 63.38 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.952 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 7.6 p -65.06 -31.36 53.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.04 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 864' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.48 -32.9 74.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.905 0.383 . . . . 0.0 111.319 179.167 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 865' ' ' SER . . . . . 0.421 ' HB3' HD12 ' A' ' 893' ' ' LEU . 0.1 OUTLIER -88.59 -16.83 31.49 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.924 0.392 . . . . 0.0 111.04 -178.198 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.03 -27.81 15.43 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.794 -177.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -146.02 158.2 43.87 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.691 0.281 . . . . 0.0 110.811 -175.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -90.31 -28.27 18.87 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 176.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 869' ' ' ILE . . . . . 0.481 HG23 ' O ' ' A' ' 826' ' ' MET . 2.3 mt 56.93 -136.52 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.528 0.135 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 -177.537 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 870' ' ' ASP . . . . . 0.453 ' H ' HG23 ' A' ' 869' ' ' ILE . 0.3 OUTLIER -157.95 -52.42 0.07 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.11 0.481 . . . . 0.0 109.824 169.309 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 871' ' ' ILE . . . . . 0.753 ' HB ' HD11 ' A' ' 827' ' ' ILE . 7.4 mm -122.4 124.0 69.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.726 179.418 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 872' ' ' VAL . . . . . 0.496 ' O ' ' HA ' ' A' ' 899' ' ' VAL . 38.4 t -118.27 129.28 74.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.316 178.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 873' ' ' LEU . . . . . 0.81 HD12 HG11 ' A' ' 829' ' ' VAL . 0.7 OUTLIER -131.76 135.23 46.64 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 177.152 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 874' ' ' SER . . . . . 0.487 ' HA ' ' O ' ' A' ' 830' ' ' VAL . 0.9 OUTLIER -123.69 126.63 46.89 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.686 -177.459 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 875' ' ' ASP . . . . . 0.505 ' CG ' ' HZ2' ' A' ' 925' ' ' LYS . 40.5 t0 -111.21 120.14 41.28 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.41 -178.291 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 4.1 t -121.39 131.93 71.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.031 -176.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 877' ' ' ASN . . . . . 0.438 ' HB2' ' HE2' ' A' ' 925' ' ' LYS . 1.8 t-20 -121.96 53.02 1.23 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.073 0.464 . . . . 0.0 110.863 179.049 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 878' ' ' MET . . . . . 0.57 ' HG2' ' HB3' ' A' ' 881' ' ' MET . 0.3 OUTLIER -139.15 110.72 7.77 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.13 179.232 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 879' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -65.03 -49.16 2.97 Favored 'Trans proline' 0 CA--C 1.529 0.261 0 C-N-CA 122.606 2.204 . . . . 0.0 112.005 179.365 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -108.26 109.21 20.51 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.525 177.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 881' ' ' MET . . . . . 0.57 ' HB3' ' HG2' ' A' ' 878' ' ' MET . 0.3 OUTLIER -157.55 -174.92 5.1 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.111 0.482 . . . . 0.0 110.978 -175.943 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -122.21 -159.74 0.84 Allowed 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 171.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . 109.54 9.01 25.92 Favored Glycine 0 N--CA 1.445 -0.723 0 N-CA-C 110.397 -1.081 . . . . 0.0 110.397 -172.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.2 -28.28 68.64 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 176.626 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 885' ' ' ARG . . . . . 0.474 ' O ' ' HB2' ' A' ' 889' ' ' ARG . 0.0 OUTLIER -63.82 -31.11 72.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.285 173.939 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 886' ' ' LEU . . . . . 0.436 ' O ' ' HB ' ' A' ' 890' ' ' ILE . 0.0 OUTLIER -68.32 -45.58 72.58 Favored 'General case' 0 C--O 1.226 -0.172 0 CA-C-N 116.662 -0.244 . . . . 0.0 110.523 -177.532 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.59 -43.82 92.61 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.114 0.483 . . . . 0.0 110.814 179.544 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 2.9 tm0? -63.96 -51.46 64.25 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.89 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 889' ' ' ARG . . . . . 0.474 ' HB2' ' O ' ' A' ' 885' ' ' ARG . 0.2 OUTLIER -72.51 -28.17 62.71 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.776 -0.647 . . . . 0.0 112.124 -174.611 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 890' ' ' ILE . . . . . 0.436 ' HB ' ' O ' ' A' ' 886' ' ' LEU . 0.8 OUTLIER -71.65 -38.59 67.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.707 179.273 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 891' ' ' ARG . . . . . 0.4 ' N ' HG22 ' A' ' 890' ' ' ILE . 0.1 OUTLIER -76.18 -24.88 54.76 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.121 0.486 . . . . 0.0 109.749 176.559 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -77.3 -31.89 55.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.459 179.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 893' ' ' LEU . . . . . 0.421 HD12 ' HB3' ' A' ' 865' ' ' SER . 1.6 tp -73.57 -49.36 26.73 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.345 -179.728 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 133.93 63.61 0.07 OUTLIER Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.297 -0.954 . . . . 0.0 112.161 -179.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 895' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.38 110.22 17.33 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.94 -0.392 . . . . 0.0 109.94 175.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -115.92 34.04 5.18 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.292 0.568 . . . . 0.0 110.996 -178.852 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 897' ' ' LEU . . . . . 0.408 ' CD1' HG22 ' A' ' 872' ' ' VAL . 0.2 OUTLIER -141.52 148.93 52.36 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.925 -178.283 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -69.66 130.12 18.9 Favored 'Trans proline' 0 C--O 1.24 0.599 0 C-N-CA 122.647 2.232 . . . . 0.0 113.03 -177.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 899' ' ' VAL . . . . . 0.673 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 8.0 t -112.05 129.45 67.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.586 176.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 900' ' ' ILE . . . . . 0.436 ' CG2' ' HG ' ' A' ' 923' ' ' LEU . 3.0 mp -99.2 111.93 30.07 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 175.805 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 901' ' ' GLY . . . . . 0.416 ' O ' ' HA ' ' A' ' 922' ' ' CYS . . . -95.07 101.13 2.67 Favored Glycine 0 N--CA 1.442 -0.938 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.035 -177.433 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 902' ' ' VAL . . . . . 1.004 ' HB ' ' HB2' ' A' ' 923' ' ' LEU . 0.1 OUTLIER -96.21 128.17 47.65 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 178.898 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 903' ' ' THR . . . . . 0.459 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.2 OUTLIER -135.51 169.12 18.0 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.321 -176.492 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 904' ' ' ALA . . . . . 0.413 ' HB2' ' HB2' ' A' ' 925' ' ' LYS . . . -142.81 104.73 4.38 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.678 0.275 . . . . 0.0 111.307 177.354 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 58.3 74.01 0.45 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.175 -0.921 . . . . 0.0 113.217 172.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 906' ' ' ALA . . . . . 0.535 ' HB2' ' CG ' ' A' ' 909' ' ' GLU . . . -117.76 -2.06 11.45 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 169.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 2.3 tp 71.76 -56.1 0.65 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 114.87 -1.059 . . . . 0.0 112.746 175.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 908' ' ' ALA . . . . . 0.588 ' O ' ' HB2' ' A' ' 912' ' ' GLN . . . -92.14 12.58 21.69 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -172.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 909' ' ' GLU . . . . . 0.535 ' CG ' ' HB2' ' A' ' 906' ' ' ALA . 0.5 OUTLIER -63.36 -36.19 82.89 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.583 0.23 . . . . 0.0 111.338 -175.192 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 910' ' ' GLU . . . . . 0.437 ' H ' ' HG3' ' A' ' 910' ' ' GLU . 0.0 OUTLIER -59.73 -61.89 2.28 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.209 -177.341 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.64 -29.31 66.75 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.088 -178.051 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 912' ' ' GLN . . . . . 0.588 ' HB2' ' O ' ' A' ' 908' ' ' ALA . 1.1 mt-30 -62.94 -45.04 94.33 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 177.55 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.61 -38.6 81.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.597 179.52 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 90.7 m -62.84 -35.25 79.31 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.956 176.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.47 -51.86 21.48 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.652 -179.051 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 916' ' ' GLU . . . . . 0.406 ' H ' ' HG3' ' A' ' 916' ' ' GLU . 0.0 OUTLIER -72.91 -50.31 24.45 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.672 -0.24 . . . . 0.0 111.292 -175.899 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 49.96 39.21 18.18 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.87 -174.512 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -99.11 -31.45 6.22 Favored Glycine 0 N--CA 1.445 -0.701 0 C-N-CA 120.845 -0.693 . . . . 0.0 111.975 -177.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 919' ' ' MET . . . . . 0.673 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 2.6 mtm -78.58 -94.0 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 110.533 -0.173 . . . . 0.0 110.533 179.325 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 920' ' ' ASP . . . . . 0.558 ' HB2' ' O ' ' A' ' 919' ' ' MET . 11.5 t70 157.47 -81.88 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.39 1.076 . . . . 0.0 108.871 179.479 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -97.48 173.04 7.37 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.752 -178.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 922' ' ' CYS . . . . . 0.416 ' HA ' ' O ' ' A' ' 901' ' ' GLY . 0.0 OUTLIER -144.18 136.76 26.86 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.943 0.401 . . . . 0.0 111.208 -178.248 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 923' ' ' LEU . . . . . 1.004 ' HB2' ' HB ' ' A' ' 902' ' ' VAL . 60.6 mt -127.25 -175.72 3.52 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.612 178.413 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 924' ' ' SER . . . . . 0.459 ' HA ' ' O ' ' A' ' 903' ' ' THR . 0.2 OUTLIER -126.31 144.17 50.9 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.362 178.3 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 925' ' ' LYS . . . . . 0.505 ' HZ2' ' CG ' ' A' ' 875' ' ' ASP . 2.3 tttp -53.82 -42.96 95.44 Favored Pre-proline 0 CA--C 1.54 0.564 0 O-C-N 123.538 0.524 . . . . 0.0 112.305 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -66.91 69.99 0.52 Allowed 'Trans proline' 0 C--N 1.36 1.168 0 C-N-CA 122.067 1.845 . . . . 0.0 111.807 171.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 3.0 p -115.48 158.1 15.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.72 -177.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -109.03 161.97 14.67 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.255 177.473 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 929' ' ' LEU . . . . . 0.508 ' HA ' HG22 ' A' ' 932' ' ' ILE . 1.2 tt -61.77 -29.52 70.19 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.925 0.393 . . . . 0.0 110.295 176.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 930' ' ' ASP . . . . . 0.551 ' O ' ' HG2' ' A' ' 934' ' ' GLN . 17.1 t0 -62.59 -46.24 89.22 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.246 179.375 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 55.2 t -71.73 -42.23 70.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.784 -176.285 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 932' ' ' ILE . . . . . 0.508 HG22 ' HA ' ' A' ' 929' ' ' LEU . 0.0 OUTLIER -64.95 -38.74 83.55 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.038 177.956 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 933' ' ' LYS . . . . . 0.516 ' HA ' HD21 ' A' ' 847' ' ' LEU . 2.0 tmmt? -62.7 -46.13 89.58 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.328 176.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 934' ' ' GLN . . . . . 0.551 ' HG2' ' O ' ' A' ' 930' ' ' ASP . 14.1 mm100 -57.05 -51.13 70.51 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.906 179.145 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 5.1 m -63.13 -42.45 99.5 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.464 -178.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 936' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.02 -35.85 82.07 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.712 178.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 90.2 m -68.32 -45.28 73.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.098 178.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 9.4 tp -61.83 -42.87 99.57 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.166 0.508 . . . . 0.0 110.506 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -72.67 -31.85 65.39 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.935 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -62.12 -41.15 97.95 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.807 178.037 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 941' ' ' GLU . . . . . 0.555 ' HG3' ' N ' ' A' ' 942' ' ' ARG . 0.0 OUTLIER -66.51 -35.43 80.23 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.342 178.139 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 942' ' ' ARG . . . . . 0.555 ' N ' ' HG3' ' A' ' 941' ' ' GLU . 5.0 mmt85 -66.1 -48.65 70.24 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.024 0.44 . . . . 0.0 110.89 178.37 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 943' ' ' VAL . . . . . 0.429 HG23 ' N ' ' A' ' 944' ' ' ARG . 25.4 m -74.17 -33.23 34.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.531 -174.263 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 944' ' ' ARG . . . . . 0.503 ' HG3' ' N ' ' A' ' 945' ' ' LYS . 0.0 OUTLIER -69.92 -34.59 73.69 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 121.187 -0.205 . . . . 0.0 110.696 -179.819 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 945' ' ' LYS . . . . . 0.503 ' N ' ' HG3' ' A' ' 944' ' ' ARG . 12.8 ptpt -79.16 -31.74 44.08 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 121.158 -0.217 . . . . 0.0 111.347 -178.332 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 7.7 m -74.42 -36.82 63.45 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.98 0.419 . . . . 0.0 110.508 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 1.7 ttm105 -78.51 -19.51 52.82 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.722 175.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 27.1 t70 67.84 79.44 0.22 Allowed 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.036 -0.984 . . . . 0.0 111.118 177.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 14.9 m . . . . . 0 C--N 1.32 -0.7 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.651 176.983 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.479 1.025 0 CA-C-O 120.777 0.322 . . . . 0.0 110.596 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . -91.02 -128.71 4.11 Favored Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.922 -0.656 . . . . 0.0 112.065 179.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . 60.02 -167.63 9.05 Favored Glycine 0 CA--C 1.52 0.362 0 C-N-CA 121.235 -0.507 . . . . 0.0 112.701 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.3 -40.47 16.53 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.743 0.306 . . . . 0.0 110.877 177.539 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . 88.38 122.25 1.87 Allowed Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.752 -0.737 . . . . 0.0 111.729 -176.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -120.19 67.35 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 120.921 0.391 . . . . 0.0 110.697 -178.03 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.93 129.97 35.09 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.863 176.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . -101.18 -154.3 26.52 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.839 -0.696 . . . . 0.0 113.006 -176.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -86.75 46.87 1.41 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.762 0.315 . . . . 0.0 111.303 -175.344 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 705' ' ' SER . . . . . 0.622 ' O ' ' HA ' ' A' ' 846' ' ' SER . 0.9 OUTLIER -70.54 62.56 0.25 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.439 177.394 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . -171.83 -28.45 0.02 OUTLIER Glycine 0 N--CA 1.446 -0.681 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.614 -178.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 707' ' ' LYS . . . . . 0.995 ' CE ' ' HH ' ' A' ' 799' ' ' TYR . 0.0 OUTLIER -63.41 148.99 46.99 Favored 'General case' 0 C--N 1.334 -0.095 0 N-CA-C 109.862 -0.421 . . . . 0.0 109.862 176.595 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 708' ' ' ARG . . . . . 0.428 ' H ' ' HE3' ' A' ' 707' ' ' LYS . 4.7 mtt180 -116.53 146.86 42.32 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.125 0.488 . . . . 0.0 111.322 -177.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 709' ' ' CYS . . . . . 0.415 ' HB2' HD22 ' A' ' 726' ' ' LEU . 42.9 t -126.89 138.0 53.24 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.138 174.163 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 710' ' ' TRP . . . . . 0.611 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 38.9 m95 -105.49 130.83 53.48 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 120.783 0.325 . . . . 0.0 110.336 -177.335 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 711' ' ' LEU . . . . . 0.612 HD23 HG23 ' A' ' 733' ' ' VAL . 0.6 OUTLIER -136.37 137.73 40.85 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.217 0.532 . . . . 0.0 111.429 -178.412 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -126.91 53.45 1.7 Allowed 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.322 176.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 713' ' ' VAL . . . . . 0.965 ' HA ' ' HB2' ' A' ' 750' ' ' ASP . 15.8 t -109.13 132.76 56.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.807 -175.837 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.57 -11.81 16.21 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.583 -177.466 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -74.22 112.9 10.83 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 170.357 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 716' ' ' ALA . . . . . 0.598 ' O ' ' HB2' ' A' ' 720' ' ' GLN . . . -63.05 -44.75 94.96 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 122.73 0.412 . . . . 0.0 111.542 -172.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.3 -39.04 89.08 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.002 0.43 . . . . 0.0 110.709 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 718' ' ' LEU . . . . . 0.521 ' O ' ' HG ' ' A' ' 722' ' ' LEU . 2.3 tt -69.0 -51.17 42.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.596 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 719' ' ' CYS . . . . . 0.81 ' HA ' HD13 ' A' ' 722' ' ' LEU . 15.0 p -65.12 -42.03 94.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.548 -176.624 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 720' ' ' GLN . . . . . 0.7 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -60.95 -39.38 89.3 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.288 179.483 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.12 -53.7 55.3 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.96 0.409 . . . . 0.0 110.836 -179.623 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 722' ' ' LEU . . . . . 0.81 HD13 ' HA ' ' A' ' 719' ' ' CYS . 0.0 OUTLIER -67.4 -48.25 67.9 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.304 -178.314 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 723' ' ' GLU . . . . . 0.7 ' HG2' ' HA ' ' A' ' 720' ' ' GLN . 3.1 pt-20 -59.51 -41.13 89.2 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.669 -174.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 724' ' ' THR . . . . . 0.643 ' HA ' ' HG2' ' A' ' 727' ' ' GLN . 10.0 m -70.35 -36.6 74.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.688 0.28 . . . . 0.0 111.277 -179.1 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 25.1 m -66.92 -34.08 76.98 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.478 0.18 . . . . 0.0 111.336 -179.116 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 726' ' ' LEU . . . . . 0.699 HD23 HG22 ' A' ' 731' ' ' ILE . 1.1 mp -81.48 -41.67 21.4 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 121.17 -0.212 . . . . 0.0 111.301 178.161 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 727' ' ' GLN . . . . . 0.643 ' HG2' ' HA ' ' A' ' 724' ' ' THR . 0.0 OUTLIER -65.07 -21.76 66.86 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.219 0.533 . . . . 0.0 109.906 177.19 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 728' ' ' ARG . . . . . 0.453 ' HB2' ' O ' ' A' ' 724' ' ' THR . 20.2 ttp85 -60.48 -26.69 66.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.841 175.056 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -107.21 4.32 26.55 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.144 -179.588 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 730' ' ' GLY . . . . . 0.61 ' O ' ' HA ' ' A' ' 705' ' ' SER . . . 99.44 -5.82 58.97 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 121.122 -0.561 . . . . 0.0 112.436 177.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 731' ' ' ILE . . . . . 0.699 HG22 HD23 ' A' ' 726' ' ' LEU . 17.1 mt -75.6 113.75 14.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.116 0.484 . . . . 0.0 110.487 -177.053 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 732' ' ' VAL . . . . . . . . . . . . . 10.5 m -76.33 133.69 30.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.83 -177.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 733' ' ' VAL . . . . . 0.612 HG23 HD23 ' A' ' 711' ' ' LEU . 0.3 OUTLIER -97.6 138.86 21.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.351 179.42 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 4.7 m -133.98 135.31 43.38 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.254 179.082 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.33 118.82 9.22 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.425 177.016 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 736' ' ' TYR . . . . . 0.611 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 50.8 t80 -82.48 95.01 7.57 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.255 0.55 . . . . 0.0 110.556 -179.294 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.24 -70.82 0.78 Allowed 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.404 175.803 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -130.22 91.29 0.3 Allowed Glycine 0 N--CA 1.445 -0.75 0 N-CA-C 110.788 -0.925 . . . . 0.0 110.788 175.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.13 164.25 34.46 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.78 0.324 . . . . 0.0 111.002 -176.37 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 740' ' ' GLU . . . . . 0.429 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 1.9 mt-10 -79.28 138.49 55.92 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.771 -179.066 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 741' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 740' ' ' GLU . 5.0 Cg_endo -87.46 126.63 2.28 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 123.282 2.655 . . . . 0.0 112.246 177.013 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 742' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -104.65 134.62 19.57 Favored Pre-proline 0 C--N 1.323 -0.571 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.009 177.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 743' ' ' PRO . . . . . 1.006 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 18.7 Cg_endo -61.91 -16.88 52.4 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 123.084 2.523 . . . . 0.0 112.98 -179.564 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 56.8 mp0 -105.33 11.79 32.41 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.844 0.354 . . . . 0.0 110.839 178.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -111.53 159.86 17.72 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.465 -177.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 3.6 p -124.08 141.44 44.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.236 -174.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 747' ' ' LEU . . . . . 0.631 HD23 HG21 ' A' ' 749' ' ' THR . 0.5 OUTLIER -117.56 141.43 48.38 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.944 179.33 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 748' ' ' ILE . . . . . 0.626 ' N ' HD21 ' A' ' 747' ' ' LEU . 0.8 OUTLIER -121.75 120.92 63.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 N-CA-C 108.631 -0.878 . . . . 0.0 108.631 169.983 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 749' ' ' THR . . . . . 0.631 HG21 HD23 ' A' ' 747' ' ' LEU . 0.0 OUTLIER -119.27 150.42 40.13 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -169.575 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 750' ' ' ASP . . . . . 0.965 ' HB2' ' HA ' ' A' ' 713' ' ' VAL . 10.1 t0 -108.84 111.55 23.33 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.479 179.472 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 751' ' ' GLU . . . . . 0.938 ' HG2' HH21 ' A' ' 767' ' ' ARG . 17.1 mm-40 58.75 -151.9 0.41 Allowed 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 123.517 0.727 . . . . 0.0 111.248 -177.69 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 752' ' ' VAL . . . . . 0.417 ' H ' ' HB3' ' A' ' 751' ' ' GLU . 2.6 t -85.74 129.73 37.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 121.061 0.458 . . . . 0.0 111.741 -174.81 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 753' ' ' VAL . . . . . 0.453 HG21 HG22 ' A' ' 749' ' ' THR . 3.4 t -120.7 159.59 22.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.19 -0.671 . . . . 0.0 109.19 177.597 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 754' ' ' SER . . . . . 0.409 ' H ' HG12 ' A' ' 753' ' ' VAL . 1.4 m -79.78 37.93 0.37 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.974 0.416 . . . . 0.0 110.934 178.103 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 755' ' ' LYS . . . . . 0.418 ' H ' ' C ' ' A' ' 753' ' ' VAL . 3.8 mttt -159.31 -174.65 4.8 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 178.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 756' ' ' LYS . . . . . 0.622 ' O ' ' HB2' ' A' ' 757' ' ' TRP . 0.0 OUTLIER -140.03 -67.6 0.43 Allowed 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 172.627 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 757' ' ' TRP . . . . . 0.622 ' HB2' ' O ' ' A' ' 756' ' ' LYS . 0.7 OUTLIER 157.68 164.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 114.303 -1.317 . . . . 0.0 109.519 -175.265 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.69 49.97 1.14 Allowed 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 173.362 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 759' ' ' GLY . . . . . 1.006 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -150.14 -144.6 3.96 Favored Glycine 0 N--CA 1.442 -0.954 0 C-N-CA 120.403 -0.904 . . . . 0.0 113.654 -173.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 760' ' ' ARG . . . . . 0.732 HH21 ' HB3' ' A' ' 821' ' ' ASP . 4.9 ttt85 -63.42 -61.51 2.29 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.22 -0.49 . . . . 0.0 111.652 -173.483 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -162.4 146.35 11.86 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.859 0.362 . . . . 0.0 111.068 -178.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 762' ' ' VAL . . . . . 0.555 HG21 ' HB3' ' A' ' 747' ' ' LEU . 4.0 p -126.57 122.96 62.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.738 174.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 16.6 t -102.08 95.56 4.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.824 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 764' ' ' THR . . . . . 0.698 HG22 HG13 ' A' ' 772' ' ' ILE . 91.5 m -92.14 122.53 34.72 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.618 -179.38 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 765' ' ' PHE . . . . . 0.867 ' HZ ' ' HG ' ' A' ' 791' ' ' LEU . 3.9 m-30 -99.39 101.65 12.98 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.098 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 766' ' ' CYS . . . . . 0.532 ' SG ' HG21 ' A' ' 764' ' ' THR . 0.0 OUTLIER -123.5 133.53 54.0 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.21 -177.646 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 767' ' ' ARG . . . . . 0.938 HH21 ' HG2' ' A' ' 751' ' ' GLU . 0.0 OUTLIER -140.19 -35.08 0.52 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.944 -179.048 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -84.98 -52.53 5.92 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 178.195 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -125.15 124.91 42.81 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.57 172.643 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 2.1 mt -115.39 85.34 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.161 0.505 . . . . 0.0 110.538 -177.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 771' ' ' GLY . . . . . 0.415 ' HA3' HG13 ' A' ' 752' ' ' VAL . . . -92.35 -6.54 64.42 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.858 -0.686 . . . . 0.0 111.815 178.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 772' ' ' ILE . . . . . 0.698 HG13 HG22 ' A' ' 764' ' ' THR . 3.0 mm -103.52 131.3 22.19 Favored Pre-proline 0 C--N 1.323 -0.583 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.431 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 773' ' ' PRO . . . . . 0.558 ' O ' ' HB3' ' A' ' 774' ' ' LEU . 31.6 Cg_exo -60.57 -94.04 0.0 OUTLIER 'Trans proline' 0 CA--C 1.532 0.391 0 C-N-CA 123.188 2.592 . . . . 0.0 113.075 -176.725 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . 0.663 HD23 ' HE3' ' A' ' 776' ' ' LYS . 0.4 OUTLIER 167.4 -163.68 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.19 0.596 . . . . 0.0 109.913 -178.98 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 775' ' ' GLU . . . . . 0.601 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 1.4 mp0 -62.94 69.47 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.743 0.782 . . . . 0.0 112.423 175.084 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . 0.663 ' HE3' HD23 ' A' ' 774' ' ' LEU . 18.3 ptpt -132.61 -1.03 3.49 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 114.796 -1.093 . . . . 0.0 108.872 171.208 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -131.62 158.36 75.58 Favored Pre-proline 0 N--CA 1.449 -0.494 0 CA-C-N 114.94 -1.027 . . . . 0.0 109.25 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -61.64 99.93 0.18 Allowed 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.58 2.187 . . . . 0.0 112.714 -178.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 94.23 15.62 47.09 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.883 -0.675 . . . . 0.0 113.408 175.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 780' ' ' GLU . . . . . 0.601 ' O ' ' HG3' ' A' ' 775' ' ' GLU . 2.7 tt0 -100.07 121.78 41.92 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 117.541 0.67 . . . . 0.0 110.322 179.251 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 12.0 m95 -129.33 124.23 33.77 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 176.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . 0.644 ' HB ' ' HA ' ' A' ' 774' ' ' LEU . 1.8 t -141.13 136.34 33.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 C-N-CA 120.696 -0.402 . . . . 0.0 111.711 -176.131 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 783' ' ' HIS . . . . . 0.432 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 1.0 OUTLIER -176.17 174.81 1.98 Allowed 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.913 168.432 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 784' ' ' SER . . . . . 0.704 ' HB3' ' HB3' ' A' ' 767' ' ' ARG . 0.7 OUTLIER -98.42 100.47 11.74 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.968 177.1 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 785' ' ' VAL . . . . . 0.688 HG12 ' H ' ' A' ' 787' ' ' ALA . 39.8 t -138.47 140.38 39.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -178.703 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -90.23 12.57 17.66 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.76 0.314 . . . . 0.0 111.138 -179.016 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 787' ' ' ALA . . . . . 0.688 ' H ' HG12 ' A' ' 785' ' ' VAL . . . 53.82 57.64 13.18 Favored Pre-proline 0 N--CA 1.467 0.381 0 CA-C-N 115.481 -0.781 . . . . 0.0 112.279 -178.782 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 788' ' ' PRO . . . . . 0.516 ' HD3' ' N ' ' A' ' 787' ' ' ALA . 24.2 Cg_exo -65.23 -57.83 0.24 Allowed 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 122.509 2.139 . . . . 0.0 112.375 178.22 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -160.73 -22.49 0.06 Allowed 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 179.041 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 790' ' ' GLU . . . . . 0.433 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 2.7 pm0 -73.09 -33.53 65.66 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 111.684 0.253 . . . . 0.0 111.684 -175.152 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 791' ' ' LEU . . . . . 0.867 ' HG ' ' HZ ' ' A' ' 765' ' ' PHE . 0.4 OUTLIER -71.07 -52.53 9.32 Favored Pre-proline 0 C--N 1.327 -0.382 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.761 -178.673 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 792' ' ' PRO . . . . . 0.438 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 9.5 Cg_endo -56.68 -30.77 85.17 Favored 'Trans proline' 0 C--N 1.356 0.949 0 C-N-CA 121.521 1.481 . . . . 0.0 111.831 175.228 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -69.7 -42.24 74.32 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.657 175.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.44 -42.57 96.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.66 177.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 795' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.68 -35.36 80.77 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.988 0.423 . . . . 0.0 110.693 -179.338 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 796' ' ' ALA . . . . . 0.443 ' HA ' HD12 ' A' ' 801' ' ' ILE . . . -63.67 -38.43 91.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.626 177.116 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 797' ' ' ARG . . . . . 0.513 ' HG3' ' N ' ' A' ' 798' ' ' ILE . 0.0 OUTLIER -71.55 -33.06 68.8 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.106 176.593 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 798' ' ' ILE . . . . . 0.513 ' N ' ' HG3' ' A' ' 797' ' ' ARG . 0.9 OUTLIER -61.45 -35.53 67.24 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.445 -175.739 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 799' ' ' TYR . . . . . 0.995 ' HH ' ' CE ' ' A' ' 707' ' ' LYS . 0.2 OUTLIER -104.62 28.04 7.39 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 119.829 -0.749 . . . . 0.0 112.076 176.114 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 800' ' ' LEU . . . . . 0.499 HD21 ' HB2' ' A' ' 821' ' ' ASP . 0.7 OUTLIER 46.09 50.74 11.52 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.291 -0.868 . . . . 0.0 112.993 170.419 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 801' ' ' ILE . . . . . 0.443 HD12 ' HA ' ' A' ' 796' ' ' ALA . 31.5 mt -77.21 79.72 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 121.817 0.817 . . . . 0.0 109.183 174.019 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -84.6 51.54 2.15 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.887 -1.051 . . . . 0.0 111.482 -173.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 803' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.35 -63.2 1.24 Allowed 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 107.937 -1.135 . . . . 0.0 107.937 170.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 804' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 56.02 61.02 2.93 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 114.809 -1.087 . . . . 0.0 112.619 167.319 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -83.42 37.65 0.58 Allowed 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.14 174.456 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 22.8 t70 53.43 58.03 5.6 Favored 'General case' 0 C--O 1.232 0.139 0 N-CA-C 107.953 -1.128 . . . . 0.0 107.953 -167.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 807' ' ' ASP . . . . . 0.427 ' HA ' ' HD3' ' A' ' 808' ' ' PRO . 1.7 t0 -66.64 118.61 56.02 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-N 114.304 -1.316 . . . . 0.0 111.101 -173.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 808' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 807' ' ' ASP . 13.5 Cg_exo -69.51 -166.57 0.18 Allowed 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 123.196 2.597 . . . . 0.0 112.062 179.126 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . 73.02 -41.06 0.49 Allowed 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.25 0.62 . . . . 0.0 111.427 -179.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -79.44 81.77 5.66 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.239 0.542 . . . . 0.0 110.09 175.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -101.33 28.71 5.23 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.161 177.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -130.47 75.49 78.96 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.982 177.466 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -74.21 14.5 0.72 Allowed 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.859 2.373 . . . . 0.0 112.641 -177.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.65 5.19 19.01 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.778 179.139 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.73 53.8 1.99 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.755 178.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -84.73 129.65 34.8 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.65 -176.825 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.03 162.13 41.15 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.106 -179.387 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -82.58 117.45 22.57 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.88 0.371 . . . . 0.0 110.509 179.128 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 45.1 t -83.76 84.12 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 121.302 0.572 . . . . 0.0 110.973 -178.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -104.22 19.35 20.33 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.814 174.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 821' ' ' ASP . . . . . 0.732 ' HB3' HH21 ' A' ' 760' ' ' ARG . 18.8 m-20 -76.73 94.18 3.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.386 -179.693 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -89.91 73.96 7.39 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.58 -176.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -106.41 54.86 0.68 Allowed 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 173.6 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -94.82 59.44 2.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.99 -1.004 . . . . 0.0 111.249 -172.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 3.0 tpt -112.99 92.7 4.1 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.142 0.496 . . . . 0.0 110.252 176.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 826' ' ' MET . . . . . . . . . . . . . 8.7 ptp -114.27 129.89 56.64 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.938 -179.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 827' ' ' ILE . . . . . 0.487 ' O ' ' HA ' ' A' ' 851' ' ' CYS . 1.0 OUTLIER -126.39 137.76 56.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.998 -178.584 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 828' ' ' LEU . . . . . 0.546 HD21 ' HB ' ' A' ' 869' ' ' ILE . 0.2 OUTLIER -107.68 143.61 35.93 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.782 0.325 . . . . 0.0 110.632 -178.504 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 829' ' ' VAL . . . . . 0.566 HG21 HD13 ' A' ' 840' ' ' LEU . 0.1 OUTLIER -128.04 119.67 51.72 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 121.315 0.579 . . . . 0.0 110.231 -179.345 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 830' ' ' VAL . . . . . . . . . . . . . 69.0 t -122.6 107.89 20.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 115.285 -0.871 . . . . 0.0 109.333 176.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 831' ' ' ASP . . . . . 0.547 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -118.22 153.26 34.19 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.155 0.502 . . . . 0.0 111.177 -177.611 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 832' ' ' ASP . . . . . 0.427 ' HB2' ' HA ' ' A' ' 876' ' ' VAL . 6.8 t70 -68.94 -42.4 76.78 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.778 -1.101 . . . . 0.0 112.293 -177.289 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -126.41 105.06 24.52 Favored Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 110.299 -0.259 . . . . 0.0 110.299 -173.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -40.75 -25.12 0.18 Allowed 'Trans proline' 0 C--N 1.353 0.803 1 C-N-CA 125.892 4.395 . . . . 0.0 116.553 -164.38 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 835' ' ' ILE . . . . . 0.461 HG21 HD13 ' A' ' 835' ' ' ILE . 0.0 OUTLIER -61.01 -39.95 83.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 117.985 0.357 . . . . 0.0 111.173 -179.206 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 836' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -74.5 -41.6 60.41 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 837' ' ' ARG . . . . . 0.547 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 12.9 ttp180 -52.83 -49.93 64.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.25 177.682 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 838' ' ' ARG . . . . . 0.434 ' HG3' ' O ' ' A' ' 835' ' ' ILE . 0.0 OUTLIER -68.56 -34.61 76.13 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.94 -178.139 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 839' ' ' LEU . . . . . 0.482 ' HA ' HD23 ' A' ' 839' ' ' LEU . 0.6 OUTLIER -69.91 -49.15 54.88 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.077 -176.104 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 840' ' ' LEU . . . . . 0.566 HD13 HG21 ' A' ' 829' ' ' VAL . 2.6 pp -74.26 -31.44 62.55 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.405 -178.199 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 841' ' ' ALA . . . . . 0.518 ' HB1' ' O ' ' A' ' 837' ' ' ARG . . . -68.93 -35.21 76.53 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.941 0.401 . . . . 0.0 110.398 177.11 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 842' ' ' ASP . . . . . 0.4 ' HB2' ' O ' ' A' ' 838' ' ' ARG . 0.3 OUTLIER -63.5 -36.66 84.49 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.885 176.064 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 843' ' ' GLN . . . . . 0.709 ' HG3' HD22 ' A' ' 929' ' ' LEU . 2.5 mm-40 -68.44 -39.79 81.36 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.494 -0.775 . . . . 0.0 109.991 176.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 844' ' ' LEU . . . . . 0.444 ' HA ' HD12 ' A' ' 847' ' ' LEU . 0.3 OUTLIER -59.15 -43.46 92.06 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.273 176.579 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -61.92 -35.13 90.92 Favored Glycine 0 N--CA 1.451 -0.316 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.003 176.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 846' ' ' SER . . . . . 0.622 ' HA ' ' O ' ' A' ' 705' ' ' SER . 29.3 m -71.47 -17.26 62.37 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.792 0.33 . . . . 0.0 111.167 178.401 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 847' ' ' LEU . . . . . 0.444 HD12 ' HA ' ' A' ' 844' ' ' LEU . 44.3 mt -83.22 -18.39 39.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.374 175.312 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 88.97 30.02 15.99 Favored Glycine 0 C--N 1.33 0.213 0 C-N-CA 121.042 -0.599 . . . . 0.0 112.924 177.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -119.31 160.19 22.71 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 179.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.82 109.51 19.33 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.196 0.522 . . . . 0.0 111.085 -177.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 851' ' ' CYS . . . . . 0.487 ' HA ' ' O ' ' A' ' 827' ' ' ILE . 0.0 OUTLIER -93.39 151.79 19.53 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.996 179.97 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.92 109.94 13.63 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.517 173.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 853' ' ' THR . . . . . 0.449 HG23 ' CG ' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -94.43 124.07 38.23 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -171.189 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 854' ' ' ALA . . . . . . . . . . . . . . . -137.65 155.58 48.99 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.479 175.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -134.39 75.35 1.58 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 856' ' ' ASP . . . . . 0.611 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 26.8 t70 170.6 143.84 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.681 179.627 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -70.63 -37.42 67.82 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 121.038 -0.601 . . . . 0.0 113.148 -177.114 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -73.71 -31.54 32.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.846 0.355 . . . . 0.0 110.217 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 859' ' ' ASP . . . . . 0.611 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 1.0 OUTLIER -58.99 -29.21 67.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.764 177.275 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -63.76 -42.47 97.82 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.961 0.41 . . . . 0.0 110.495 177.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 861' ' ' LEU . . . . . 0.532 HD23 HD22 ' A' ' 893' ' ' LEU . 0.2 OUTLIER -71.14 -33.52 70.16 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.999 178.17 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -63.98 -52.23 60.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.602 179.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 9.4 p -69.14 -32.69 55.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.023 -177.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 864' ' ' LEU . . . . . 0.467 ' HA ' HD23 ' A' ' 864' ' ' LEU . 0.2 OUTLIER -61.3 -39.02 88.92 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.051 0.453 . . . . 0.0 110.571 177.984 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 11.0 m -82.14 -20.89 37.04 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.986 -178.49 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.8 -46.34 17.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.451 -179.607 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -150.5 138.92 20.46 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 177.729 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 18.3 m80 -86.7 88.66 7.72 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.301 0.572 . . . . 0.0 111.773 -172.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 869' ' ' ILE . . . . . 0.546 ' HB ' HD21 ' A' ' 828' ' ' LEU . 0.8 OUTLIER -69.48 154.74 8.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.301 173.22 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.03 -34.37 15.15 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -169.692 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 871' ' ' ILE . . . . . 0.462 HG23 ' N ' ' A' ' 872' ' ' VAL . 2.2 mt -130.37 136.01 59.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 O-C-N 122.208 -0.308 . . . . 0.0 110.721 -179.165 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 872' ' ' VAL . . . . . 0.828 ' HB ' ' HB ' ' A' ' 899' ' ' VAL . 2.2 t -103.38 126.2 57.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.425 -178.092 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 873' ' ' LEU . . . . . 0.54 ' HB2' ' HA ' ' A' ' 829' ' ' VAL . 13.0 mt -104.03 99.82 9.57 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 170.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -106.05 96.95 6.84 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.581 0.229 . . . . 0.0 110.645 -178.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 875' ' ' ASP . . . . . 0.506 ' HA ' ' HB ' ' A' ' 902' ' ' VAL . 10.2 t0 -109.26 110.69 21.94 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.395 -177.245 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 876' ' ' VAL . . . . . 0.427 ' HA ' ' HB2' ' A' ' 832' ' ' ASP . 0.2 OUTLIER -108.01 155.19 8.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.22 0.533 . . . . 0.0 111.538 -175.884 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -115.63 -65.75 1.16 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.476 176.031 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 878' ' ' MET . . . . . 0.44 ' CB ' ' HD3' ' A' ' 879' ' ' PRO . 2.5 ttm -178.0 -70.32 0.0 OUTLIER Pre-proline 0 CA--C 1.538 0.491 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 177.062 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 879' ' ' PRO . . . . . 0.44 ' HD3' ' CB ' ' A' ' 878' ' ' MET . 79.5 Cg_endo -88.5 51.52 1.77 Allowed 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 122.302 2.001 . . . . 0.0 114.235 -164.138 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -125.63 -23.64 4.01 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.813 175.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 4.1 ptt? -173.78 179.58 1.98 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.426 -177.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -74.8 131.77 41.05 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 171.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -75.28 41.54 1.35 Allowed Glycine 0 CA--C 1.519 0.332 0 C-N-CA 121.49 -0.386 . . . . 0.0 114.005 -172.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -168.06 -8.58 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.842 0.353 . . . . 0.0 110.6 178.512 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -63.51 -44.15 95.13 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.311 -176.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 886' ' ' LEU . . . . . 0.59 HD12 ' H ' ' A' ' 887' ' ' THR . 0.0 OUTLIER -68.72 -29.25 67.64 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.149 -177.796 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 887' ' ' THR . . . . . 0.59 ' H ' HD12 ' A' ' 886' ' ' LEU . 0.2 OUTLIER -72.33 -43.58 63.91 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 120.942 0.401 . . . . 0.0 110.409 176.863 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 33.1 mm-40 -59.53 -40.78 88.27 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.343 177.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.68 -34.78 62.74 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.355 -178.648 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 890' ' ' ILE . . . . . 0.449 HG22 ' N ' ' A' ' 891' ' ' ARG . 0.3 OUTLIER -73.32 -36.72 49.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 120.9 -0.32 . . . . 0.0 110.904 -179.712 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 891' ' ' ARG . . . . . 0.449 ' N ' HG22 ' A' ' 890' ' ' ILE . 6.2 ptm180 -75.57 -25.26 56.91 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.969 0.414 . . . . 0.0 110.097 176.799 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -71.01 -45.41 63.99 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.209 175.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 893' ' ' LEU . . . . . 0.532 HD22 HD23 ' A' ' 861' ' ' LEU . 4.4 tp -68.08 -45.81 72.77 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.571 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 125.49 66.41 0.18 Allowed Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.155 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 895' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 895' ' ' LEU . 0.0 OUTLIER -55.52 121.6 9.41 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.18 0.514 . . . . 0.0 110.204 176.599 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -123.12 17.8 9.97 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.323 0.582 . . . . 0.0 111.021 -176.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 897' ' ' LEU . . . . . 0.446 ' HA ' ' HD3' ' A' ' 898' ' ' PRO . 0.0 OUTLIER -144.03 138.54 15.09 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.203 -177.003 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 898' ' ' PRO . . . . . 0.446 ' HD3' ' HA ' ' A' ' 897' ' ' LEU . 33.1 Cg_exo -61.43 140.78 89.59 Favored 'Trans proline' 0 C--O 1.237 0.427 0 C-N-CA 122.709 2.273 . . . . 0.0 112.191 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 899' ' ' VAL . . . . . 0.888 HG13 ' HA ' ' A' ' 919' ' ' MET . 0.2 OUTLIER -128.88 138.42 54.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.655 0.74 . . . . 0.0 110.94 -178.425 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 900' ' ' ILE . . . . . . . . . . . . . 4.1 mt -91.15 114.29 28.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 115.33 -0.85 . . . . 0.0 109.905 177.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 901' ' ' GLY . . . . . 0.508 ' O ' ' HA ' ' A' ' 922' ' ' CYS . . . -84.52 106.66 2.94 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.266 -179.201 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 902' ' ' VAL . . . . . 0.506 ' HB ' ' HA ' ' A' ' 875' ' ' ASP . 1.1 t -110.07 140.04 30.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -150.82 150.03 30.44 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 110.267 -0.271 . . . . 0.0 110.267 176.542 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -69.79 114.54 8.08 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 169.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -54.7 106.45 0.21 Allowed 'General case' 0 CA--C 1.513 -0.453 0 CA-C-O 121.539 0.685 . . . . 0.0 110.64 -174.427 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 906' ' ' ALA . . . . . 0.569 ' O ' ' HB2' ' A' ' 907' ' ' LEU . . . -120.8 -81.64 0.64 Allowed 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 114.851 -1.068 . . . . 0.0 110.109 -175.464 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 907' ' ' LEU . . . . . 0.569 ' HB2' ' O ' ' A' ' 906' ' ' ALA . 0.4 OUTLIER 160.24 137.87 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.475 -1.239 . . . . 0.0 108.496 -176.692 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . 74.69 -50.72 0.67 Allowed 'General case' 0 N--CA 1.467 0.391 0 O-C-N 123.788 0.68 . . . . 0.0 111.977 175.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.98 -38.8 92.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.119 0.485 . . . . 0.0 111.027 179.7 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 910' ' ' GLU . . . . . 0.473 ' H ' ' HG3' ' A' ' 910' ' ' GLU . 0.5 OUTLIER -67.15 -29.12 68.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.449 0.642 . . . . 0.0 109.496 175.581 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 1.4 ttpm? -77.69 -15.94 58.83 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.315 178.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -75.59 -37.53 59.8 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 173.266 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.49 -40.46 87.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.672 172.582 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 70.8 m -71.54 -26.5 62.67 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.156 176.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.6 -44.6 70.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.643 -179.809 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -77.85 -48.11 17.25 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.059 178.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.8 25.92 3.23 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.066 0.546 . . . . 0.0 111.776 -175.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -98.62 24.02 33.82 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.156 -178.017 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 919' ' ' MET . . . . . 0.888 ' HA ' HG13 ' A' ' 899' ' ' VAL . 1.5 mpt? -112.44 -86.19 0.56 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 110.162 -0.31 . . . . 0.0 110.162 -179.396 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 920' ' ' ASP . . . . . 0.585 ' HB2' ' O ' ' A' ' 919' ' ' MET . 8.4 t70 160.38 -73.17 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.449 0 O-C-N 124.614 1.196 . . . . 0.0 109.357 175.549 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -90.77 172.97 8.27 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.077 -173.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 922' ' ' CYS . . . . . 0.508 ' HA ' ' O ' ' A' ' 901' ' ' GLY . 0.1 OUTLIER -149.73 121.33 8.01 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.485 177.794 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 923' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -143.7 173.04 12.02 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.894 0.378 . . . . 0.0 110.31 175.138 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 1.8 m -94.52 153.29 17.97 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.436 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 925' ' ' LYS . . . . . 0.413 ' N ' ' HD2' ' A' ' 926' ' ' PRO . 25.8 tttp -46.93 -48.99 51.42 Favored Pre-proline 0 CA--C 1.538 0.519 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -178.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 926' ' ' PRO . . . . . 0.413 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 50.2 Cg_endo -69.67 72.52 1.39 Allowed 'Trans proline' 0 C--N 1.355 0.901 0 C-N-CA 121.634 1.556 . . . . 0.0 112.815 177.257 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 927' ' ' VAL . . . . . 0.572 HG12 ' HB ' ' A' ' 932' ' ' ILE . 34.2 t -79.62 119.19 28.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.428 177.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.42 156.55 38.94 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.228 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 929' ' ' LEU . . . . . 0.709 HD22 ' HG3' ' A' ' 843' ' ' GLN . 1.4 tm? -56.57 -46.05 80.97 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.631 -176.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -67.43 -33.09 74.44 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.372 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 54.0 t -70.08 -49.23 57.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.876 -177.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 932' ' ' ILE . . . . . 0.572 ' HB ' HG12 ' A' ' 927' ' ' VAL . 0.8 OUTLIER -61.1 -39.59 82.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 178.861 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 2.4 tmmt? -61.93 -48.79 78.85 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.894 178.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 -66.16 -48.22 71.48 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.487 -177.081 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 4.3 m -61.85 -44.16 97.38 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.165 -178.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 936' ' ' LEU . . . . . 0.498 ' O ' ' HB1' ' A' ' 940' ' ' ALA . 0.7 OUTLIER -64.59 -41.73 96.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.513 179.527 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 86.4 m -62.36 -44.43 96.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.977 0.418 . . . . 0.0 110.819 178.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -64.98 -44.32 89.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.406 -177.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -76.64 -28.57 56.09 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.414 -177.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 940' ' ' ALA . . . . . 0.498 ' HB1' ' O ' ' A' ' 936' ' ' LEU . . . -66.71 -41.51 87.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.899 0.381 . . . . 0.0 110.179 175.248 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 941' ' ' GLU . . . . . 0.509 ' HA ' ' HB2' ' A' ' 944' ' ' ARG . 7.4 pt-20 -75.55 -22.1 57.34 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.347 177.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 942' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.28 -48.01 71.78 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.259 175.604 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 943' ' ' VAL . . . . . 0.477 HG22 ' O ' ' A' ' 940' ' ' ALA . 12.7 m -74.41 -30.93 26.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.892 0.377 . . . . 0.0 110.342 178.05 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 944' ' ' ARG . . . . . 0.509 ' HB2' ' HA ' ' A' ' 941' ' ' GLU . 0.8 OUTLIER -65.83 -31.94 73.19 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.002 177.928 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -87.73 -15.35 37.31 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.692 0.282 . . . . 0.0 110.623 177.11 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 53.2 m -72.52 -45.27 60.11 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.904 0.383 . . . . 0.0 110.053 174.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 2.9 ttp85 -78.07 -31.68 50.37 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 174.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 36.5 t70 70.41 101.43 0.06 Allowed 'General case' 0 C--O 1.233 0.235 0 CA-C-N 114.751 -1.113 . . . . 0.0 111.272 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 C--O 1.25 1.103 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.145 -177.859 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 2.9 tpt . . . . . 0 N--CA 1.481 1.103 0 N-CA-C 110.191 -0.3 . . . . 0.0 110.191 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 106.17 -76.8 0.24 Allowed Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.786 -0.721 . . . . 0.0 111.523 -179.3 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . -163.45 -131.95 1.28 Allowed Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 121.044 -0.598 . . . . 0.0 111.937 177.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 5.7 m -92.82 148.48 22.0 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 120.951 0.405 . . . . 0.0 110.649 -179.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . -103.67 38.55 3.19 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.992 -0.623 . . . . 0.0 112.134 -177.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 11.5 p -152.78 152.29 10.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 N-CA-C 110.24 -0.281 . . . . 0.0 110.24 -178.493 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -96.9 -143.28 0.29 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 175.255 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . 72.87 68.35 1.61 Allowed Glycine 0 C--N 1.33 0.213 0 C-N-CA 120.516 -0.85 . . . . 0.0 111.174 -176.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.522 ' H ' HD12 ' A' ' 704' ' ' LEU . 0.0 OUTLIER -74.55 121.77 22.06 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.724 0.773 . . . . 0.0 112.499 -171.678 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 705' ' ' SER . . . . . 0.565 ' HA ' ' HA3' ' A' ' 730' ' ' GLY . 4.6 m -94.19 47.72 1.21 Allowed 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.153 -0.931 . . . . 0.0 109.444 172.161 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . -145.42 43.94 0.9 Allowed Glycine 0 N--CA 1.447 -0.596 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.617 -176.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 707' ' ' LYS . . . . . 0.639 ' HB2' HD12 ' A' ' 731' ' ' ILE . 1.2 mmtt -133.99 143.92 48.43 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 178.201 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 708' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.06 152.82 20.53 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.246 0.546 . . . . 0.0 110.993 -177.566 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -131.59 112.36 12.54 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.766 175.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 710' ' ' TRP . . . . . 0.641 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 84.5 m95 -92.51 121.12 33.66 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.431 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 711' ' ' LEU . . . . . 0.659 HD13 ' SG ' ' A' ' 719' ' ' CYS . 2.4 pt? -128.77 131.15 47.81 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.528 0.68 . . . . 0.0 111.297 -177.02 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -127.43 66.34 1.31 Allowed 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.876 177.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 713' ' ' VAL . . . . . 0.748 ' HB ' ' SG ' ' A' ' 719' ' ' CYS . 45.9 t -113.85 130.09 68.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.109 -179.015 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 714' ' ' ARG . . . . . 0.485 ' HD2' ' OD2' ' A' ' 750' ' ' ASP . 20.6 mtt180 -81.37 -13.42 58.35 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.209 -177.536 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -87.4 122.2 30.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.411 178.098 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -70.59 -35.65 73.14 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.74 -176.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.18 -54.41 47.23 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.115 0.483 . . . . 0.0 110.244 177.502 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 718' ' ' LEU . . . . . 0.71 HD21 HD13 ' A' ' 722' ' ' LEU . 0.8 OUTLIER -61.99 -49.38 76.29 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.763 -179.499 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 719' ' ' CYS . . . . . 0.748 ' SG ' ' HB ' ' A' ' 713' ' ' VAL . 0.7 OUTLIER -59.31 -53.08 62.3 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.205 -177.287 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 720' ' ' GLN . . . . . 0.46 ' O ' ' HG3' ' A' ' 723' ' ' GLU . 48.0 tt0 -65.28 -44.34 88.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.798 -174.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -56.52 -48.81 76.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.822 0.344 . . . . 0.0 110.954 -176.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 722' ' ' LEU . . . . . 0.71 HD13 HD21 ' A' ' 718' ' ' LEU . 76.3 mt -68.35 -48.12 65.65 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.09 -178.731 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 723' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 720' ' ' GLN . 0.0 OUTLIER -62.15 -42.73 99.53 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 111.705 0.261 . . . . 0.0 111.705 -174.092 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 724' ' ' THR . . . . . . . . . . . . . 27.8 m -69.08 -37.52 78.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.837 0.351 . . . . 0.0 111.022 -179.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 23.8 m -67.76 -37.88 82.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.804 0.335 . . . . 0.0 111.151 178.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 726' ' ' LEU . . . . . 0.752 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 18.4 mt -75.15 -38.57 60.9 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.998 0.428 . . . . 0.0 111.101 -178.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -74.47 -4.3 35.91 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.148 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.78 -44.11 94.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.277 -0.42 . . . . 0.0 109.95 174.988 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -80.67 -68.76 0.65 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.068 175.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 730' ' ' GLY . . . . . 0.565 ' HA3' ' HA ' ' A' ' 705' ' ' SER . . . 172.28 26.07 0.02 OUTLIER Glycine 0 N--CA 1.442 -0.919 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.942 176.051 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 731' ' ' ILE . . . . . 0.752 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 13.5 mm -84.09 91.49 2.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 177.763 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 732' ' ' VAL . . . . . . . . . . . . . 1.8 p -67.46 120.71 15.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.601 0.715 . . . . 0.0 111.173 -176.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 733' ' ' VAL . . . . . 0.47 ' HB ' HD22 ' A' ' 711' ' ' LEU . 4.3 m -91.32 147.63 5.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.087 -178.028 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 734' ' ' THR . . . . . 0.447 ' HB ' ' CZ3' ' A' ' 710' ' ' TRP . 0.1 OUTLIER -143.61 138.44 29.02 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.767 178.309 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.25 110.91 1.17 Allowed 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.788 176.46 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 736' ' ' TYR . . . . . 0.641 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 46.2 t80 -80.52 93.17 6.0 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.371 0.605 . . . . 0.0 110.175 178.158 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -97.21 -30.85 12.75 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.763 177.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 162.64 56.78 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 111.019 -0.832 . . . . 0.0 111.019 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 739' ' ' GLN . . . . . 0.45 ' HB3' ' H ' ' A' ' 740' ' ' GLU . 15.2 mp0 -101.99 -144.95 0.35 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.91 0.386 . . . . 0.0 111.728 -172.425 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 740' ' ' GLU . . . . . 0.45 ' H ' ' HB3' ' A' ' 739' ' ' GLN . 2.3 pt-20 -106.02 125.11 33.92 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.117 -173.609 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 741' ' ' PRO . . . . . 0.58 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 73.4 Cg_endo -78.5 123.34 5.92 Favored 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 122.471 2.114 . . . . 0.0 112.267 175.487 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 742' ' ' THR . . . . . 0.875 HG23 ' HD2' ' A' ' 743' ' ' PRO . 0.2 OUTLIER -118.84 141.8 30.72 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.589 178.506 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 743' ' ' PRO . . . . . 0.875 ' HD2' HG23 ' A' ' 742' ' ' THR . 34.7 Cg_endo -65.55 -1.38 4.72 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 123.314 2.676 . . . . 0.0 113.032 179.036 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -103.34 -8.48 20.24 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.245 0.545 . . . . 0.0 110.4 177.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -112.75 153.1 28.3 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.744 -171.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 746' ' ' VAL . . . . . 0.481 ' HA ' ' O ' ' A' ' 761' ' ' ALA . 8.3 m -116.94 147.92 20.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.817 178.353 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 747' ' ' LEU . . . . . 0.46 ' HA ' HD23 ' A' ' 747' ' ' LEU . 0.0 OUTLIER -107.86 104.61 14.12 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.372 179.933 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -99.49 111.89 30.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 177.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 14.0 p -124.09 156.22 36.98 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.896 0.379 . . . . 0.0 111.418 -175.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 750' ' ' ASP . . . . . 0.617 ' HB3' HG11 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -109.16 130.77 55.48 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 168.464 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 751' ' ' GLU . . . . . 0.433 ' HG3' ' N ' ' A' ' 752' ' ' VAL . 4.4 tp10 72.86 153.25 0.13 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.188 -167.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 752' ' ' VAL . . . . . 0.754 HG22 ' HB ' ' A' ' 772' ' ' ILE . 1.4 t -70.82 123.5 25.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.63 -178.401 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 11.1 m -101.32 155.09 4.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.563 -179.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -83.24 75.15 9.97 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.061 178.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -154.24 127.3 8.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.066 0.46 . . . . 0.0 111.568 -175.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.96 81.2 4.59 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 169.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 757' ' ' TRP . . . . . 0.58 ' CH2' ' HA ' ' A' ' 741' ' ' PRO . 70.7 t-105 -68.24 100.64 1.06 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.759 -177.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.39 49.15 0.99 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.38 0.61 . . . . 0.0 109.805 178.659 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 759' ' ' GLY . . . . . 0.458 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -104.13 -131.34 7.15 Favored Glycine 0 N--CA 1.444 -0.768 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.396 178.827 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 2.9 ttm-85 -79.83 -50.41 10.56 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.102 177.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 761' ' ' ALA . . . . . 0.481 ' O ' ' HA ' ' A' ' 746' ' ' VAL . . . -166.93 157.87 12.07 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.256 179.065 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 762' ' ' VAL . . . . . 0.555 HG12 ' HA ' ' A' ' 780' ' ' GLU . 1.4 p -133.91 122.8 43.16 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 176.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 763' ' ' VAL . . . . . 0.541 HG12 HD21 ' A' ' 791' ' ' LEU . 41.8 t -114.71 115.11 48.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.291 -0.413 . . . . 0.0 109.904 -178.284 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 764' ' ' THR . . . . . 0.458 HG22 ' HA ' ' A' ' 752' ' ' VAL . 34.2 m -112.2 119.09 37.17 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.246 0.546 . . . . 0.0 111.321 -178.321 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 765' ' ' PHE . . . . . 0.607 ' HA ' ' O ' ' A' ' 783' ' ' HIS . 91.3 m-85 -84.06 98.0 9.62 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.372 175.163 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 766' ' ' CYS . . . . . 0.423 ' SG ' ' HA ' ' A' ' 751' ' ' GLU . 1.7 t -140.04 141.35 36.27 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -172.807 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 767' ' ' ARG . . . . . 0.502 ' HE ' ' HB3' ' A' ' 767' ' ' ARG . 0.0 OUTLIER -104.29 -31.03 9.76 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.026 174.654 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.92 -50.86 7.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.194 177.401 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . 0.569 ' HA ' ' CG2' ' A' ' 752' ' ' VAL . 12.3 p-80 46.93 88.22 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.331 1.052 . . . . 0.0 113.037 177.484 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 6.1 mt -78.05 -74.21 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.919 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 771' ' ' GLY . . . . . 0.607 ' H ' HG11 ' A' ' 752' ' ' VAL . . . -111.85 7.91 27.62 Favored Glycine 0 C--N 1.332 0.317 0 C-N-CA 120.485 -0.864 . . . . 0.0 114.375 -170.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 772' ' ' ILE . . . . . 0.754 ' HB ' HG22 ' A' ' 752' ' ' VAL . 43.2 mm -105.0 115.58 62.16 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 117.647 0.724 . . . . 0.0 110.397 176.307 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 773' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -90.63 -170.41 0.38 Allowed 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 123.769 2.98 . . . . 0.0 112.465 176.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -95.32 -158.22 0.63 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.509 178.041 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 775' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.49 61.92 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -179.085 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -121.56 22.15 10.71 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 167.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 777' ' ' ALA . . . . . 0.836 ' HB1' ' HD2' ' A' ' 778' ' ' PRO . . . -148.47 176.31 2.3 Favored Pre-proline 0 N--CA 1.451 -0.399 0 CA-C-N 113.611 -1.632 . . . . 0.0 108.794 -175.39 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 778' ' ' PRO . . . . . 0.836 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 51.8 Cg_endo -68.65 61.96 1.2 Allowed 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 122.702 2.268 . . . . 0.0 114.176 -178.807 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 102.02 22.26 10.2 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.611 -0.804 . . . . 0.0 113.764 173.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 780' ' ' GLU . . . . . 0.565 ' HB2' ' HB3' ' A' ' 777' ' ' ALA . 0.3 OUTLIER -79.57 125.28 29.39 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 117.111 0.456 . . . . 0.0 110.564 178.213 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 20.3 m95 -130.12 115.62 17.32 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.65 0.262 . . . . 0.0 110.429 179.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . 0.436 ' H ' HG21 ' A' ' 782' ' ' VAL . 0.1 OUTLIER -103.04 136.02 37.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 110.176 -0.305 . . . . 0.0 110.176 175.263 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 783' ' ' HIS . . . . . 0.607 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.2 OUTLIER -152.1 132.93 14.11 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.725 0.298 . . . . 0.0 110.827 179.202 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -99.44 100.24 11.26 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.982 0.42 . . . . 0.0 110.176 174.121 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -164.56 178.92 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.764 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -111.51 28.95 8.27 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.94 0.4 . . . . 0.0 110.187 175.106 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 57.82 70.54 1.26 Allowed Pre-proline 0 N--CA 1.465 0.285 0 CA-C-N 115.32 -0.855 . . . . 0.0 111.278 -178.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 788' ' ' PRO . . . . . 0.4 ' HB2' ' H ' ' A' ' 789' ' ' HIS . 5.3 Cg_exo -77.09 -96.34 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.724 2.283 . . . . 0.0 112.438 -178.34 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 789' ' ' HIS . . . . . 0.4 ' H ' ' HB2' ' A' ' 788' ' ' PRO . 0.2 OUTLIER -124.11 2.94 8.62 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.964 0.411 . . . . 0.0 111.717 -178.319 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 790' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -104.38 -46.66 4.33 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.669 -175.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 791' ' ' LEU . . . . . 0.58 ' HG ' ' CZ ' ' A' ' 765' ' ' PHE . 0.4 OUTLIER -62.91 -51.23 72.73 Favored Pre-proline 0 C--N 1.327 -0.382 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -178.803 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 792' ' ' PRO . . . . . 0.425 ' HD3' ' HB3' ' A' ' 791' ' ' LEU . 24.5 Cg_exo -60.95 -30.59 90.22 Favored 'Trans proline' 0 C--N 1.354 0.836 0 C-N-CA 121.445 1.43 . . . . 0.0 111.626 179.747 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -68.98 -45.49 70.5 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.413 176.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 794' ' ' LEU . . . . . 0.453 HD22 ' HA ' ' A' ' 794' ' ' LEU . 0.2 OUTLIER -63.78 -36.58 84.36 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.687 179.437 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 795' ' ' LEU . . . . . 0.413 HD11 HD13 ' A' ' 726' ' ' LEU . 0.4 OUTLIER -63.56 -47.61 80.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.771 179.622 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -66.14 -33.6 76.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.105 179.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 1.5 ttt-85 -71.05 -37.12 72.53 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.889 179.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -69.53 -31.45 49.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.827 -178.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 799' ' ' TYR . . . . . 0.55 ' HD1' ' HE3' ' A' ' 707' ' ' LYS . 17.3 m-85 -85.39 -0.43 54.82 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.578 178.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 47.7 mt 58.4 44.7 17.85 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.337 178.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 801' ' ' ILE . . . . . 0.435 ' C ' ' H ' ' A' ' 803' ' ' MET . 48.0 mm -72.01 -40.57 67.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.14 177.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 802' ' ' GLU . . . . . 0.481 ' HA ' ' OG ' ' A' ' 805' ' ' SER . 8.0 mm-40 72.13 -21.68 0.22 Allowed 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.619 0.768 . . . . 0.0 112.873 173.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 803' ' ' MET . . . . . 0.435 ' H ' ' C ' ' A' ' 801' ' ' ILE . 6.1 tpt -71.36 -32.15 68.17 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.285 0.564 . . . . 0.0 109.881 175.602 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 804' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -112.29 12.17 20.23 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.995 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 805' ' ' SER . . . . . 0.481 ' OG ' ' HA ' ' A' ' 802' ' ' GLU . 13.8 m -82.98 81.97 8.43 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 174.089 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -80.65 52.54 1.7 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.669 -172.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -130.84 90.72 39.07 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.084 177.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 808' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -81.63 54.72 5.23 Favored 'Trans proline' 0 N--CA 1.462 -0.381 0 C-N-CA 122.647 2.232 . . . . 0.0 111.645 178.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . 60.14 67.42 0.86 Allowed 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.751 -0.658 . . . . 0.0 109.381 -173.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -45.93 -62.52 1.28 Allowed 'General case' 0 C--O 1.232 0.181 0 CA-C-N 114.843 -1.071 . . . . 0.0 112.752 -174.473 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -142.32 -53.26 0.41 Allowed 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -176.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -113.45 122.66 34.84 Favored Pre-proline 0 C--N 1.322 -0.587 0 CA-C-O 120.561 0.22 . . . . 0.0 111.546 -173.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_exo -58.0 -47.24 21.28 Favored 'Trans proline' 0 C--O 1.232 0.209 0 C-N-CA 122.638 2.225 . . . . 0.0 110.996 172.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 1.4 m 69.88 -58.54 0.53 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.884 0.874 . . . . 0.0 113.1 173.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -82.15 88.6 6.46 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.244 0.545 . . . . 0.0 112.296 -174.009 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 47.0 t0 -91.75 163.68 13.99 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.689 174.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.75 -62.22 1.75 Allowed 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 -179.539 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . 60.56 89.83 0.07 Allowed 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.817 176.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -101.28 135.82 35.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.664 179.519 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 1.7 m -130.61 93.79 3.51 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.104 0.478 . . . . 0.0 111.025 -177.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -83.0 74.55 9.95 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.055 0.455 . . . . 0.0 110.742 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -111.15 5.38 20.01 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.411 179.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -101.93 107.44 18.59 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.662 -178.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -129.26 -35.82 1.76 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -173.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 825' ' ' MET . . . . . 0.535 ' O ' ' HB2' ' A' ' 850' ' ' GLN . 0.1 OUTLIER -127.83 106.66 9.27 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.979 -176.767 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 826' ' ' MET . . . . . 0.4 ' H ' ' HG2' ' A' ' 826' ' ' MET . 0.0 OUTLIER -97.84 108.86 21.66 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.301 0.572 . . . . 0.0 111.3 -177.042 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 827' ' ' ILE . . . . . 0.658 HD11 ' HB ' ' A' ' 871' ' ' ILE . 9.6 mm -107.52 136.13 43.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.312 175.755 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 828' ' ' LEU . . . . . 0.457 ' HB2' HG12 ' A' ' 869' ' ' ILE . 46.2 tp -106.17 122.61 46.56 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.994 0.425 . . . . 0.0 110.541 -176.599 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 829' ' ' VAL . . . . . 0.604 ' HB ' ' HD2' ' A' ' 837' ' ' ARG . 0.8 OUTLIER -113.38 111.55 36.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.19 -179.361 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 830' ' ' VAL . . . . . . . . . . . . . 12.7 t -117.37 129.27 74.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.335 -179.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 831' ' ' ASP . . . . . 0.743 ' HB2' ' NE ' ' A' ' 837' ' ' ARG . 9.1 t0 -134.61 142.54 46.94 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 173.028 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 832' ' ' ASP . . . . . 0.4 ' HB2' ' HB2' ' A' ' 878' ' ' MET . 4.8 p-10 -65.98 -15.1 62.71 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.132 0.492 . . . . 0.0 110.432 174.108 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 22.1 m170 -117.41 104.99 49.21 Favored Pre-proline 0 C--O 1.234 0.268 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.486 171.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -57.67 -35.77 98.7 Favored 'Trans proline' 0 CA--C 1.532 0.392 0 C-N-CA 123.184 2.589 . . . . 0.0 113.799 -173.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 835' ' ' ILE . . . . . 0.505 ' O ' ' HG3' ' A' ' 838' ' ' ARG . 0.0 OUTLIER -59.55 -44.38 93.0 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-O 121.006 0.432 . . . . 0.0 111.199 -177.737 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 836' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -65.41 -40.09 92.95 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.248 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 837' ' ' ARG . . . . . 0.743 ' NE ' ' HB2' ' A' ' 831' ' ' ASP . 0.0 OUTLIER -64.97 -46.99 79.21 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.675 -177.028 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 838' ' ' ARG . . . . . 0.505 ' HG3' ' O ' ' A' ' 835' ' ' ILE . 0.3 OUTLIER -65.87 -29.13 69.53 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.839 0.352 . . . . 0.0 110.962 -179.28 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 8.5 mt -66.41 -52.56 45.31 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.944 -179.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 840' ' ' LEU . . . . . 0.401 HD22 ' CZ ' ' A' ' 837' ' ' ARG . 1.2 pp -72.68 -26.66 61.7 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.588 179.247 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -65.58 -33.28 75.55 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.008 0.433 . . . . 0.0 110.202 174.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -63.14 -43.5 98.2 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.045 175.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 843' ' ' GLN . . . . . 0.467 ' CB ' HD22 ' A' ' 929' ' ' LEU . 45.2 mm-40 -64.29 -39.73 94.52 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.387 176.565 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 844' ' ' LEU . . . . . 0.804 HD11 ' HB2' ' A' ' 849' ' ' TYR . 0.0 OUTLIER -61.15 -34.96 75.86 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.578 176.575 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -62.41 -39.0 97.22 Favored Glycine 0 N--CA 1.445 -0.72 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.003 176.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -70.32 -23.25 62.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.92 0.391 . . . . 0.0 110.985 176.514 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 847' ' ' LEU . . . . . 0.454 HD22 ' HA ' ' A' ' 847' ' ' LEU . 5.4 mt -78.81 -21.47 47.69 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.885 0.374 . . . . 0.0 111.127 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 102.21 12.15 34.55 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.662 -0.78 . . . . 0.0 113.545 174.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 849' ' ' TYR . . . . . 0.804 ' HB2' HD11 ' A' ' 844' ' ' LEU . 66.6 m-85 -104.68 138.4 41.04 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.958 0.379 . . . . 0.0 109.986 178.658 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 850' ' ' GLN . . . . . 0.535 ' HB2' ' O ' ' A' ' 825' ' ' MET . 4.7 mp0 -73.03 121.08 19.57 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 179.275 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 851' ' ' CYS . . . . . 0.459 ' SG ' ' HB3' ' A' ' 844' ' ' LEU . 0.0 OUTLIER -108.13 126.83 53.23 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 120.988 0.423 . . . . 0.0 111.607 -173.884 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.36 111.76 24.48 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 174.797 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -91.18 124.58 35.5 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 120.93 0.395 . . . . 0.0 111.451 -174.632 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 854' ' ' ALA . . . . . . . . . . . . . . . -130.11 142.28 50.61 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.961 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 855' ' ' ASN . . . . . 0.558 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 20.2 t30 -124.22 74.99 1.34 Allowed 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 177.026 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 856' ' ' ASP . . . . . 0.704 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 12.0 t70 166.14 147.37 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.036 177.043 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -71.9 -41.91 54.13 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.566 178.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 2.0 t -73.7 -34.7 41.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.077 0.465 . . . . 0.0 110.598 -178.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 859' ' ' ASP . . . . . 0.704 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 1.1 t0 -64.27 -27.74 69.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.939 -178.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -62.14 -38.39 88.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.139 0.495 . . . . 0.0 110.352 176.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 861' ' ' LEU . . . . . 0.485 HD23 HG23 ' A' ' 890' ' ' ILE . 0.2 OUTLIER -74.14 -33.01 63.39 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.93 176.933 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -60.56 -53.76 53.64 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.858 178.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 10.7 p -66.01 -32.21 57.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.769 0.318 . . . . 0.0 110.945 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 864' ' ' LEU . . . . . 0.539 HD21 ' HA ' ' A' ' 864' ' ' LEU . 0.6 OUTLIER -62.99 -40.46 97.82 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.565 176.578 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 7.4 m -74.31 -27.28 60.64 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.862 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 866' ' ' LYS . . . . . 0.522 ' HA ' ' HD2' ' A' ' 866' ' ' LYS . 1.3 tptm -69.79 -55.85 8.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.716 179.532 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 867' ' ' ASN . . . . . 0.456 ' HB3' ' H ' ' A' ' 868' ' ' HIS . 6.0 t30 -119.15 -105.5 0.39 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.905 178.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 868' ' ' HIS . . . . . 0.456 ' H ' ' HB3' ' A' ' 867' ' ' ASN . 0.1 OUTLIER 178.93 155.54 0.45 Allowed 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 178.571 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 869' ' ' ILE . . . . . 0.457 HG12 ' HB2' ' A' ' 828' ' ' LEU . 0.7 OUTLIER -143.25 147.98 19.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 -179.794 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.69 -49.98 5.13 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.694 0.283 . . . . 0.0 111.356 -178.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 871' ' ' ILE . . . . . 0.658 ' HB ' HD11 ' A' ' 827' ' ' ILE . 18.7 mm -111.54 123.98 67.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.272 -178.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 872' ' ' VAL . . . . . 0.52 HG21 HD12 ' A' ' 897' ' ' LEU . 1.8 t -109.52 125.92 66.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.217 -179.086 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 873' ' ' LEU . . . . . 0.676 HD11 HD11 ' A' ' 936' ' ' LEU . 47.3 mt -111.49 100.83 9.32 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 173.456 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 5.7 m -105.77 101.49 11.0 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.939 0.4 . . . . 0.0 111.22 -176.206 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 875' ' ' ASP . . . . . 0.663 ' OD1' ' HG2' ' A' ' 925' ' ' LYS . 0.6 OUTLIER -92.62 106.6 18.55 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.383 -179.517 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 876' ' ' VAL . . . . . 0.558 HG11 ' HG2' ' A' ' 879' ' ' PRO . 0.1 OUTLIER -115.45 111.99 37.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.314 0.578 . . . . 0.0 112.134 -172.25 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -119.65 -44.59 2.54 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.664 172.044 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 878' ' ' MET . . . . . 0.4 ' HB2' ' HB2' ' A' ' 832' ' ' ASP . 4.4 tpp -69.61 -50.15 19.47 Favored Pre-proline 0 CA--C 1.537 0.443 0 CA-C-N 115.559 -0.746 . . . . 0.0 112.699 -178.844 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 879' ' ' PRO . . . . . 0.558 ' HG2' HG11 ' A' ' 876' ' ' VAL . 34.7 Cg_exo -59.3 103.94 0.19 Allowed 'Trans proline' 0 C--N 1.357 1.011 0 C-N-CA 121.961 1.774 . . . . 0.0 112.579 179.197 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -113.54 -53.9 2.65 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.715 179.243 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -94.51 -22.86 17.97 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.105 179.471 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 882' ' ' ASP . . . . . 0.435 ' C ' ' H ' ' A' ' 884' ' ' TYR . 0.6 OUTLIER -87.97 2.96 50.43 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.836 -179.38 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -76.9 38.33 1.52 Allowed Glycine 0 C--N 1.331 0.301 0 CA-C-N 115.793 -0.64 . . . . 0.0 112.047 178.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 884' ' ' TYR . . . . . 0.435 ' H ' ' C ' ' A' ' 882' ' ' ASP . 0.0 OUTLIER -137.22 -40.91 0.58 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 -179.952 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -68.47 -47.33 67.39 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.677 -179.017 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 886' ' ' LEU . . . . . 0.635 ' HG ' ' N ' ' A' ' 887' ' ' THR . 0.0 OUTLIER -65.55 -43.55 89.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.646 -0.252 . . . . 0.0 110.384 -179.495 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 887' ' ' THR . . . . . 0.635 ' N ' ' HG ' ' A' ' 886' ' ' LEU . 0.0 OUTLIER -62.52 -44.89 95.25 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.218 0.532 . . . . 0.0 110.662 -179.483 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 888' ' ' GLN . . . . . 0.78 ' HA ' ' HD3' ' A' ' 891' ' ' ARG . 15.9 tt0 -63.47 -41.31 98.61 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.624 177.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -67.27 -41.66 85.13 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.192 0.441 . . . . 0.0 112.192 -175.185 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 890' ' ' ILE . . . . . 0.612 HG13 ' O ' ' A' ' 886' ' ' LEU . 22.2 mt -68.54 -42.63 83.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.881 -179.478 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 891' ' ' ARG . . . . . 0.78 ' HD3' ' HA ' ' A' ' 888' ' ' GLN . 0.7 OUTLIER -68.92 -23.93 64.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.032 0.444 . . . . 0.0 110.216 177.262 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 -71.18 -42.14 69.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.367 176.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 893' ' ' LEU . . . . . 0.461 ' HA ' HD22 ' A' ' 893' ' ' LEU . 0.2 OUTLIER -71.26 -32.8 69.14 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.183 179.071 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 115.66 87.5 1.41 Allowed Glycine 0 N--CA 1.441 -1.017 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.747 178.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 895' ' ' LEU . . . . . 0.562 HD12 HG22 ' A' ' 899' ' ' VAL . 0.3 OUTLIER -63.74 109.27 1.66 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.125 0.488 . . . . 0.0 110.602 177.781 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -120.77 16.95 11.9 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.805 0.812 . . . . 0.0 109.469 176.284 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 897' ' ' LEU . . . . . 0.52 HD12 HG21 ' A' ' 872' ' ' VAL . 0.0 OUTLIER -139.06 123.88 11.63 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 114.801 -1.09 . . . . 0.0 109.283 -176.665 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 898' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 897' ' ' LEU . 35.5 Cg_exo -59.28 121.41 9.86 Favored 'Trans proline' 0 C--O 1.238 0.494 0 C-N-CA 122.888 2.392 . . . . 0.0 112.305 -177.69 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 899' ' ' VAL . . . . . 0.601 HG13 ' HG2' ' A' ' 919' ' ' MET . 26.5 t -98.36 108.68 22.45 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 CA-C-O 121.257 0.551 . . . . 0.0 110.639 -179.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 900' ' ' ILE . . . . . 0.534 HD11 HD23 ' A' ' 873' ' ' LEU . 2.5 mt -84.41 92.42 3.11 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 175.445 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 901' ' ' GLY . . . . . 0.694 ' HA3' ' SD ' ' A' ' 919' ' ' MET . . . -83.4 122.41 5.77 Favored Glycine 0 N--CA 1.441 -1.026 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.075 -176.093 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 902' ' ' VAL . . . . . 0.661 ' HB ' ' HB2' ' A' ' 923' ' ' LEU . 0.2 OUTLIER -111.57 117.09 54.28 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 178.459 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 903' ' ' THR . . . . . 0.71 ' HB ' ' HB2' ' A' ' 906' ' ' ALA . 0.0 OUTLIER -107.64 148.88 28.77 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.917 -172.271 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 904' ' ' ALA . . . . . 0.659 ' HB1' ' HG3' ' A' ' 925' ' ' LYS . . . -90.51 134.51 34.31 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.494 175.538 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 53.69 43.26 31.34 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.298 179.627 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 906' ' ' ALA . . . . . 0.71 ' HB2' ' HB ' ' A' ' 903' ' ' THR . . . -92.25 93.76 8.82 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.059 177.245 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -52.33 -49.11 64.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.254 -178.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -127.06 88.56 2.83 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.103 176.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 909' ' ' GLU . . . . . 0.676 ' HB3' ' HB2' ' A' ' 922' ' ' CYS . 10.7 mt-10 -57.85 -34.97 70.28 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.179 -176.865 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 910' ' ' GLU . . . . . 0.434 ' H ' ' HG3' ' A' ' 910' ' ' GLU . 0.0 OUTLIER -58.78 -57.03 14.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.998 178.638 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 8.0 tttt -65.52 -27.93 68.82 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.197 179.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -62.91 -44.96 94.67 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 176.022 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 913' ' ' ARG . . . . . 0.492 ' O ' ' HD2' ' A' ' 913' ' ' ARG . 0.0 OUTLIER -65.63 -37.9 87.86 Favored 'General case' 0 C--O 1.225 -0.201 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.053 175.999 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 19.0 m -58.66 -37.16 75.39 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.871 0.367 . . . . 0.0 110.937 177.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.84 -51.23 42.69 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.755 -178.206 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 916' ' ' GLU . . . . . 0.429 ' OE2' ' HD3' ' A' ' 913' ' ' ARG . 0.0 OUTLIER -77.11 -42.64 37.18 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 111.627 0.232 . . . . 0.0 111.627 -175.219 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 1.4 m 53.06 52.15 14.35 Favored 'General case' 0 C--O 1.235 0.32 0 O-C-N 123.464 0.478 . . . . 0.0 112.149 -178.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -139.66 -32.8 0.17 Allowed Glycine 0 CA--C 1.523 0.578 0 C-N-CA 120.51 -0.853 . . . . 0.0 113.745 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 919' ' ' MET . . . . . 0.694 ' SD ' ' HA3' ' A' ' 901' ' ' GLY . 20.2 mtt -76.58 -93.54 0.03 OUTLIER 'General case' 0 C--O 1.238 0.488 0 CA-C-N 117.311 0.556 . . . . 0.0 112.171 -174.311 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 920' ' ' ASP . . . . . 0.507 ' HB2' ' O ' ' A' ' 919' ' ' MET . 45.0 t0 162.29 -73.16 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.191 0.996 . . . . 0.0 109.643 176.705 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -105.91 172.02 7.03 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.054 -179.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 922' ' ' CYS . . . . . 0.676 ' HB2' ' HB3' ' A' ' 909' ' ' GLU . 0.8 OUTLIER -140.42 136.78 33.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.292 0.568 . . . . 0.0 111.881 -178.278 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 923' ' ' LEU . . . . . 0.661 ' HB2' ' HB ' ' A' ' 902' ' ' VAL . 0.3 OUTLIER -133.73 178.21 7.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.192 177.158 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 924' ' ' SER . . . . . 0.492 ' O ' HG23 ' A' ' 927' ' ' VAL . 0.8 OUTLIER -104.18 143.1 33.39 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.268 178.594 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 925' ' ' LYS . . . . . 0.663 ' HG2' ' OD1' ' A' ' 875' ' ' ASP . 0.0 OUTLIER -48.63 -43.5 63.11 Favored Pre-proline 0 N--CA 1.475 0.823 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -176.034 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 926' ' ' PRO . . . . . 0.506 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 37.7 Cg_endo -66.71 68.44 0.51 Allowed 'Trans proline' 0 C--N 1.356 0.929 0 C-N-CA 121.885 1.723 . . . . 0.0 112.998 175.441 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 927' ' ' VAL . . . . . 0.616 HG12 ' HB ' ' A' ' 931' ' ' VAL . 42.3 t -87.8 110.67 21.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.038 0.447 . . . . 0.0 110.425 177.225 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.36 167.49 20.16 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.29 176.074 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 929' ' ' LEU . . . . . 0.486 HD21 ' HA ' ' A' ' 929' ' ' LEU . 0.7 OUTLIER -54.62 -38.66 67.09 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.69 0.281 . . . . 0.0 111.604 -177.975 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -68.72 -23.35 64.34 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.854 0.359 . . . . 0.0 110.747 -177.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 931' ' ' VAL . . . . . 0.616 ' HB ' HG12 ' A' ' 927' ' ' VAL . 18.4 t -78.13 -41.57 26.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.418 179.062 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 932' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -66.64 -37.16 78.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 177.277 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -60.7 -49.05 79.08 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.439 -179.503 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 934' ' ' GLN . . . . . 0.484 ' HG3' ' H ' ' A' ' 935' ' ' THR . 0.3 OUTLIER -71.74 -48.96 43.45 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -175.941 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 935' ' ' THR . . . . . 0.484 ' H ' ' HG3' ' A' ' 934' ' ' GLN . 1.6 m -66.73 -43.4 84.32 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 111.828 0.307 . . . . 0.0 111.828 -174.363 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 936' ' ' LEU . . . . . 0.676 HD11 HD11 ' A' ' 873' ' ' LEU . 0.3 OUTLIER -66.23 -49.92 65.6 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.636 0.255 . . . . 0.0 110.812 -179.577 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 95.0 m -62.2 -46.06 90.61 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.25 -178.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 938' ' ' LEU . . . . . 0.457 ' O ' ' HB3' ' A' ' 942' ' ' ARG . 29.3 tp -62.82 -47.77 81.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.182 -178.46 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 939' ' ' TYR . . . . . 0.409 ' HB3' HD13 ' A' ' 871' ' ' ILE . 0.2 OUTLIER -69.26 -40.73 77.67 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.613 -0.267 . . . . 0.0 111.171 -177.097 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 940' ' ' ALA . . . . . 0.49 ' O ' HG21 ' A' ' 943' ' ' VAL . . . -66.36 -40.98 90.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.737 0.303 . . . . 0.0 111.006 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 941' ' ' GLU . . . . . 0.575 ' O ' ' HG3' ' A' ' 944' ' ' ARG . 0.0 OUTLIER -69.99 -33.8 72.51 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.87 0.366 . . . . 0.0 110.216 178.473 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 942' ' ' ARG . . . . . 0.457 ' HB3' ' O ' ' A' ' 938' ' ' LEU . 0.0 OUTLIER -66.84 -37.7 84.98 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.446 -178.511 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 943' ' ' VAL . . . . . 0.49 HG21 ' O ' ' A' ' 940' ' ' ALA . 17.1 m -78.08 -33.8 18.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.646 -0.422 . . . . 0.0 110.954 -177.496 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 944' ' ' ARG . . . . . 0.575 ' HG3' ' O ' ' A' ' 941' ' ' GLU . 0.2 OUTLIER -73.56 -21.63 60.3 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.32 177.42 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 16.0 mmtp -67.32 -52.4 40.79 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-O 121.33 0.586 . . . . 0.0 109.885 171.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 50.3 m -63.5 -44.32 94.67 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.123 -0.944 . . . . 0.0 111.428 -177.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -68.38 -60.94 2.07 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.77 -0.196 . . . . 0.0 110.51 178.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 6.7 t70 72.55 -34.13 0.29 Allowed 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.724 0.81 . . . . 0.0 112.79 175.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 14.6 m . . . . . 0 C--O 1.246 0.915 0 CA-C-O 118.869 -0.586 . . . . 0.0 109.892 -179.601 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 2.9 tpt . . . . . 0 N--CA 1.478 0.926 0 CA-C-O 120.9 0.381 . . . . 0.0 110.501 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 146.47 169.06 13.98 Favored Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.938 -0.648 . . . . 0.0 111.87 -179.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . -81.11 62.3 4.47 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.517 -178.391 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -94.32 141.8 28.15 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.255 -0.276 . . . . 0.0 110.255 179.594 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . -159.07 -77.05 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.943 -179.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . 0.598 ' HB ' ' HB3' ' A' ' 802' ' ' GLU . 6.7 t 58.41 72.35 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 CA-C-O 121.517 0.675 . . . . 0.0 110.341 -178.768 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -75.35 70.87 2.29 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.557 -0.747 . . . . 0.0 112.43 -174.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . -85.06 -52.41 3.45 Favored Glycine 0 N--CA 1.449 -0.438 0 N-CA-C 110.527 -1.029 . . . . 0.0 110.527 171.24 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.876 ' HA ' ' HB ' ' A' ' 801' ' ' ILE . 1.8 mt 63.41 62.13 0.99 Allowed 'General case' 0 C--N 1.332 -0.172 0 C-N-CA 123.21 0.604 . . . . 0.0 112.456 173.391 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 705' ' ' SER . . . . . 0.462 ' HA ' ' C ' ' A' ' 730' ' ' GLY . 0.8 OUTLIER -127.47 145.89 50.68 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.012 175.397 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 108.51 -36.13 4.54 Favored Glycine 0 CA--C 1.52 0.355 0 C-N-CA 120.384 -0.912 . . . . 0.0 114.037 171.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 707' ' ' LYS . . . . . 0.783 ' HB2' HD12 ' A' ' 801' ' ' ILE . 7.2 mmmt -75.4 155.61 36.23 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 117.011 0.406 . . . . 0.0 111.624 -174.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 708' ' ' ARG . . . . . 0.545 ' HD3' HG12 ' A' ' 732' ' ' VAL . 0.3 OUTLIER -97.63 149.32 22.38 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.875 178.585 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -134.88 131.7 37.65 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 177.454 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 710' ' ' TRP . . . . . 0.463 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 70.4 m95 -105.06 124.72 50.01 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.901 0.382 . . . . 0.0 110.679 -177.715 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 711' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -120.51 138.97 53.55 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.198 0.523 . . . . 0.0 111.046 -179.257 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 712' ' ' ALA . . . . . 0.682 ' HB3' HG22 ' A' ' 749' ' ' THR . . . -124.6 67.39 1.09 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.125 176.002 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 713' ' ' VAL . . . . . 0.747 HG11 ' HB3' ' A' ' 750' ' ' ASP . 41.4 t -122.39 122.44 66.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.277 -177.617 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 714' ' ' ARG . . . . . 0.461 ' HB2' HH11 ' A' ' 714' ' ' ARG . 0.1 OUTLIER -86.74 -25.29 24.79 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 176.271 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -67.63 104.53 1.63 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.274 178.271 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 716' ' ' ALA . . . . . 0.625 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -60.45 -43.25 97.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.065 -0.516 . . . . 0.0 112.0 -173.071 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.02 -39.64 95.36 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.193 0.521 . . . . 0.0 110.524 179.538 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 718' ' ' LEU . . . . . 0.504 HD11 ' HA ' ' A' ' 786' ' ' ALA . 0.3 OUTLIER -73.04 -49.57 27.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.155 -178.032 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 719' ' ' CYS . . . . . 0.718 ' HB3' ' HB ' ' A' ' 713' ' ' VAL . 28.4 p -64.79 -40.59 95.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.556 -177.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 720' ' ' GLN . . . . . 0.541 ' HB2' ' O ' ' A' ' 716' ' ' ALA . 0.0 OUTLIER -63.23 -40.39 97.31 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.382 -179.543 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -57.68 -48.76 78.63 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.958 0.409 . . . . 0.0 110.47 178.842 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 722' ' ' LEU . . . . . 0.455 ' O ' ' HG ' ' A' ' 726' ' ' LEU . 6.4 mt -67.66 -48.19 67.34 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.58 -178.342 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 723' ' ' GLU . . . . . 0.566 ' HA ' HG13 ' A' ' 733' ' ' VAL . 0.0 OUTLIER -62.57 -43.97 97.5 Favored 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 111.579 0.214 . . . . 0.0 111.579 -174.126 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 724' ' ' THR . . . . . 0.497 ' O ' ' HB3' ' A' ' 728' ' ' ARG . 28.1 m -64.83 -39.26 93.29 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.715 0.293 . . . . 0.0 110.811 -179.613 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 44.0 m -65.38 -32.57 74.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.783 0.325 . . . . 0.0 111.388 179.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 726' ' ' LEU . . . . . 0.756 HD22 HD12 ' A' ' 731' ' ' ILE . 24.9 mt -81.95 -47.9 12.14 Favored 'General case' 0 C--N 1.322 -0.626 0 O-C-N 122.208 -0.307 . . . . 0.0 110.921 -178.418 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 727' ' ' GLN . . . . . 0.435 ' HG2' ' HA ' ' A' ' 724' ' ' THR . 3.1 pt20 -67.92 -25.08 65.3 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.527 -177.283 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 728' ' ' ARG . . . . . 0.497 ' HB3' ' O ' ' A' ' 724' ' ' THR . 0.0 OUTLIER -64.03 -31.37 72.54 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 121.114 0.483 . . . . 0.0 110.304 178.303 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -85.67 -51.01 6.75 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.378 179.047 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 730' ' ' GLY . . . . . 0.462 ' C ' ' HA ' ' A' ' 705' ' ' SER . . . 154.32 -6.29 0.33 Allowed Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.508 -0.853 . . . . 0.0 112.689 178.448 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 731' ' ' ILE . . . . . 0.756 HD12 HD22 ' A' ' 726' ' ' LEU . 0.2 OUTLIER -75.3 114.08 14.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 176.604 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 732' ' ' VAL . . . . . 0.545 HG12 ' HD3' ' A' ' 708' ' ' ARG . 2.1 p -74.58 113.96 13.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 121.719 0.771 . . . . 0.0 110.78 -176.377 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 733' ' ' VAL . . . . . 0.566 HG13 ' HA ' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -85.94 136.88 21.92 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.861 -179.21 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -145.36 137.7 25.79 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.483 177.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -61.47 124.86 21.81 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 173.81 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 736' ' ' TYR . . . . . 0.463 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 47.2 t80 -55.71 -47.05 77.49 Favored 'General case' 0 C--O 1.232 0.17 0 O-C-N 123.242 0.339 . . . . 0.0 110.278 -179.259 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 54.61 -108.78 0.45 Allowed 'General case' 0 CA--C 1.53 0.183 0 O-C-N 123.728 0.643 . . . . 0.0 110.431 177.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -129.62 37.67 2.13 Favored Glycine 0 N--CA 1.445 -0.743 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 176.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -84.19 -172.48 4.18 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.002 0.43 . . . . 0.0 111.31 -177.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.61 126.89 54.59 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.977 -178.888 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 741' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -71.61 123.46 9.46 Favored 'Trans proline' 0 N--CA 1.462 -0.345 0 C-N-CA 122.612 2.208 . . . . 0.0 111.876 175.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 742' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.47 134.93 19.49 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-O 120.699 0.285 . . . . 0.0 111.066 179.691 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 743' ' ' PRO . . . . . 0.516 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 57.3 Cg_endo -71.15 3.72 3.27 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 123.102 2.535 . . . . 0.0 112.464 179.419 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -109.95 -12.29 14.57 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.714 178.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 85.2 m-20 -114.47 165.44 12.74 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.722 -172.106 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 746' ' ' VAL . . . . . 0.551 HG23 HD22 ' A' ' 795' ' ' LEU . 18.8 m -117.1 148.43 19.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.965 -175.334 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 747' ' ' LEU . . . . . 0.507 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 0.3 OUTLIER -104.72 113.27 26.75 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.91 175.764 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 3.7 mt -97.45 113.53 32.16 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 175.19 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 749' ' ' THR . . . . . 0.682 HG22 ' HB3' ' A' ' 712' ' ' ALA . 0.0 OUTLIER -114.77 164.74 13.65 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.576 -170.089 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 750' ' ' ASP . . . . . 0.747 ' HB3' HG11 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -125.62 123.35 38.81 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 168.548 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 751' ' ' GLU . . . . . 0.859 ' HG2' HH21 ' A' ' 767' ' ' ARG . 0.0 OUTLIER 61.95 176.84 0.13 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.681 -172.8 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 752' ' ' VAL . . . . . 0.509 HG21 ' HB ' ' A' ' 772' ' ' ILE . 2.6 p -69.86 131.76 33.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.402 -176.182 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 753' ' ' VAL . . . . . 0.505 HG13 HD13 ' A' ' 772' ' ' ILE . 4.4 p -120.41 164.69 16.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.161 179.36 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.2 50.29 1.91 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.879 0.371 . . . . 0.0 111.023 -179.531 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -152.71 132.17 12.95 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.149 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 6.2 tptp -89.97 -18.76 25.44 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.886 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 757' ' ' TRP . . . . . 0.507 ' CD2' ' HB2' ' A' ' 747' ' ' LEU . 73.7 t-105 67.37 96.98 0.06 Allowed 'General case' 0 C--O 1.234 0.248 0 C-N-CA 123.237 0.615 . . . . 0.0 111.928 176.558 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 32.3 tp60 -86.84 58.15 4.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.445 0.641 . . . . 0.0 109.789 173.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 759' ' ' GLY . . . . . 0.516 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -119.25 -147.29 8.06 Favored Glycine 0 N--CA 1.443 -0.834 0 CA-C-N 115.696 -0.684 . . . . 0.0 112.016 -179.075 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 5.3 ttm180 -77.01 -59.74 2.65 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.204 0.526 . . . . 0.0 109.922 177.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -152.88 155.12 36.44 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.0 -179.154 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 2.7 p -128.07 128.53 68.94 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 177.046 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -118.09 102.94 13.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.48 -178.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 764' ' ' THR . . . . . 0.491 ' HB ' HG22 ' A' ' 782' ' ' VAL . 91.0 m -100.66 124.45 46.27 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.798 -0.637 . . . . 0.0 112.022 -174.693 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 765' ' ' PHE . . . . . 0.556 ' HA ' ' O ' ' A' ' 783' ' ' HIS . 34.5 m-85 -79.79 78.49 6.37 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.539 173.345 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 766' ' ' CYS . . . . . 0.44 ' HB2' HG21 ' A' ' 782' ' ' VAL . 0.0 OUTLIER -106.93 133.24 51.88 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.327 -172.195 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 767' ' ' ARG . . . . . 0.859 HH21 ' HG2' ' A' ' 751' ' ' GLU . 0.0 OUTLIER -111.0 -24.62 10.25 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 174.06 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -103.41 -71.33 0.73 Allowed 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.084 175.584 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . 0.668 ' HB2' HG22 ' A' ' 772' ' ' ILE . 0.0 OUTLIER 66.6 129.0 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 122.112 0.958 . . . . 0.0 112.377 179.735 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 6.4 mt -128.66 -79.96 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.021 -0.991 . . . . 0.0 109.681 176.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -82.69 -21.2 60.19 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.932 -0.651 . . . . 0.0 111.846 177.327 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 772' ' ' ILE . . . . . 0.668 HG22 ' HB2' ' A' ' 769' ' ' HIS . 0.3 OUTLIER -67.45 141.91 95.99 Favored Pre-proline 0 C--O 1.237 0.405 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 176.395 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 773' ' ' PRO . . . . . 0.412 ' HB2' ' H ' ' A' ' 774' ' ' LEU . 87.8 Cg_endo -91.05 -143.41 0.02 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.098 0 C-N-CA 123.156 2.57 . . . . 0.0 113.22 -174.04 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . 0.49 ' HA ' ' HB ' ' A' ' 782' ' ' VAL . 0.4 OUTLIER -176.24 -172.26 0.47 Allowed 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 -177.729 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 775' ' ' GLU . . . . . 0.54 ' HA ' ' O ' ' A' ' 780' ' ' GLU . 0.6 OUTLIER -65.81 52.73 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 113.021 0.748 . . . . 0.0 113.021 175.745 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.3 -21.55 23.11 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 169.624 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -133.03 157.68 77.75 Favored Pre-proline 0 N--CA 1.449 -0.482 0 CA-C-N 114.382 -1.281 . . . . 0.0 108.443 174.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -68.58 -4.3 12.81 Favored 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 122.552 2.168 . . . . 0.0 114.089 -173.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . -112.58 -4.0 25.16 Favored Glycine 0 N--CA 1.453 -0.167 0 C-N-CA 120.575 -0.821 . . . . 0.0 112.358 -176.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 780' ' ' GLU . . . . . 0.54 ' O ' ' HA ' ' A' ' 775' ' ' GLU . 6.7 mt-10 -118.86 125.45 49.55 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 -179.167 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 781' ' ' TRP . . . . . 0.448 ' CZ3' HD13 ' A' ' 794' ' ' LEU . 15.2 m95 -130.25 147.16 51.94 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 -177.717 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . 0.491 HG22 ' HB ' ' A' ' 764' ' ' THR . 0.4 OUTLIER -142.69 145.94 22.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-O 120.848 0.356 . . . . 0.0 110.5 179.46 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 783' ' ' HIS . . . . . 0.556 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 2.1 t-160 -157.5 135.96 11.24 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.975 178.278 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -98.21 100.85 12.18 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.404 175.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 785' ' ' VAL . . . . . 0.477 ' HB ' ' HD3' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -163.21 -172.9 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 179.937 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 786' ' ' ALA . . . . . 0.504 ' HA ' HD11 ' A' ' 718' ' ' LEU . . . -117.66 39.28 3.37 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.639 177.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 787' ' ' ALA . . . . . 0.421 ' N ' ' HD3' ' A' ' 788' ' ' PRO . . . 57.87 61.94 5.46 Favored Pre-proline 0 N--CA 1.463 0.213 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.632 -179.186 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 788' ' ' PRO . . . . . 0.477 ' HD3' ' HB ' ' A' ' 785' ' ' VAL . 19.3 Cg_exo -66.93 -65.51 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.433 2.089 . . . . 0.0 111.979 -177.448 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -171.63 -16.61 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 178.17 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 790' ' ' GLU . . . . . . . . . . . . . 6.3 pm0 -76.15 -35.46 59.19 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 121.006 -0.278 . . . . 0.0 111.407 -173.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 791' ' ' LEU . . . . . 0.472 ' N ' ' HD2' ' A' ' 792' ' ' PRO . 0.2 OUTLIER -73.31 -50.18 6.47 Favored Pre-proline 0 CA--C 1.533 0.308 0 CA-C-O 119.489 -0.291 . . . . 0.0 111.77 -179.128 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 792' ' ' PRO . . . . . 0.472 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 11.0 Cg_endo -57.37 -32.87 95.12 Favored 'Trans proline' 0 C--N 1.357 1.024 0 C-N-CA 121.7 1.6 . . . . 0.0 112.212 175.216 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -70.93 -44.27 66.5 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.952 0.406 . . . . 0.0 110.678 177.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 794' ' ' LEU . . . . . 0.448 HD13 ' CZ3' ' A' ' 781' ' ' TRP . 1.5 tm? -61.9 -40.47 95.56 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.506 178.452 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 795' ' ' LEU . . . . . 0.551 HD22 HG23 ' A' ' 746' ' ' VAL . 0.0 OUTLIER -65.13 -34.7 79.01 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.119 -179.453 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 796' ' ' ALA . . . . . 0.582 ' HA ' HD23 ' A' ' 704' ' ' LEU . . . -61.4 -41.73 97.6 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.255 0.55 . . . . 0.0 110.021 176.769 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 2.7 ttt-85 -71.28 -32.37 68.59 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.734 178.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 798' ' ' ILE . . . . . 0.472 HG23 HD11 ' A' ' 798' ' ' ILE . 2.8 mt -66.22 -45.75 89.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.826 179.628 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -75.17 -43.55 51.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.149 -176.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 4.9 mt 50.47 61.82 3.01 Favored 'General case' 0 C--O 1.236 0.366 0 O-C-N 123.644 0.59 . . . . 0.0 111.534 179.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 801' ' ' ILE . . . . . 0.876 ' HB ' ' HA ' ' A' ' 704' ' ' LEU . 1.6 mt -96.32 108.08 20.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.907 177.726 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 802' ' ' GLU . . . . . 0.598 ' HB3' ' HB ' ' A' ' 701' ' ' VAL . 0.2 OUTLIER -85.86 -10.78 54.8 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.972 -178.183 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 803' ' ' MET . . . . . 0.43 ' HE2' ' O ' ' A' ' 705' ' ' SER . 27.4 ttp -72.71 116.23 12.94 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.948 -1.024 . . . . 0.0 109.403 175.302 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 804' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -100.48 163.54 12.32 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.522 -177.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -95.36 -179.93 4.95 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.159 0.504 . . . . 0.0 111.497 -177.798 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -106.4 143.96 33.77 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 169.779 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 807' ' ' ASP . . . . . 0.408 ' HA ' ' HD3' ' A' ' 808' ' ' PRO . 31.5 t70 -105.45 109.44 63.2 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-O 120.992 0.425 . . . . 0.0 111.514 -175.14 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 808' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 807' ' ' ASP . 2.8 Cg_exo -77.46 120.7 5.33 Favored 'Trans proline' 0 C--O 1.235 0.348 0 C-N-CA 123.258 2.639 . . . . 0.0 112.001 176.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -104.4 149.65 25.22 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.47 179.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -162.15 133.25 5.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.653 0.263 . . . . 0.0 110.781 -178.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -142.58 151.96 42.07 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.964 177.475 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -143.0 97.42 5.78 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 120.761 0.315 . . . . 0.0 111.513 -176.662 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -90.0 115.0 0.56 Allowed 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 122.866 2.378 . . . . 0.0 111.851 174.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -133.68 137.09 45.14 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.189 -176.823 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -134.03 162.51 31.88 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.046 -179.097 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -131.5 156.71 45.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.751 0.31 . . . . 0.0 110.709 179.066 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -135.49 145.88 47.58 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.613 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -129.17 145.85 51.22 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.946 -179.292 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 4.0 p -155.09 136.87 5.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.151 -179.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -141.09 155.45 46.13 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.764 0.316 . . . . 0.0 110.416 177.752 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -149.18 -176.15 5.25 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.279 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -154.49 -89.73 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.543 -0.298 . . . . 0.0 110.664 -178.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 14.6 t70 54.87 77.31 0.21 Allowed 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.394 0.616 . . . . 0.0 110.293 -176.011 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -147.43 82.18 1.53 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.884 -178.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -107.6 135.34 49.22 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.404 175.292 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 826' ' ' MET . . . . . 0.642 ' HG3' ' HA ' ' A' ' 869' ' ' ILE . 0.4 OUTLIER -115.76 124.11 49.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.277 0.56 . . . . 0.0 111.587 -173.684 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 827' ' ' ILE . . . . . . . . . . . . . 3.1 mm -117.34 138.77 46.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.086 178.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 828' ' ' LEU . . . . . 0.759 HD11 HD11 ' A' ' 869' ' ' ILE . 0.5 OUTLIER -105.21 122.39 45.82 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.727 0.299 . . . . 0.0 110.728 179.309 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -104.31 100.82 11.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.993 176.19 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 830' ' ' VAL . . . . . . . . . . . . . 5.1 t -109.04 112.2 39.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.304 -179.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 831' ' ' ASP . . . . . 0.747 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 11.5 t0 -121.58 142.94 49.61 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 178.778 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 832' ' ' ASP . . . . . 0.431 ' HB3' HG13 ' A' ' 876' ' ' VAL . 0.0 OUTLIER -78.75 -21.01 48.6 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.699 -178.765 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 15.7 m80 -114.31 109.85 48.49 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.132 177.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -51.13 -38.57 60.69 Favored 'Trans proline' 0 CA--C 1.531 0.368 0 C-N-CA 123.766 2.978 . . . . 0.0 114.668 -173.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 835' ' ' ILE . . . . . 0.438 HG23 ' N ' ' A' ' 836' ' ' ASN . 0.0 OUTLIER -64.19 -38.99 83.92 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-O 121.223 0.535 . . . . 0.0 110.678 -179.275 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 836' ' ' ASN . . . . . 0.61 ' ND2' ' HZ2' ' A' ' 925' ' ' LYS . 4.7 t30 -73.57 -37.83 65.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.613 178.41 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 837' ' ' ARG . . . . . 0.747 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 16.2 ttp180 -55.83 -44.34 77.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.448 176.579 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 7.1 ttm180 -59.18 -41.78 89.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.789 178.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 1.7 tp -58.88 -52.6 65.02 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.744 -179.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 840' ' ' LEU . . . . . 0.633 HD13 ' HA ' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -72.99 -30.44 63.8 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 120.79 -0.364 . . . . 0.0 111.597 -177.476 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -66.44 -37.55 85.43 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.097 0.475 . . . . 0.0 110.702 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -67.9 -41.04 83.33 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.301 178.042 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 843' ' ' GLN . . . . . 0.659 ' HG3' HD22 ' A' ' 929' ' ' LEU . 0.5 OUTLIER -62.74 -50.8 69.63 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.679 178.459 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 844' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.48 -35.78 74.75 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.993 178.038 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -62.97 -35.01 91.49 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.058 177.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 4.2 m -76.64 -26.81 55.3 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.873 0.368 . . . . 0.0 110.521 178.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 847' ' ' LEU . . . . . 0.653 HD22 ' HG2' ' A' ' 933' ' ' LYS . 3.6 mp -63.13 -33.68 75.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.013 177.503 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 97.59 26.91 9.49 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.692 -0.765 . . . . 0.0 112.918 176.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 849' ' ' TYR . . . . . 0.411 ' HE2' HD21 ' A' ' 847' ' ' LEU . 38.9 m-85 -112.09 155.77 23.32 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 176.863 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -69.08 118.0 11.43 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 178.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -107.3 126.19 52.12 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.16 0.505 . . . . 0.0 111.399 -173.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -111.0 140.44 45.53 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 171.633 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -118.31 144.05 46.14 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 120.559 -0.456 . . . . 0.0 111.643 -174.013 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 854' ' ' ALA . . . . . . . . . . . . . . . -149.21 150.55 32.8 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.157 178.024 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 855' ' ' ASN . . . . . 0.544 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 13.6 t-20 -133.84 74.97 1.57 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.399 175.572 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 856' ' ' ASP . . . . . 0.631 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 4.1 t70 165.53 170.44 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.118 -0.946 . . . . 0.0 108.836 -178.302 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -92.73 -47.29 3.22 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.865 -0.683 . . . . 0.0 111.922 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -71.67 -31.1 40.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.984 0.421 . . . . 0.0 110.661 -178.955 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 859' ' ' ASP . . . . . 0.631 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 0.3 OUTLIER -64.23 -35.4 80.68 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.007 -179.53 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 860' ' ' ALA . . . . . 0.418 ' O ' HG22 ' A' ' 863' ' ' VAL . . . -68.34 -33.64 74.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.181 0.515 . . . . 0.0 110.49 178.65 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 861' ' ' LEU . . . . . . . . . . . . . 15.3 tp -73.59 -32.37 64.07 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.596 179.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 -62.82 -47.12 84.8 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.816 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 863' ' ' VAL . . . . . 0.418 HG22 ' O ' ' A' ' 860' ' ' ALA . 0.3 OUTLIER -68.81 -31.27 50.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 C-N-CA 120.861 -0.336 . . . . 0.0 110.61 177.915 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 864' ' ' LEU . . . . . 0.413 HD21 ' HA ' ' A' ' 864' ' ' LEU . 1.0 OUTLIER -60.84 -34.84 75.19 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 120.704 0.288 . . . . 0.0 111.138 179.118 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.89 -33.41 34.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.929 0.395 . . . . 0.0 110.482 179.426 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.14 -46.15 78.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.525 179.613 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -144.39 129.33 18.45 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 176.855 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 10.0 t-80 -70.7 88.36 0.71 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.8 0.333 . . . . 0.0 111.291 -177.335 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 869' ' ' ILE . . . . . 0.759 HD11 HD11 ' A' ' 828' ' ' LEU . 1.4 mp -65.43 139.91 20.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.524 174.101 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 35.6 m-20 -73.91 -60.34 2.3 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.066 -172.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 871' ' ' ILE . . . . . 0.562 HD11 ' HB3' ' A' ' 939' ' ' TYR . 8.0 mm -117.43 128.61 74.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.223 -178.482 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 872' ' ' VAL . . . . . 0.48 HG21 HD12 ' A' ' 828' ' ' LEU . 48.1 t -115.33 125.72 72.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.34 179.324 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 873' ' ' LEU . . . . . 0.537 HD21 HD13 ' A' ' 936' ' ' LEU . 0.1 OUTLIER -109.13 121.73 45.77 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 178.956 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -106.78 96.49 6.48 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.033 178.202 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 875' ' ' ASP . . . . . 0.552 ' HA ' HG11 ' A' ' 902' ' ' VAL . 22.1 t0 -97.89 110.29 22.89 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.719 179.388 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 876' ' ' VAL . . . . . 0.431 HG13 ' HB3' ' A' ' 832' ' ' ASP . 0.0 OUTLIER -121.89 132.1 71.64 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.41 -173.591 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -99.52 12.2 37.09 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.773 0.797 . . . . 0.0 108.879 171.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 878' ' ' MET . . . . . 0.481 ' HA ' ' HD3' ' A' ' 879' ' ' PRO . 6.0 ttm -68.51 137.68 91.0 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 114.68 -1.146 . . . . 0.0 110.27 179.228 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 879' ' ' PRO . . . . . 0.481 ' HD3' ' HA ' ' A' ' 878' ' ' MET . 10.2 Cg_exo -73.07 -140.35 0.02 OUTLIER 'Trans proline' 0 CA--C 1.534 0.525 0 C-N-CA 122.85 2.367 . . . . 0.0 112.822 178.405 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -85.17 159.01 20.22 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.521 -173.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 881' ' ' MET . . . . . 0.453 ' HA ' ' HE1' ' A' ' 881' ' ' MET . 3.3 tpt 83.98 -54.58 0.13 Allowed 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.229 1.011 . . . . 0.0 112.702 170.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 14.6 t0 -87.73 137.24 32.51 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.877 0.37 . . . . 0.0 110.952 -175.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . 122.44 -7.78 9.67 Favored Glycine 0 N--CA 1.447 -0.603 0 N-CA-C 111.368 -0.693 . . . . 0.0 111.368 -176.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -84.43 -32.43 24.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.519 0.676 . . . . 0.0 109.425 -178.246 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.55 -32.77 63.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.796 178.019 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 4.1 tp -67.06 -51.52 53.56 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.753 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -45.26 92.79 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.213 -178.557 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 888' ' ' GLN . . . . . 0.547 ' HA ' ' HD3' ' A' ' 891' ' ' ARG . 7.7 tp-100 -56.98 -42.6 80.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.164 0.506 . . . . 0.0 110.737 178.609 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.97 -38.65 66.62 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.077 -178.613 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 890' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -69.98 -37.13 71.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.726 0.298 . . . . 0.0 111.203 -176.682 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 891' ' ' ARG . . . . . 0.547 ' HD3' ' HA ' ' A' ' 888' ' ' GLN . 1.9 ptm180 -74.15 -28.7 61.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.824 0.345 . . . . 0.0 110.613 178.005 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -78.07 -27.99 48.74 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.075 0.464 . . . . 0.0 110.752 178.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -80.59 -11.34 59.66 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.239 179.448 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 86.28 56.93 2.19 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.294 178.271 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 895' ' ' LEU . . . . . 0.503 HD22 ' HA ' ' A' ' 891' ' ' ARG . 0.2 OUTLIER -57.72 135.16 56.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.111 0.481 . . . . 0.0 110.577 178.471 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -141.01 49.47 1.66 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.305 0.574 . . . . 0.0 110.637 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 897' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -157.79 151.73 19.74 Favored Pre-proline 0 C--N 1.32 -0.698 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.704 -177.274 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_exo -73.18 112.93 3.64 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 122.454 2.103 . . . . 0.0 111.496 177.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 899' ' ' VAL . . . . . 0.546 HG13 ' HA ' ' A' ' 919' ' ' MET . 0.2 OUTLIER -115.41 130.79 69.4 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 CA-C-O 121.5 0.667 . . . . 0.0 110.126 176.746 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 900' ' ' ILE . . . . . 0.42 HD12 HD22 ' A' ' 873' ' ' LEU . 21.2 mt -96.34 117.0 39.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.719 -176.145 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 901' ' ' GLY . . . . . 0.552 ' HA3' ' HD3' ' A' ' 913' ' ' ARG . . . -92.7 105.82 3.34 Favored Glycine 0 N--CA 1.444 -0.811 0 C-N-CA 120.621 -0.799 . . . . 0.0 111.989 177.785 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 902' ' ' VAL . . . . . 0.871 ' HB ' HD11 ' A' ' 923' ' ' LEU . 0.1 OUTLIER -113.83 126.18 71.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 177.49 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 903' ' ' THR . . . . . 0.424 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.4 OUTLIER -143.87 165.23 28.3 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.679 -0.237 . . . . 0.0 110.398 -175.026 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -119.44 103.12 9.17 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.968 0.414 . . . . 0.0 111.722 -178.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 52.22 56.23 8.03 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.064 -0.971 . . . . 0.0 112.856 171.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 906' ' ' ALA . . . . . 0.492 ' HB1' ' HB3' ' A' ' 909' ' ' GLU . . . -95.75 46.91 1.1 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.073 0.463 . . . . 0.0 110.123 174.676 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 907' ' ' LEU . . . . . 0.487 ' HB3' ' H ' ' A' ' 908' ' ' ALA . 0.1 OUTLIER 64.94 -108.71 0.18 Allowed 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.115 -178.998 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 908' ' ' ALA . . . . . 0.487 ' H ' ' HB3' ' A' ' 907' ' ' LEU . . . -98.53 33.56 2.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.96 0.409 . . . . 0.0 110.682 -177.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 909' ' ' GLU . . . . . 0.492 ' HB3' ' HB1' ' A' ' 906' ' ' ALA . 0.0 OUTLIER -52.1 -47.15 65.39 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.42 -0.809 . . . . 0.0 112.314 -176.625 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 910' ' ' GLU . . . . . 0.675 ' HA ' ' NH1' ' A' ' 913' ' ' ARG . 1.5 pt-20 -64.82 -37.46 87.68 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.978 -176.668 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.39 -42.34 71.84 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.872 0.368 . . . . 0.0 110.269 178.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -61.81 -40.59 95.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.706 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 913' ' ' ARG . . . . . 0.837 ' HD2' ' HB2' ' A' ' 922' ' ' CYS . 3.0 mtm105 -59.81 -45.54 92.03 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.756 178.128 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 80.7 m -64.73 -44.9 88.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.6 178.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 915' ' ' LEU . . . . . 0.4 HD21 ' HA ' ' A' ' 915' ' ' LEU . 0.1 OUTLIER -59.83 -43.51 94.54 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.308 -179.535 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.52 -43.21 81.37 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.569 179.536 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 51.67 33.84 11.67 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.139 -175.687 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -106.08 24.66 25.92 Favored Glycine 0 N--CA 1.447 -0.568 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.715 178.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 919' ' ' MET . . . . . 0.546 ' HA ' HG13 ' A' ' 899' ' ' VAL . 2.1 mtt -132.2 -94.89 0.35 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 110.328 -0.249 . . . . 0.0 110.328 -177.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 920' ' ' ASP . . . . . 0.455 ' H ' ' HB3' ' A' ' 919' ' ' MET . 9.6 t70 166.36 -64.77 0.0 OUTLIER 'General case' 0 CA--C 1.518 -0.279 0 O-C-N 124.205 0.941 . . . . 0.0 109.175 175.433 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -115.08 165.81 12.5 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.799 -177.459 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 922' ' ' CYS . . . . . 0.837 ' HB2' ' HD2' ' A' ' 913' ' ' ARG . 0.0 OUTLIER -147.37 135.12 21.11 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.332 -179.683 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 923' ' ' LEU . . . . . 0.871 HD11 ' HB ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -155.98 -175.8 5.62 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 178.37 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 924' ' ' SER . . . . . 0.687 ' HB2' ' HD2' ' A' ' 926' ' ' PRO . 0.0 OUTLIER -106.29 154.68 20.41 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.916 -178.839 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 925' ' ' LYS . . . . . 0.61 ' HZ2' ' ND2' ' A' ' 836' ' ' ASN . 8.4 tttp -52.92 -43.33 93.86 Favored Pre-proline 0 N--CA 1.47 0.531 0 N-CA-C 112.762 0.652 . . . . 0.0 112.762 179.4 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 926' ' ' PRO . . . . . 0.687 ' HD2' ' HB2' ' A' ' 924' ' ' SER . 23.2 Cg_exo -66.5 75.33 0.38 Allowed 'Trans proline' 0 C--N 1.357 0.997 0 C-N-CA 121.983 1.788 . . . . 0.0 111.798 172.474 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -107.09 152.98 8.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.188 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -95.06 149.56 21.13 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.913 179.854 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 929' ' ' LEU . . . . . 0.659 HD22 ' HG3' ' A' ' 843' ' ' GLN . 0.5 OUTLIER -55.93 -37.78 69.4 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.652 -179.029 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.92 -27.21 65.55 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.82 -178.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 931' ' ' VAL . . . . . 0.513 ' O ' ' HG2' ' A' ' 934' ' ' GLN . 93.2 t -75.94 -51.34 20.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.863 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 932' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -58.52 -37.06 62.4 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-O 121.056 0.455 . . . . 0.0 109.826 178.403 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 933' ' ' LYS . . . . . 0.653 ' HG2' HD22 ' A' ' 847' ' ' LEU . 0.0 OUTLIER -65.37 -47.43 76.43 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.288 -179.978 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 934' ' ' GLN . . . . . 0.546 ' O ' ' HB2' ' A' ' 938' ' ' LEU . 10.2 pt20 -63.72 -41.96 98.0 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.406 -177.049 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 1.3 m -69.44 -39.33 77.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.612 0.244 . . . . 0.0 110.732 -179.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 936' ' ' LEU . . . . . 0.537 HD13 HD21 ' A' ' 873' ' ' LEU . 0.7 OUTLIER -63.89 -54.8 29.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.618 179.595 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 74.6 m -60.6 -41.86 95.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.575 -179.076 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 938' ' ' LEU . . . . . 0.546 ' HB2' ' O ' ' A' ' 934' ' ' GLN . 0.1 OUTLIER -68.01 -40.16 83.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.732 0.301 . . . . 0.0 111.416 -178.156 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 939' ' ' TYR . . . . . 0.562 ' HB3' HD11 ' A' ' 871' ' ' ILE . 1.6 m-85 -77.19 -27.21 53.5 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.93 -0.308 . . . . 0.0 111.101 -178.087 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -64.28 -43.61 94.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.007 0.432 . . . . 0.0 110.254 174.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 941' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -73.73 -21.99 60.04 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.333 177.575 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 942' ' ' ARG . . . . . 0.56 ' HB3' ' HA ' ' A' ' 939' ' ' TYR . 0.0 OUTLIER -67.57 -47.55 69.46 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.266 177.234 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 10.1 m -74.11 -33.07 34.45 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 CA-C-O 120.946 0.403 . . . . 0.0 110.155 178.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 19.1 ttt85 -58.56 -48.1 82.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.517 176.472 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.03 -19.33 60.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.199 -179.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 71.4 m -71.9 -21.95 61.56 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.09 0.472 . . . . 0.0 109.903 175.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.63 -30.21 14.45 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.311 174.489 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -78.78 -46.09 19.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.027 -175.787 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.006 0 CA-C-O 118.289 -0.863 . . . . 0.0 110.448 -176.26 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 4.3 ttp . . . . . 0 N--CA 1.479 1.024 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 110.6 34.09 2.33 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.507 -0.854 . . . . 0.0 111.671 179.119 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . -138.27 129.16 4.45 Favored Glycine 0 N--CA 1.445 -0.758 0 N-CA-C 111.408 -0.677 . . . . 0.0 111.408 178.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -142.03 105.89 4.72 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.848 0.356 . . . . 0.0 110.298 -179.61 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . -80.93 68.28 3.44 Favored Glycine 0 N--CA 1.448 -0.516 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.618 -179.203 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -87.67 87.46 2.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 120.872 0.367 . . . . 0.0 110.037 177.469 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -124.08 134.7 53.33 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.635 -179.4 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . 138.1 -54.81 0.69 Allowed Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 121.051 -0.595 . . . . 0.0 112.107 178.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 8.3 mt -125.76 -158.91 0.87 Allowed 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 705' ' ' SER . . . . . 0.545 ' HA ' ' O ' ' A' ' 730' ' ' GLY . 1.5 m 55.25 72.88 0.45 Allowed 'General case' 0 CA--C 1.531 0.234 0 O-C-N 123.722 0.639 . . . . 0.0 111.495 177.746 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 170.49 -23.98 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.345 -0.931 . . . . 0.0 112.597 -178.05 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 707' ' ' LYS . . . . . 0.417 ' O ' HG22 ' A' ' 732' ' ' VAL . 1.4 mptt -75.16 135.75 41.08 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 -179.778 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 708' ' ' ARG . . . . . 0.848 ' HG2' HG23 ' A' ' 732' ' ' VAL . 0.0 OUTLIER -100.24 155.13 17.94 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.054 0.454 . . . . 0.0 111.612 -174.445 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -136.47 127.17 27.21 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.812 176.698 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 710' ' ' TRP . . . . . 0.646 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 90.2 m95 -107.07 117.45 34.09 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 177.113 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 711' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -120.27 123.02 42.17 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.233 0.54 . . . . 0.0 111.191 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -121.27 68.92 0.9 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.368 176.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 713' ' ' VAL . . . . . 0.552 ' HB ' ' HB3' ' A' ' 719' ' ' CYS . 55.3 t -117.84 127.98 75.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.182 -178.216 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 714' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' A' ' 714' ' ' ARG . 3.3 mtt85 -73.53 -35.45 65.56 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.942 0.401 . . . . 0.0 110.667 178.757 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 41.2 t-20 -63.36 112.53 2.76 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.375 177.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 716' ' ' ALA . . . . . 0.643 ' O ' ' HB2' ' A' ' 720' ' ' GLN . . . -66.71 -38.1 86.04 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.328 -175.006 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.83 -38.28 83.02 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.935 0.398 . . . . 0.0 110.092 178.662 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 718' ' ' LEU . . . . . 0.655 HD12 ' HA ' ' A' ' 786' ' ' ALA . 0.9 OUTLIER -67.95 -50.22 57.14 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.663 179.908 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 719' ' ' CYS . . . . . 0.552 ' HB3' ' HB ' ' A' ' 713' ' ' VAL . 21.8 p -67.35 -38.46 84.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.65 -177.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 720' ' ' GLN . . . . . 0.684 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -63.96 -39.14 93.46 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.176 177.574 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -57.3 -55.17 38.23 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.704 -179.588 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 722' ' ' LEU . . . . . 0.412 HD12 HG23 ' A' ' 748' ' ' ILE . 0.7 OUTLIER -63.87 -48.35 77.04 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.952 -179.42 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 723' ' ' GLU . . . . . 0.684 ' HG2' ' HA ' ' A' ' 720' ' ' GLN . 2.9 pt-20 -60.39 -43.41 96.68 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.67 -174.154 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 724' ' ' THR . . . . . 0.538 ' N ' ' HG3' ' A' ' 723' ' ' GLU . 14.6 m -71.8 -38.55 70.23 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.841 0.353 . . . . 0.0 111.166 -177.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 725' ' ' SER . . . . . 0.416 ' O ' ' HG2' ' A' ' 728' ' ' ARG . 37.5 m -69.03 -36.42 77.73 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.877 0.37 . . . . 0.0 111.299 -179.083 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 726' ' ' LEU . . . . . 0.462 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 11.1 mt -82.06 -42.86 18.66 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.869 -176.655 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 727' ' ' GLN . . . . . 0.509 ' HB3' HG22 ' A' ' 733' ' ' VAL . 8.5 pt20 -62.43 -29.76 70.74 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.57 0.224 . . . . 0.0 111.392 -176.387 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 728' ' ' ARG . . . . . 0.416 ' HG2' ' O ' ' A' ' 725' ' ' SER . 11.7 ptt180 -69.51 -17.83 63.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.956 0.408 . . . . 0.0 111.128 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 1.4 m -99.35 -1.82 37.87 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.094 -178.123 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 730' ' ' GLY . . . . . 0.545 ' O ' ' HA ' ' A' ' 705' ' ' SER . . . 100.31 14.68 32.34 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.35 -0.929 . . . . 0.0 112.578 179.237 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 731' ' ' ILE . . . . . 0.462 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 32.0 mm -90.57 129.07 41.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 176.438 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 732' ' ' VAL . . . . . 0.848 HG23 ' HG2' ' A' ' 708' ' ' ARG . 0.2 OUTLIER -85.78 94.33 4.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 121.981 0.896 . . . . 0.0 110.428 -178.784 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 733' ' ' VAL . . . . . 0.509 HG22 ' HB3' ' A' ' 727' ' ' GLN . 0.1 OUTLIER -83.22 122.8 38.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 114.595 -1.184 . . . . 0.0 111.08 -177.398 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.66 147.91 52.39 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.717 -179.66 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 3.9 m -77.46 119.27 20.82 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.032 0.444 . . . . 0.0 110.766 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 736' ' ' TYR . . . . . 0.646 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 86.0 t80 -81.84 114.58 20.55 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.616 -178.551 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -109.33 -42.59 4.33 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.075 177.313 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 176.97 47.76 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.432 0 N-CA-C 111.208 -0.757 . . . . 0.0 111.208 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 13.3 mp0 -91.79 -176.31 4.42 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.528 -0.336 . . . . 0.0 110.863 -174.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 740' ' ' GLU . . . . . 0.498 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 0.0 OUTLIER -97.78 131.77 26.21 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.455 179.897 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 741' ' ' PRO . . . . . 0.64 ' HG2' ' HB2' ' A' ' 758' ' ' GLN . 6.5 Cg_endo -87.25 127.54 2.49 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 123.348 2.699 . . . . 0.0 113.313 -175.519 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 742' ' ' THR . . . . . 0.588 ' CG2' ' HD2' ' A' ' 743' ' ' PRO . 0.2 OUTLIER -90.92 148.59 38.5 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 172.392 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 743' ' ' PRO . . . . . 0.588 ' HD2' ' CG2' ' A' ' 742' ' ' THR . 23.8 Cg_endo -61.77 5.01 0.23 Allowed 'Trans proline' 0 N--CA 1.48 0.687 0 C-N-CA 123.208 2.605 . . . . 0.0 113.931 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -118.03 -2.57 11.23 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.772 0.32 . . . . 0.0 110.424 175.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 745' ' ' ASP . . . . . 0.432 ' HB3' ' HD1' ' A' ' 710' ' ' TRP . 87.1 m-20 -89.38 149.09 23.15 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.746 -176.149 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 746' ' ' VAL . . . . . 0.465 ' HA ' ' O ' ' A' ' 761' ' ' ALA . 2.8 p -120.51 137.25 54.92 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.3 178.458 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 747' ' ' LEU . . . . . 0.472 ' HA ' HD23 ' A' ' 747' ' ' LEU . 0.0 OUTLIER -106.01 100.01 9.57 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.874 0.369 . . . . 0.0 110.903 -179.748 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 748' ' ' ILE . . . . . 0.412 HG23 HD12 ' A' ' 722' ' ' LEU . 12.0 mt -93.78 106.83 18.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 173.783 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 6.0 t -128.98 160.38 32.9 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 110.113 -0.328 . . . . 0.0 110.113 -177.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 750' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -105.51 145.86 30.34 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.02 0.438 . . . . 0.0 111.171 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 751' ' ' GLU . . . . . 0.492 ' HA ' ' HA ' ' A' ' 766' ' ' CYS . 22.5 mm-40 63.91 -157.06 0.31 Allowed 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.366 -178.656 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 752' ' ' VAL . . . . . 0.519 HG22 ' H ' ' A' ' 771' ' ' GLY . 62.1 t -75.68 127.16 37.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 120.992 0.425 . . . . 0.0 111.287 -176.295 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 753' ' ' VAL . . . . . 0.415 HG11 HD12 ' A' ' 772' ' ' ILE . 8.6 p -102.12 142.74 15.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.823 175.437 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -94.37 39.84 1.09 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.906 0.384 . . . . 0.0 111.236 -178.266 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.02 148.24 18.67 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.223 178.684 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 6.4 mmtm -97.2 10.51 39.26 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.826 179.092 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 757' ' ' TRP . . . . . 0.592 ' CH2' ' HB3' ' A' ' 741' ' ' PRO . 4.5 t-105 69.61 153.96 0.11 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.419 -0.81 . . . . 0.0 112.123 177.255 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 758' ' ' GLN . . . . . 0.64 ' HB2' ' HG2' ' A' ' 741' ' ' PRO . 4.9 mp0 -135.22 47.96 2.29 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.797 178.249 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 759' ' ' GLY . . . . . 0.53 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -146.1 -140.86 3.54 Favored Glycine 0 N--CA 1.443 -0.87 0 C-N-CA 120.409 -0.901 . . . . 0.0 113.1 -175.481 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -74.31 -59.97 2.48 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 111.597 0.221 . . . . 0.0 111.597 -178.226 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 761' ' ' ALA . . . . . 0.465 ' O ' ' HA ' ' A' ' 746' ' ' VAL . . . -156.99 157.85 35.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.738 -176.235 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 3.2 p -126.59 131.81 70.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.139 177.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 92.2 t -111.37 96.66 4.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 178.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 764' ' ' THR . . . . . 0.671 HG22 HG13 ' A' ' 772' ' ' ILE . 0.2 OUTLIER -86.39 92.67 8.9 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.083 -178.593 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 765' ' ' PHE . . . . . 0.728 ' CZ ' ' HG ' ' A' ' 791' ' ' LEU . 0.2 OUTLIER -84.23 83.63 7.9 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.207 179.085 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 766' ' ' CYS . . . . . 0.52 ' HB2' HG12 ' A' ' 770' ' ' ILE . 0.0 OUTLIER -94.54 132.85 38.8 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 -175.049 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 5.1 mmm-85 -88.86 -56.15 3.41 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.913 -171.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.28 -34.16 2.96 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.271 -176.33 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -108.75 106.59 16.68 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.291 0.567 . . . . 0.0 110.402 -179.425 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 770' ' ' ILE . . . . . 0.52 HG12 ' HB2' ' A' ' 766' ' ' CYS . 24.2 mt -107.26 87.39 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.467 178.377 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 771' ' ' GLY . . . . . 0.519 ' H ' HG22 ' A' ' 752' ' ' VAL . . . -95.28 6.71 68.78 Favored Glycine 0 N--CA 1.454 -0.156 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.693 177.873 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 772' ' ' ILE . . . . . 0.79 HG22 ' HD2' ' A' ' 773' ' ' PRO . 41.9 mm -104.06 141.79 23.26 Favored Pre-proline 0 C--N 1.32 -0.686 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 178.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 773' ' ' PRO . . . . . 0.79 ' HD2' HG22 ' A' ' 772' ' ' ILE . 50.7 Cg_exo -53.39 -96.83 0.0 OUTLIER 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 123.135 2.557 . . . . 0.0 113.37 178.657 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . 0.674 ' HB3' ' O ' ' A' ' 773' ' ' PRO . 0.3 OUTLIER 153.05 -161.85 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.462 1.105 . . . . 0.0 109.477 -177.365 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 775' ' ' GLU . . . . . 0.501 ' HA ' ' O ' ' A' ' 780' ' ' GLU . 0.8 OUTLIER -62.65 54.05 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.911 0.884 . . . . 0.0 113.335 177.266 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . 0.568 ' HD3' ' HB3' ' A' ' 773' ' ' PRO . 0.1 OUTLIER -118.75 0.41 11.44 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 170.122 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -126.93 150.87 72.96 Favored Pre-proline 0 C--N 1.324 -0.526 0 CA-C-N 114.615 -1.175 . . . . 0.0 109.114 176.123 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_endo -62.14 100.32 0.21 Allowed 'Trans proline' 0 CA--C 1.529 0.232 0 C-N-CA 122.617 2.212 . . . . 0.0 112.626 -178.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 96.48 20.11 25.78 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.832 -0.699 . . . . 0.0 113.004 177.475 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 780' ' ' GLU . . . . . 0.501 ' O ' ' HA ' ' A' ' 775' ' ' GLU . 0.1 OUTLIER -109.59 125.06 52.16 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 179.808 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 35.5 m95 -142.66 106.78 4.73 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.853 -0.158 . . . . 0.0 111.152 -175.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . 0.53 HG21 ' HB3' ' A' ' 774' ' ' LEU . 3.6 m -102.19 156.43 4.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 C-N-CA 120.781 -0.367 . . . . 0.0 110.156 175.19 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 783' ' ' HIS . . . . . 0.418 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.1 OUTLIER -176.36 150.16 0.88 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.61 177.415 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 3.1 m -104.96 100.21 9.82 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.935 0.397 . . . . 0.0 110.533 173.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 785' ' ' VAL . . . . . 0.405 HG23 ' CE1' ' A' ' 765' ' ' PHE . 0.1 OUTLIER -159.45 164.55 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 178.239 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 786' ' ' ALA . . . . . 0.655 ' HA ' HD12 ' A' ' 718' ' ' LEU . . . -103.56 40.36 1.43 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.997 179.094 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 49.39 64.09 9.18 Favored Pre-proline 0 N--CA 1.469 0.487 0 CA-C-N 115.26 -0.882 . . . . 0.0 112.705 177.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 788' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -68.59 -70.37 0.02 OUTLIER 'Trans proline' 0 CA--C 1.533 0.455 0 C-N-CA 122.254 1.969 . . . . 0.0 112.545 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 2.2 p-80 -153.32 -30.82 0.13 Allowed 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -178.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 790' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -71.18 -34.28 70.77 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 111.747 0.277 . . . . 0.0 111.747 -174.258 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 791' ' ' LEU . . . . . 0.728 ' HG ' ' CZ ' ' A' ' 765' ' ' PHE . 0.7 OUTLIER -65.46 -55.62 23.68 Favored Pre-proline 0 C--N 1.327 -0.382 0 C-N-CA 120.986 -0.286 . . . . 0.0 111.272 -178.922 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 792' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -58.55 -26.71 79.79 Favored 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 121.585 1.523 . . . . 0.0 111.871 175.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -68.09 -45.69 73.07 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.892 176.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 794' ' ' LEU . . . . . 0.482 HD21 ' HA ' ' A' ' 794' ' ' LEU . 0.2 OUTLIER -65.63 -36.89 85.0 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 176.797 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 795' ' ' LEU . . . . . 0.463 ' O ' HG21 ' A' ' 798' ' ' ILE . 0.6 OUTLIER -63.04 -44.26 96.36 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.865 179.158 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -63.69 -31.73 72.99 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.148 0.499 . . . . 0.0 110.727 177.053 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.24 -47.18 65.46 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.674 178.69 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 798' ' ' ILE . . . . . 0.463 HG21 ' O ' ' A' ' 795' ' ' LEU . 0.9 OUTLIER -70.1 -16.94 20.58 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.589 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.308 -177.562 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 799' ' ' TYR . . . . . 0.425 ' HD1' ' HA ' ' A' ' 799' ' ' TYR . 2.4 m-30 -78.53 -8.32 58.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.282 175.188 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 34.1 mt 62.17 49.3 4.47 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.532 177.206 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 801' ' ' ILE . . . . . . . . . . . . . 93.6 mt -74.62 -39.49 46.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.236 176.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 50.67 70.01 0.57 Allowed 'General case' 0 C--O 1.234 0.264 0 O-C-N 123.943 0.777 . . . . 0.0 110.892 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 803' ' ' MET . . . . . . . . . . . . . 1.8 ttp -82.42 -37.84 24.92 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.385 -174.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 804' ' ' GLU . . . . . 0.483 ' H ' ' HG3' ' A' ' 804' ' ' GLU . 0.0 OUTLIER -75.44 99.41 4.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.795 0.331 . . . . 0.0 110.862 -177.499 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -97.01 162.75 13.25 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.172 -179.043 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -146.1 91.25 2.05 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.094 177.423 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 807' ' ' ASP . . . . . 0.432 ' HA ' ' HD3' ' A' ' 808' ' ' PRO . 0.7 OUTLIER -60.25 122.21 65.23 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.001 179.346 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 808' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 807' ' ' ASP . 4.7 Cg_exo -77.38 -170.33 0.91 Allowed 'Trans proline' 0 N--CA 1.462 -0.358 0 C-N-CA 123.281 2.654 . . . . 0.0 112.473 -178.269 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -109.73 163.45 13.48 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.915 177.246 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 17.2 t30 -118.69 128.84 54.89 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.156 0.503 . . . . 0.0 111.04 -178.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -141.14 105.77 4.89 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.169 179.206 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 812' ' ' LEU . . . . . 0.439 ' HA ' ' HD3' ' A' ' 813' ' ' PRO . 2.9 tp -88.71 137.56 30.11 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.892 -177.321 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 813' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 812' ' ' LEU . 14.2 Cg_exo -70.07 152.53 67.73 Favored 'Trans proline' 0 N--CA 1.461 -0.428 0 C-N-CA 122.847 2.365 . . . . 0.0 111.96 176.18 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 54.8 m -137.02 138.93 41.0 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 174.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.23 93.97 4.07 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.782 -175.399 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -119.08 120.03 35.95 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.314 -177.039 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 2.0 ttmt -172.57 116.02 0.31 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.952 176.173 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -140.07 146.52 39.05 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.861 0.363 . . . . 0.0 111.516 -178.086 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 2.6 p -175.07 115.5 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.679 -0.692 . . . . 0.0 109.424 176.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 1.2 m -151.09 147.78 27.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.702 0.287 . . . . 0.0 111.513 -175.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 29.1 t70 74.23 137.56 0.06 Allowed 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.07 -0.968 . . . . 0.0 112.716 171.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 822' ' ' ASN . . . . . 0.404 ' O ' ' HB3' ' A' ' 823' ' ' ASP . 21.7 t30 -159.83 -43.05 0.05 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.878 173.555 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 823' ' ' ASP . . . . . 0.404 ' HB3' ' O ' ' A' ' 822' ' ' ASN . 14.4 t0 70.82 111.34 0.06 Allowed 'General case' 0 N--CA 1.467 0.387 0 O-C-N 123.939 0.775 . . . . 0.0 111.061 -179.397 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -112.55 62.49 0.63 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.513 -175.288 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 825' ' ' MET . . . . . 0.507 ' O ' ' HB3' ' A' ' 849' ' ' TYR . 0.5 OUTLIER -92.29 127.76 37.89 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 -178.501 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 826' ' ' MET . . . . . 0.578 ' HG3' ' HA ' ' A' ' 869' ' ' ILE . 5.0 ptp -125.61 131.02 52.76 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.121 0.486 . . . . 0.0 111.383 -176.763 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 827' ' ' ILE . . . . . . . . . . . . . 10.3 mm -120.71 128.91 76.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.075 176.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 828' ' ' LEU . . . . . 0.556 ' HB3' HD13 ' A' ' 869' ' ' ILE . 0.1 OUTLIER -106.36 134.75 49.01 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.259 0.552 . . . . 0.0 110.768 -178.063 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -112.33 111.73 37.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.509 -177.373 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 830' ' ' VAL . . . . . 0.612 ' HA ' ' O ' ' A' ' 854' ' ' ALA . 48.7 t -112.17 100.59 11.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.316 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 831' ' ' ASP . . . . . 0.747 ' HB2' ' HB3' ' A' ' 875' ' ' ASP . 0.1 OUTLIER -121.26 137.55 54.64 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.935 0.398 . . . . 0.0 110.505 -178.27 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 832' ' ' ASP . . . . . 0.46 ' O ' ' HD3' ' A' ' 834' ' ' PRO . 7.2 t70 -74.24 -37.7 63.73 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.854 -176.181 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -108.49 93.1 11.04 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.28 -174.531 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 834' ' ' PRO . . . . . 0.46 ' HD3' ' O ' ' A' ' 832' ' ' ASP . 98.1 Cg_exo -45.62 -25.34 2.33 Favored 'Trans proline' 0 N--CA 1.482 0.849 0 C-N-CA 125.14 3.893 . . . . 0.0 116.374 -164.0 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 1.2 pp -58.25 -40.49 77.87 Favored 'Isoleucine or valine' 0 C--O 1.239 0.524 0 CA-C-O 121.242 0.544 . . . . 0.0 110.758 179.524 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 836' ' ' ASN . . . . . 0.528 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 2.2 t30 -74.53 -39.82 62.12 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.903 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 837' ' ' ARG . . . . . 0.734 ' HA ' HD13 ' A' ' 840' ' ' LEU . 6.7 ttp-105 -53.43 -39.96 64.8 Favored 'General case' 0 CA--C 1.518 -0.281 0 O-C-N 123.338 0.399 . . . . 0.0 110.542 175.856 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 838' ' ' ARG . . . . . 0.443 ' HG3' ' N ' ' A' ' 839' ' ' LEU . 0.0 OUTLIER -59.39 -44.0 92.84 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 176.297 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 839' ' ' LEU . . . . . 0.443 ' N ' ' HG3' ' A' ' 838' ' ' ARG . 0.7 OUTLIER -69.04 -45.22 70.98 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.971 -0.559 . . . . 0.0 112.098 -175.279 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 840' ' ' LEU . . . . . 0.734 HD13 ' HA ' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -67.59 -37.37 82.47 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.183 177.629 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 841' ' ' ALA . . . . . 0.561 ' HB1' ' O ' ' A' ' 837' ' ' ARG . . . -67.22 -24.25 65.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.005 0.431 . . . . 0.0 110.444 178.517 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.08 -57.76 8.66 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.052 176.011 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 843' ' ' GLN . . . . . 1.0 ' HG2' HD21 ' A' ' 929' ' ' LEU . 4.4 mp0 -68.1 -42.03 80.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.095 -177.654 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 844' ' ' LEU . . . . . 0.428 ' HB2' ' O ' ' A' ' 840' ' ' LEU . 0.0 OUTLIER -66.04 -32.76 74.42 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.11 0.481 . . . . 0.0 110.743 179.263 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -65.46 -38.41 94.8 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.933 -0.651 . . . . 0.0 111.874 178.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -70.98 -44.38 66.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.618 0.247 . . . . 0.0 111.099 179.09 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -161.23 78.65 0.58 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.065 0.459 . . . . 0.0 111.39 178.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . -147.8 32.5 1.31 Allowed Glycine 0 N--CA 1.445 -0.753 0 C-N-CA 120.673 -0.775 . . . . 0.0 111.786 176.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 849' ' ' TYR . . . . . 0.507 ' HB3' ' O ' ' A' ' 825' ' ' MET . 70.0 m-85 62.89 -156.9 0.33 Allowed 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 -178.895 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -77.24 108.81 10.62 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.866 0.365 . . . . 0.0 110.298 179.211 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -96.6 134.3 40.0 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.256 -176.228 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.43 122.44 36.69 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.069 177.095 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -92.94 137.25 32.53 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -175.668 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 854' ' ' ALA . . . . . 0.612 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -150.65 161.66 42.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.952 176.258 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 855' ' ' ASN . . . . . 0.451 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 16.1 p-10 -147.29 74.83 1.35 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.271 0.558 . . . . 0.0 111.647 -179.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 856' ' ' ASP . . . . . 0.451 ' HB2' ' O ' ' A' ' 855' ' ' ASN . 7.3 t0 172.86 147.9 0.05 Allowed 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 114.999 -1.0 . . . . 0.0 109.613 175.127 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -74.06 -35.31 53.88 Favored Glycine 0 N--CA 1.443 -0.861 0 C-N-CA 120.949 -0.643 . . . . 0.0 111.685 179.515 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 858' ' ' VAL . . . . . 0.424 HG23 ' N ' ' A' ' 859' ' ' ASP . 19.4 m -73.09 -31.37 34.77 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 CA-C-O 120.899 0.38 . . . . 0.0 110.645 -179.749 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 859' ' ' ASP . . . . . 0.424 ' N ' HG23 ' A' ' 858' ' ' VAL . 2.2 t70 -70.55 -38.52 74.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.051 179.003 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 860' ' ' ALA . . . . . 0.605 ' O ' ' HG ' ' A' ' 864' ' ' LEU . . . -61.33 -42.44 98.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.12 176.278 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 861' ' ' LEU . . . . . 0.494 HD21 ' HB3' ' A' ' 893' ' ' LEU . 1.3 mt -60.13 -41.63 93.06 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.719 177.604 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -63.88 -39.89 95.25 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.793 179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 863' ' ' VAL . . . . . 0.405 HG13 ' O ' ' A' ' 860' ' ' ALA . 0.3 OUTLIER -66.14 -33.9 66.63 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.764 -177.997 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 864' ' ' LEU . . . . . 0.605 ' HG ' ' O ' ' A' ' 860' ' ' ALA . 4.9 mt -69.85 -35.06 74.43 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.048 0.451 . . . . 0.0 110.109 176.27 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 4.1 m -81.5 -6.63 59.15 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.074 -178.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 17.2 mtpt -99.99 -45.59 5.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.729 176.009 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 867' ' ' ASN . . . . . 0.438 ' HB3' ' H ' ' A' ' 868' ' ' HIS . 22.9 t-20 -124.68 -112.16 0.3 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.518 -178.66 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 868' ' ' HIS . . . . . 0.438 ' H ' ' HB3' ' A' ' 867' ' ' ASN . 11.5 t60 -161.68 -67.27 0.06 Allowed 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 179.237 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 869' ' ' ILE . . . . . 0.578 ' HA ' ' HG3' ' A' ' 826' ' ' MET . 35.7 mt 66.07 147.42 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 O-C-N 123.846 0.716 . . . . 0.0 110.468 -175.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 870' ' ' ASP . . . . . 0.44 ' N ' HG23 ' A' ' 869' ' ' ILE . 0.2 OUTLIER -96.69 -36.42 10.69 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.251 -0.58 . . . . 0.0 112.421 -171.495 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 871' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -136.51 133.88 49.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.908 0.385 . . . . 0.0 110.837 -178.366 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 872' ' ' VAL . . . . . 0.545 HG22 HD12 ' A' ' 897' ' ' LEU . 12.0 t -101.81 124.83 55.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.444 177.67 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 873' ' ' LEU . . . . . 0.505 ' HA ' HD23 ' A' ' 873' ' ' LEU . 45.5 mt -104.85 100.06 9.68 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 174.616 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -95.52 96.31 8.98 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.626 -178.252 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 875' ' ' ASP . . . . . 0.747 ' HB3' ' HB2' ' A' ' 831' ' ' ASP . 25.0 t0 -93.19 106.91 18.81 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.988 -177.842 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 21.6 t -108.61 135.77 46.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.091 -170.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 877' ' ' ASN . . . . . 0.819 ' HB2' ' HE3' ' A' ' 925' ' ' LYS . 10.9 t-20 -163.6 80.37 0.44 Allowed 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.7 176.205 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 878' ' ' MET . . . . . 0.448 ' HA ' ' HD3' ' A' ' 879' ' ' PRO . 0.0 OUTLIER -145.54 142.96 18.73 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.81 178.598 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 879' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 878' ' ' MET . 3.0 Cg_exo -75.78 39.33 0.63 Allowed 'Trans proline' 0 CA--C 1.53 0.303 0 C-N-CA 123.273 2.649 . . . . 0.0 112.587 -178.414 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -145.42 127.54 15.65 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 -179.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.44 78.96 3.16 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.66 0.743 . . . . 0.0 111.421 -178.08 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -86.22 21.83 1.94 Allowed 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.264 175.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -75.63 49.7 2.42 Favored Glycine 0 C--N 1.331 0.292 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.58 177.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 884' ' ' TYR . . . . . 0.422 ' O ' ' HB2' ' A' ' 888' ' ' GLN . 54.6 t80 -158.99 -54.99 0.06 Allowed 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 -179.752 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 885' ' ' ARG . . . . . 0.73 ' O ' ' HB2' ' A' ' 889' ' ' ARG . 0.0 OUTLIER -58.39 -50.73 72.64 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.409 -179.486 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.43 -52.61 17.57 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.815 -176.435 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -60.87 -48.36 82.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 0.0 112.141 -174.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 888' ' ' GLN . . . . . 0.499 ' O ' ' HB2' ' A' ' 892' ' ' GLN . 3.8 mm-40 -68.68 -45.22 72.26 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.956 -0.297 . . . . 0.0 110.745 -178.124 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 889' ' ' ARG . . . . . 0.73 ' HB2' ' O ' ' A' ' 885' ' ' ARG . 0.0 OUTLIER -61.38 -48.09 82.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.595 0.236 . . . . 0.0 111.223 -177.724 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 890' ' ' ILE . . . . . 0.625 HG23 ' N ' ' A' ' 891' ' ' ARG . 0.7 OUTLIER -62.71 -42.69 97.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.25 -175.94 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 891' ' ' ARG . . . . . 0.625 ' N ' HG23 ' A' ' 890' ' ' ILE . 0.0 OUTLIER -75.45 -28.53 59.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.652 0.263 . . . . 0.0 111.04 -178.84 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 892' ' ' GLN . . . . . 0.499 ' HB2' ' O ' ' A' ' 888' ' ' GLN . 0.0 OUTLIER -70.15 -36.05 74.46 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.046 179.312 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 893' ' ' LEU . . . . . 0.494 ' HB3' HD21 ' A' ' 861' ' ' LEU . 0.1 OUTLIER -83.58 -3.58 57.81 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.889 -176.536 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 109.32 30.76 3.48 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.122 -1.037 . . . . 0.0 114.313 172.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 895' ' ' LEU . . . . . 0.593 HD11 HD11 ' A' ' 864' ' ' LEU . 0.2 OUTLIER -66.79 112.03 4.03 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 117.393 0.596 . . . . 0.0 109.524 172.837 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 8.4 t -130.16 59.67 1.63 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 122.08 0.943 . . . . 0.0 110.537 -177.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 897' ' ' LEU . . . . . 0.545 HD12 HG22 ' A' ' 872' ' ' VAL . 1.0 OUTLIER -156.07 151.73 22.18 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.655 178.454 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -58.03 116.39 3.2 Favored 'Trans proline' 0 C--O 1.235 0.327 0 C-N-CA 122.956 2.437 . . . . 0.0 113.117 -176.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 899' ' ' VAL . . . . . 0.4 ' HB ' ' CA ' ' A' ' 919' ' ' MET . 16.2 t -103.38 124.91 57.89 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.634 177.037 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 900' ' ' ILE . . . . . 0.495 HG21 ' HB2' ' A' ' 921' ' ' SER . 8.7 mt -104.74 102.03 13.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 177.06 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 901' ' ' GLY . . . . . 0.497 ' HA3' ' HE1' ' A' ' 919' ' ' MET . . . -83.5 112.73 3.59 Favored Glycine 0 N--CA 1.444 -0.799 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.0 -178.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 902' ' ' VAL . . . . . 0.851 ' HB ' HD13 ' A' ' 923' ' ' LEU . 0.2 OUTLIER -104.23 114.55 44.15 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.915 0 N-CA-C 109.268 -0.642 . . . . 0.0 109.268 178.311 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 903' ' ' THR . . . . . 0.498 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.1 OUTLIER -119.86 152.76 36.84 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.546 -176.347 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -76.14 103.84 6.38 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.749 -179.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 57.88 79.07 0.21 Allowed 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.751 178.649 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 906' ' ' ALA . . . . . 0.434 ' HB1' ' HG3' ' A' ' 909' ' ' GLU . . . -85.16 -11.92 53.95 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.744 179.161 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 907' ' ' LEU . . . . . 0.423 ' HB2' ' O ' ' A' ' 906' ' ' ALA . 1.5 mt 73.86 -54.25 0.68 Allowed 'General case' 0 N--CA 1.471 0.599 0 O-C-N 124.048 0.842 . . . . 0.0 111.27 176.631 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -132.85 72.3 1.49 Allowed 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 177.006 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 909' ' ' GLU . . . . . 0.434 ' HG3' ' HB1' ' A' ' 906' ' ' ALA . 1.8 mp0 -46.61 -52.46 13.56 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.377 -0.828 . . . . 0.0 112.304 -176.028 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 910' ' ' GLU . . . . . 0.436 ' O ' ' HB3' ' A' ' 913' ' ' ARG . 1.0 OUTLIER -56.77 -46.44 81.49 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 120.946 0.403 . . . . 0.0 111.575 -179.136 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -66.53 -37.32 84.77 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.23 0.538 . . . . 0.0 110.692 -178.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -63.3 -31.29 72.4 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.039 177.23 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 913' ' ' ARG . . . . . 0.645 ' HB2' ' SG ' ' A' ' 922' ' ' CYS . 13.6 ttp180 -67.12 -38.88 86.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.444 177.536 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 13.3 m -63.45 -27.94 69.63 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.037 0.446 . . . . 0.0 110.32 176.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.02 -49.68 42.34 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.641 177.31 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 916' ' ' GLU . . . . . 0.452 ' H ' ' HG3' ' A' ' 916' ' ' GLU . 0.0 OUTLIER -74.18 -50.28 19.93 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 121.106 -0.237 . . . . 0.0 111.266 -176.535 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 50.38 40.95 24.03 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.802 -175.575 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -136.9 -29.38 0.3 Allowed Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.572 -0.823 . . . . 0.0 113.483 -176.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 919' ' ' MET . . . . . 0.577 ' O ' ' HB2' ' A' ' 920' ' ' ASP . 0.3 OUTLIER -84.23 -87.53 0.11 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 117.183 0.491 . . . . 0.0 110.826 -176.763 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 920' ' ' ASP . . . . . 0.577 ' HB2' ' O ' ' A' ' 919' ' ' MET . 25.6 t70 164.32 -53.15 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.533 0.733 . . . . 0.0 110.39 176.081 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 921' ' ' SER . . . . . 0.495 ' HB2' HG21 ' A' ' 900' ' ' ILE . 1.0 OUTLIER -134.81 171.06 14.91 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.871 179.819 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 922' ' ' CYS . . . . . 0.645 ' SG ' ' HB2' ' A' ' 913' ' ' ARG . 0.4 OUTLIER -149.59 145.43 26.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.815 0.34 . . . . 0.0 111.372 -178.213 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 923' ' ' LEU . . . . . 0.851 HD13 ' HB ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -145.82 -176.86 5.31 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.933 175.654 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 924' ' ' SER . . . . . 0.519 ' HB3' ' HD2' ' A' ' 926' ' ' PRO . 4.1 m -103.55 144.55 31.27 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.802 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 925' ' ' LYS . . . . . 0.819 ' HE3' ' HB2' ' A' ' 877' ' ' ASN . 12.9 tttm -54.44 -45.85 99.25 Favored Pre-proline 0 CA--C 1.539 0.547 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 -179.154 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 926' ' ' PRO . . . . . 0.519 ' HD2' ' HB3' ' A' ' 924' ' ' SER . 14.8 Cg_exo -69.93 71.96 1.57 Allowed 'Trans proline' 0 C--N 1.356 0.953 0 C-N-CA 121.851 1.701 . . . . 0.0 111.923 175.157 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 10.0 p -95.04 140.75 16.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.992 -178.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 928' ' ' THR . . . . . 0.472 ' OG1' HG22 ' A' ' 931' ' ' VAL . 0.0 OUTLIER -92.56 159.56 15.43 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.857 179.182 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 929' ' ' LEU . . . . . 1.0 HD21 ' HG2' ' A' ' 843' ' ' GLN . 1.3 tm? -52.69 -43.26 65.48 Favored 'General case' 0 N--CA 1.464 0.271 0 O-C-N 123.468 0.48 . . . . 0.0 111.027 179.269 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.39 -37.71 88.47 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.97 0.414 . . . . 0.0 110.659 -177.282 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 931' ' ' VAL . . . . . 0.472 HG22 ' OG1' ' A' ' 928' ' ' THR . 44.2 t -75.6 -47.14 34.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.147 -176.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 932' ' ' ILE . . . . . 0.453 HG21 ' N ' ' A' ' 933' ' ' LYS . 0.0 OUTLIER -63.59 -40.1 87.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 121.148 -0.221 . . . . 0.0 110.702 -179.329 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 933' ' ' LYS . . . . . 0.453 ' N ' HG21 ' A' ' 932' ' ' ILE . 1.8 tmmt? -62.96 -48.47 78.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.066 0.46 . . . . 0.0 110.33 177.829 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -62.34 -49.35 75.92 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.379 -177.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 4.7 m -63.87 -44.8 92.0 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.386 -177.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 936' ' ' LEU . . . . . 0.415 ' HB2' ' O ' ' A' ' 932' ' ' ILE . 0.1 OUTLIER -63.9 -47.64 79.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.558 -179.045 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 55.0 m -63.27 -45.95 89.09 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.308 -179.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 938' ' ' LEU . . . . . 0.462 ' O ' ' HB2' ' A' ' 942' ' ' ARG . 0.4 OUTLIER -64.01 -43.19 96.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.254 -178.372 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -73.89 -32.57 63.64 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 121.084 -0.246 . . . . 0.0 111.082 -177.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -69.54 -45.99 67.5 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.806 0.336 . . . . 0.0 110.678 177.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 941' ' ' GLU . . . . . 0.425 ' HA ' ' HB2' ' A' ' 944' ' ' ARG . 1.7 pt-20 -70.42 -23.78 62.8 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.833 0.349 . . . . 0.0 110.463 178.524 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 942' ' ' ARG . . . . . 0.462 ' HB2' ' O ' ' A' ' 938' ' ' LEU . 0.4 OUTLIER -66.13 -48.47 70.73 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.724 178.722 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 943' ' ' VAL . . . . . 0.419 ' H ' HG22 ' A' ' 943' ' ' VAL . 2.8 m -72.69 -30.44 33.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.046 0.45 . . . . 0.0 110.043 178.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 944' ' ' ARG . . . . . 0.425 ' HB2' ' HA ' ' A' ' 941' ' ' GLU . 0.9 OUTLIER -62.68 -48.74 77.96 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.981 177.37 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -74.48 -16.13 60.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.769 0.318 . . . . 0.0 111.26 -179.562 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 63.4 m -79.29 -26.78 42.26 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.15 0.5 . . . . 0.0 109.971 174.088 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 1.6 mpp_? -82.63 -38.49 23.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.647 175.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -96.12 -127.02 0.14 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.856 177.764 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 2.3 m . . . . . 0 C--O 1.25 1.116 0 CA-C-O 118.89 -0.576 . . . . 0.0 109.983 176.528 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.928 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . -146.01 92.19 0.16 Allowed Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.996 -0.621 . . . . 0.0 111.679 -179.281 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . -94.2 82.54 0.97 Allowed Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.761 -0.733 . . . . 0.0 111.805 -177.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 5.8 m -147.34 101.65 3.4 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.055 0.455 . . . . 0.0 110.799 179.041 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . -142.25 50.02 0.73 Allowed Glycine 0 N--CA 1.445 -0.724 0 N-CA-C 110.763 -0.935 . . . . 0.0 110.763 175.628 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -142.1 135.52 28.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 120.939 0.399 . . . . 0.0 111.058 -176.028 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -83.62 80.1 9.23 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 173.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . -51.71 -46.12 54.34 Favored Glycine 0 C--N 1.332 0.333 0 CA-C-N 115.544 -0.753 . . . . 0.0 113.361 -175.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.642 ' HB3' HG23 ' A' ' 801' ' ' ILE . 1.7 pt? -151.73 -48.88 0.11 Allowed 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 121.291 -0.164 . . . . 0.0 110.581 179.69 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 705' ' ' SER . . . . . 0.56 ' N ' ' HG ' ' A' ' 704' ' ' LEU . 3.7 m 58.44 -177.45 0.08 Allowed 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.827 178.506 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 67.68 15.72 66.87 Favored Glycine 0 CA--C 1.52 0.346 0 CA-C-N 116.142 -0.481 . . . . 0.0 113.603 175.025 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 707' ' ' LYS . . . . . 0.632 ' HB2' HD11 ' A' ' 731' ' ' ILE . 10.0 mmmt -118.88 148.34 43.01 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 708' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -109.38 122.96 48.52 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.058 0.456 . . . . 0.0 110.863 -176.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -101.86 113.79 27.29 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 175.507 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 710' ' ' TRP . . . . . . . . . . . . . 87.8 m95 -89.91 115.38 27.17 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -178.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 711' ' ' LEU . . . . . 0.494 HD12 ' HB2' ' A' ' 719' ' ' CYS . 0.0 OUTLIER -114.87 125.48 53.7 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.75 -172.158 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 712' ' ' ALA . . . . . 0.408 ' HB2' HG21 ' A' ' 749' ' ' THR . . . -126.29 43.37 3.11 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.191 177.256 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 713' ' ' VAL . . . . . 0.754 ' HA ' ' CB ' ' A' ' 750' ' ' ASP . 25.2 t -98.82 133.76 40.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.63 -0.713 . . . . 0.0 110.652 -178.053 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -98.3 -34.04 10.84 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.639 -176.647 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -69.96 122.52 19.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.436 178.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 716' ' ' ALA . . . . . 0.707 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -64.18 -37.59 88.02 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.087 -0.506 . . . . 0.0 112.066 -173.404 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 717' ' ' SER . . . . . 0.409 ' O ' ' HB2' ' A' ' 721' ' ' PHE . 1.7 m -63.09 -45.61 91.27 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.116 0.484 . . . . 0.0 110.24 179.126 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 718' ' ' LEU . . . . . 0.576 ' HB3' HG12 ' A' ' 713' ' ' VAL . 0.4 OUTLIER -68.93 -49.74 55.47 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.514 -0.767 . . . . 0.0 111.566 -179.534 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 719' ' ' CYS . . . . . 0.707 ' SG ' ' HA ' ' A' ' 716' ' ' ALA . 30.5 p -67.13 -51.02 59.17 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.212 -174.675 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 720' ' ' GLN . . . . . 0.408 ' HA ' ' CG ' ' A' ' 723' ' ' GLU . 4.6 tp60 -60.24 -39.23 86.0 Favored 'General case' 0 C--N 1.332 -0.163 0 O-C-N 122.997 0.185 . . . . 0.0 111.37 -178.21 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 721' ' ' PHE . . . . . 0.409 ' HB2' ' O ' ' A' ' 717' ' ' SER . 10.6 t80 -55.87 -55.8 28.19 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.021 0.438 . . . . 0.0 110.433 179.755 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 722' ' ' LEU . . . . . 0.489 HD11 HG22 ' A' ' 748' ' ' ILE . 20.5 mt -68.42 -46.54 69.62 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.427 -176.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 723' ' ' GLU . . . . . 0.408 ' CG ' ' HA ' ' A' ' 720' ' ' GLN . 0.0 OUTLIER -64.66 -44.23 91.07 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.549 0.203 . . . . 0.0 111.549 -173.892 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 724' ' ' THR . . . . . 0.624 ' O ' ' HG3' ' A' ' 728' ' ' ARG . 55.4 m -67.36 -36.76 82.04 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.769 0.318 . . . . 0.0 110.804 -179.189 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 24.5 m -70.67 -49.08 51.08 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.737 0.304 . . . . 0.0 111.467 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 726' ' ' LEU . . . . . . . . . . . . . 9.6 mt -68.6 -37.09 79.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.649 -175.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.61 -18.96 65.71 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.044 0.45 . . . . 0.0 110.88 -179.707 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 728' ' ' ARG . . . . . 0.624 ' HG3' ' O ' ' A' ' 724' ' ' THR . 8.9 mtm180 -74.69 -11.25 60.13 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.013 0.435 . . . . 0.0 110.74 178.297 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -103.7 8.02 37.34 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.045 0.45 . . . . 0.0 110.803 178.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 730' ' ' GLY . . . . . 0.467 ' O ' ' HA ' ' A' ' 705' ' ' SER . . . 89.86 13.17 61.24 Favored Glycine 0 C--N 1.329 0.169 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.784 179.006 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 731' ' ' ILE . . . . . 0.632 HD11 ' HB2' ' A' ' 707' ' ' LYS . 15.2 mm -90.35 128.94 41.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 O-C-N 122.791 -0.24 . . . . 0.0 110.475 179.686 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 732' ' ' VAL . . . . . . . . . . . . . 1.4 p -90.01 115.81 30.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.201 0.524 . . . . 0.0 110.566 -179.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 733' ' ' VAL . . . . . . . . . . . . . 10.1 t -86.81 137.14 21.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.195 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -141.48 137.34 32.04 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.827 0.346 . . . . 0.0 110.948 -177.845 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.72 116.6 7.82 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.632 178.548 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -85.4 80.01 9.27 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.401 0.619 . . . . 0.0 110.873 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 737' ' ' GLU . . . . . 0.537 ' H ' ' HG3' ' A' ' 737' ' ' GLU . 0.0 OUTLIER -79.01 -29.41 43.65 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.065 176.26 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 146.77 67.49 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.57 178.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 739' ' ' GLN . . . . . 0.411 ' HB2' ' H ' ' A' ' 740' ' ' GLU . 0.1 OUTLIER -112.99 -119.96 0.3 Allowed 'General case' 0 C--N 1.329 -0.312 0 O-C-N 122.879 -0.189 . . . . 0.0 110.817 179.304 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 740' ' ' GLU . . . . . 0.483 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 17.2 mm-40 -112.5 134.14 21.67 Favored Pre-proline 0 C--N 1.326 -0.432 0 CA-C-O 120.659 0.266 . . . . 0.0 111.045 -177.065 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 741' ' ' PRO . . . . . 0.483 ' HD3' ' HA ' ' A' ' 740' ' ' GLU . 4.5 Cg_endo -88.0 125.81 1.98 Allowed 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 123.434 2.756 . . . . 0.0 111.98 175.607 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 742' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -95.71 125.17 50.14 Favored Pre-proline 0 N--CA 1.449 -0.525 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.377 176.777 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 743' ' ' PRO . . . . . 0.666 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 34.0 Cg_endo -64.28 -9.41 19.79 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.834 2.356 . . . . 0.0 112.465 -179.314 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -104.85 -6.96 19.74 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.055 -179.902 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -117.13 167.28 11.32 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.519 -173.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 746' ' ' VAL . . . . . 0.665 HG23 HD12 ' A' ' 795' ' ' LEU . 33.0 m -118.91 148.21 21.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.352 0.596 . . . . 0.0 112.417 -171.454 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 747' ' ' LEU . . . . . 0.463 HD23 HG23 ' A' ' 749' ' ' THR . 0.3 OUTLIER -107.89 115.14 29.59 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.481 175.141 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 748' ' ' ILE . . . . . 0.489 HG22 HD11 ' A' ' 722' ' ' LEU . 19.3 mt -98.86 107.55 20.67 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 172.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 749' ' ' THR . . . . . 0.67 HG22 ' HB ' ' A' ' 753' ' ' VAL . 0.0 OUTLIER -102.68 160.55 14.48 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.319 -0.855 . . . . 0.0 112.192 -170.388 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 750' ' ' ASP . . . . . 0.754 ' CB ' ' HA ' ' A' ' 713' ' ' VAL . 36.7 t0 -124.14 121.61 35.59 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 171.426 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 64.84 -165.77 0.23 Allowed 'General case' 0 C--N 1.327 -0.385 0 O-C-N 123.785 0.678 . . . . 0.0 110.715 -174.288 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 752' ' ' VAL . . . . . 0.593 HG22 HG12 ' A' ' 772' ' ' ILE . 42.0 t -82.46 122.4 37.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.06 0.457 . . . . 0.0 111.317 -175.164 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 753' ' ' VAL . . . . . 0.67 ' HB ' HG22 ' A' ' 749' ' ' THR . 8.7 p -93.21 -7.16 10.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.269 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 54.72 51.24 14.17 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.388 -178.666 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.72 167.87 28.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.713 178.196 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 756' ' ' LYS . . . . . 0.458 ' HZ1' ' CD ' ' A' ' 780' ' ' GLU . 0.3 OUTLIER -101.77 -29.47 11.86 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 123.108 0.255 . . . . 0.0 110.987 -179.686 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 757' ' ' TRP . . . . . 0.511 ' CD1' ' HB ' ' A' ' 762' ' ' VAL . 68.9 t-105 65.03 94.01 0.06 Allowed 'General case' 0 N--CA 1.464 0.271 0 O-C-N 123.794 0.684 . . . . 0.0 111.007 -179.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.81 64.58 8.13 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.255 0.55 . . . . 0.0 110.326 177.447 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 759' ' ' GLY . . . . . 0.666 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -123.44 -151.82 8.33 Favored Glycine 0 N--CA 1.446 -0.644 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.457 178.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.14 -51.01 19.49 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.993 0.425 . . . . 0.0 110.051 178.563 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -162.39 151.17 15.03 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.377 178.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 762' ' ' VAL . . . . . 0.511 ' HB ' ' CD1' ' A' ' 757' ' ' TRP . 2.7 p -128.15 117.04 44.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.606 176.754 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 763' ' ' VAL . . . . . 0.411 HG11 HD23 ' A' ' 791' ' ' LEU . 1.6 t -109.49 104.19 16.69 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.693 -178.2 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 764' ' ' THR . . . . . . . . . . . . . 90.4 m -95.43 121.44 37.12 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.951 -175.132 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 765' ' ' PHE . . . . . 0.835 ' HE1' HG22 ' A' ' 785' ' ' VAL . 5.6 m-85 -91.13 89.3 7.31 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.334 173.629 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -110.61 133.54 53.22 Favored 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.57 -175.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.79 61.06 4.08 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.98 0.419 . . . . 0.0 110.053 179.565 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 3.3 mtm180 57.39 29.9 17.69 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.868 178.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -96.17 118.66 33.19 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.114 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 770' ' ' ILE . . . . . 0.533 ' HB ' HG21 ' A' ' 752' ' ' VAL . 53.6 mt 71.31 -70.01 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 O-C-N 123.76 0.662 . . . . 0.0 111.477 178.123 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . 126.73 96.93 0.99 Allowed Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 120.504 -0.855 . . . . 0.0 113.248 178.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 772' ' ' ILE . . . . . 0.593 HG12 HG22 ' A' ' 752' ' ' VAL . 39.2 mm -104.42 129.28 25.33 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 171.49 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 773' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -75.12 170.91 19.35 Favored 'Trans proline' 0 CA--C 1.53 0.279 0 C-N-CA 122.578 2.186 . . . . 0.0 113.184 -178.311 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . 0.571 ' O ' ' HB3' ' A' ' 780' ' ' GLU . 0.7 OUTLIER -101.93 -148.88 0.38 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.459 -178.706 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 775' ' ' GLU . . . . . 0.482 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 1.7 mp0 -65.38 60.56 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -179.688 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -102.01 -16.06 16.59 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 170.75 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -132.26 149.25 72.67 Favored Pre-proline 0 N--CA 1.449 -0.514 0 CA-C-N 114.188 -1.369 . . . . 0.0 108.423 175.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -60.67 100.41 0.16 Allowed 'Trans proline' 0 C--O 1.232 0.206 0 C-N-CA 122.572 2.181 . . . . 0.0 112.956 -176.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 123.05 -17.28 8.09 Favored Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.693 -0.765 . . . . 0.0 113.109 175.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 780' ' ' GLU . . . . . 0.571 ' HB3' ' O ' ' A' ' 774' ' ' LEU . 1.1 tt0 -81.07 126.29 31.26 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 117.13 0.465 . . . . 0.0 111.418 -175.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 32.3 m95 -138.68 143.07 39.0 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 176.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 1.2 m -143.93 155.35 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-O 121.121 0.486 . . . . 0.0 111.633 178.015 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 783' ' ' HIS . . . . . 0.479 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 1.4 t-160 -161.52 139.98 9.54 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.565 174.167 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -105.4 99.36 8.97 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 175.623 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 785' ' ' VAL . . . . . 0.835 HG22 ' HE1' ' A' ' 765' ' ' PHE . 0.0 OUTLIER -171.29 -160.98 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.953 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -133.33 68.15 1.51 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.796 -0.184 . . . . 0.0 110.659 177.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 50.2 67.95 3.9 Favored Pre-proline 0 N--CA 1.468 0.447 0 CA-C-N 115.878 -0.601 . . . . 0.0 112.011 178.095 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 788' ' ' PRO . . . . . 0.408 ' C ' ' H ' ' A' ' 790' ' ' GLU . 54.8 Cg_endo -87.36 46.77 1.41 Allowed 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 122.595 2.197 . . . . 0.0 112.947 -174.336 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 71.21 -32.26 0.24 Allowed 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.415 0.686 . . . . 0.0 112.85 175.726 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 790' ' ' GLU . . . . . 0.415 ' H ' ' HG3' ' A' ' 790' ' ' GLU . 1.8 pp20? -71.19 -37.92 72.13 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -175.78 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 791' ' ' LEU . . . . . 0.573 HD21 ' HE2' ' A' ' 765' ' ' PHE . 0.2 OUTLIER -71.12 -48.3 13.58 Favored Pre-proline 0 C--N 1.327 -0.372 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -176.362 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 792' ' ' PRO . . . . . 0.457 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 2.9 Cg_endo -53.65 -33.08 67.75 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 121.373 1.382 . . . . 0.0 112.119 173.855 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -66.79 -44.65 80.74 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 120.909 0.385 . . . . 0.0 110.464 175.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 794' ' ' LEU . . . . . 0.469 ' HA ' HD22 ' A' ' 794' ' ' LEU . 1.8 tm? -59.75 -44.36 93.86 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.292 177.155 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 795' ' ' LEU . . . . . 0.665 HD12 HG23 ' A' ' 746' ' ' VAL . 0.2 OUTLIER -59.84 -47.36 86.04 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.096 -179.282 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -62.13 -45.06 95.14 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.097 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.02 -24.63 62.4 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.352 -178.008 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -77.62 -28.65 15.96 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 CA-C-O 120.732 0.301 . . . . 0.0 111.116 -179.135 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 799' ' ' TYR . . . . . 0.454 ' HD1' ' HA ' ' A' ' 799' ' ' TYR . 0.2 OUTLIER -81.45 -16.96 50.42 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.445 178.488 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 1.8 mt 58.69 83.37 0.12 Allowed 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.426 -0.807 . . . . 0.0 111.92 174.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 801' ' ' ILE . . . . . 0.642 HG23 ' HB3' ' A' ' 704' ' ' LEU . 1.8 mt -102.58 109.26 26.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.815 -179.517 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -107.84 9.85 28.77 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.293 177.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 803' ' ' MET . . . . . 0.482 ' HB3' ' H ' ' A' ' 804' ' ' GLU . 0.0 OUTLIER 56.91 -121.14 1.48 Allowed 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.475 -177.397 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 804' ' ' GLU . . . . . 0.482 ' H ' ' HB3' ' A' ' 803' ' ' MET . 0.0 OUTLIER -155.55 161.33 40.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.716 0.293 . . . . 0.0 110.345 178.872 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 3.2 m -147.89 109.01 4.26 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.121 0.486 . . . . 0.0 109.936 177.169 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -105.76 119.84 40.17 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.767 -175.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 33.0 t0 -171.22 84.51 0.5 Allowed Pre-proline 0 C--N 1.327 -0.396 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.938 178.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 808' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_exo -65.78 147.4 85.51 Favored 'Trans proline' 0 C--O 1.233 0.269 0 C-N-CA 123.045 2.497 . . . . 0.0 112.779 -177.108 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -88.11 159.8 18.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.262 176.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 14.6 t30 -124.9 114.77 19.62 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.803 0.335 . . . . 0.0 110.562 -177.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -116.55 149.61 39.33 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.95 -178.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -139.77 108.3 7.08 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.459 179.228 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -77.15 146.48 25.4 Favored 'Trans proline' 0 CA--C 1.53 0.314 0 C-N-CA 122.494 2.129 . . . . 0.0 112.324 176.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -114.5 133.03 56.08 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.466 -0.333 . . . . 0.0 110.617 179.278 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 1.1 m -95.51 139.16 32.18 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.099 -179.344 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -116.63 159.3 22.38 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 176.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.11 139.2 52.64 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.252 0.548 . . . . 0.0 112.07 -172.131 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -145.22 161.99 38.2 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.023 174.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -148.8 136.74 14.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.184 0.516 . . . . 0.0 111.282 -176.384 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -127.66 153.63 46.23 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.812 174.476 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -163.98 133.59 4.0 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.767 -0.197 . . . . 0.0 110.601 179.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -167.44 108.11 0.6 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.297 176.503 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -145.25 138.25 26.32 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 172.582 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -159.07 -97.49 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.779 0.324 . . . . 0.0 111.576 -175.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.32 103.53 12.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.743 0.306 . . . . 0.0 111.049 -176.462 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 826' ' ' MET . . . . . 0.438 ' SD ' ' HA ' ' A' ' 869' ' ' ILE . 0.0 OUTLIER -100.55 117.08 33.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.495 178.949 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 827' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -113.66 120.14 62.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.93 178.811 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 828' ' ' LEU . . . . . 0.77 ' HB2' HG12 ' A' ' 869' ' ' ILE . 2.2 tm? -95.55 129.72 42.64 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 -179.03 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 829' ' ' VAL . . . . . 0.608 ' HB ' ' CZ ' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -123.44 124.22 69.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 120.725 0.298 . . . . 0.0 110.667 179.329 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 830' ' ' VAL . . . . . 0.756 HG13 ' HA ' ' A' ' 874' ' ' SER . 2.2 p -122.25 105.29 16.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.993 0.425 . . . . 0.0 111.338 -176.799 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 831' ' ' ASP . . . . . 0.687 ' HA ' ' O ' ' A' ' 875' ' ' ASP . 4.7 t0 -110.11 155.42 21.93 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.276 0.56 . . . . 0.0 111.415 -175.541 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -93.24 -21.45 19.61 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.031 -0.986 . . . . 0.0 109.496 175.184 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 10.9 m170 -110.75 118.1 49.21 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.837 -179.025 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -61.2 -40.5 49.86 Favored 'Trans proline' 0 C--O 1.234 0.313 0 C-N-CA 122.892 2.394 . . . . 0.0 112.66 -178.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 835' ' ' ILE . . . . . 0.414 HG23 ' H ' ' A' ' 836' ' ' ASN . 0.0 OUTLIER -61.04 -40.92 87.26 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.421 178.925 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 836' ' ' ASN . . . . . 0.414 ' H ' HG23 ' A' ' 835' ' ' ILE . 4.9 m120 -66.46 -46.1 77.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.638 178.282 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 837' ' ' ARG . . . . . 0.67 ' NH1' ' HB2' ' A' ' 831' ' ' ASP . 0.0 OUTLIER -52.06 -53.3 43.86 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.653 179.926 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 838' ' ' ARG . . . . . 0.495 ' HG3' ' N ' ' A' ' 839' ' ' LEU . 0.0 OUTLIER -64.24 -42.46 96.52 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.728 0.299 . . . . 0.0 111.37 -175.728 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 839' ' ' LEU . . . . . 0.495 ' N ' ' HG3' ' A' ' 838' ' ' ARG . 0.2 OUTLIER -76.3 -49.02 18.06 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -171.347 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 840' ' ' LEU . . . . . 0.528 HD13 ' NH2' ' A' ' 837' ' ' ARG . 1.7 pp -75.15 -30.04 60.64 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.387 -0.525 . . . . 0.0 111.168 -176.624 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -71.87 -25.26 61.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.822 0.344 . . . . 0.0 110.24 175.493 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -63.59 -44.66 93.37 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 172.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 843' ' ' GLN . . . . . 0.511 ' HG2' HD22 ' A' ' 929' ' ' LEU . 1.4 mt-30 -62.7 -38.3 89.88 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.286 176.397 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 844' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.81 -34.91 76.78 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.229 0.538 . . . . 0.0 110.416 175.12 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -68.45 -31.77 74.44 Favored Glycine 0 N--CA 1.446 -0.644 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.993 176.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -68.65 -24.85 64.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.939 0.4 . . . . 0.0 110.413 177.088 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 847' ' ' LEU . . . . . 0.513 HD23 ' HA ' ' A' ' 933' ' ' LYS . 0.2 OUTLIER -68.29 -38.38 81.61 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.442 174.995 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 92.0 55.66 1.71 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.742 -0.742 . . . . 0.0 113.094 175.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -136.14 164.18 28.62 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 177.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 850' ' ' GLN . . . . . 0.404 ' O ' ' HA ' ' A' ' 826' ' ' MET . 0.0 OUTLIER -80.65 108.34 14.22 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 -179.45 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -112.16 148.37 34.15 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.634 -176.122 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 852' ' ' LYS . . . . . 0.416 ' O ' HD21 ' A' ' 828' ' ' LEU . 0.0 OUTLIER -121.51 116.83 25.41 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 175.007 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 32.8 p -92.68 128.62 38.61 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.836 -178.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 854' ' ' ALA . . . . . 0.496 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -137.35 132.35 33.45 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.367 176.796 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -112.21 73.7 0.83 Allowed 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 172.235 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 856' ' ' ASP . . . . . 0.625 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 2.1 t0 -173.56 126.82 0.41 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.074 -0.966 . . . . 0.0 109.689 -170.929 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -71.86 -61.87 3.61 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.197 -177.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -59.23 -31.51 46.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 111.933 0.346 . . . . 0.0 111.933 -178.43 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 859' ' ' ASP . . . . . 0.625 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 0.2 OUTLIER -68.91 -20.85 64.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.578 0.227 . . . . 0.0 111.364 -178.049 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 860' ' ' ALA . . . . . 0.448 ' O ' ' HB2' ' A' ' 864' ' ' LEU . . . -64.77 -36.27 83.78 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.975 0.417 . . . . 0.0 110.078 176.165 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 861' ' ' LEU . . . . . 0.607 HD13 ' HG2' ' A' ' 889' ' ' ARG . 1.3 mt -71.56 -37.22 71.1 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.706 175.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 36.4 t-20 -56.18 -53.16 60.46 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 114.98 -1.009 . . . . 0.0 111.034 179.636 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 863' ' ' VAL . . . . . 0.434 HG12 ' N ' ' A' ' 864' ' ' LEU . 8.3 p -72.79 -32.71 41.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.49 -178.054 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 864' ' ' LEU . . . . . 0.502 HD22 HG23 ' A' ' 872' ' ' VAL . 0.2 OUTLIER -62.71 -45.87 90.75 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.024 0.44 . . . . 0.0 110.857 -179.956 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 1.4 m -80.2 -20.05 45.61 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.015 -178.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -74.09 -52.14 13.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.072 0.463 . . . . 0.0 110.58 178.104 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -109.84 -88.22 0.5 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.02 -179.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 868' ' ' HIS . . . . . 0.492 ' O ' ' HB ' ' A' ' 869' ' ' ILE . 0.2 OUTLIER 172.73 -64.87 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 O-C-N 123.267 0.355 . . . . 0.0 110.662 -179.409 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 869' ' ' ILE . . . . . 0.77 HG12 ' HB2' ' A' ' 828' ' ' LEU . 1.7 mp 71.89 142.66 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 O-C-N 123.783 0.677 . . . . 0.0 110.496 -175.368 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 870' ' ' ASP . . . . . 0.512 ' N ' HG23 ' A' ' 869' ' ' ILE . 0.1 OUTLIER -87.01 -42.66 12.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.883 0.373 . . . . 0.0 111.323 -176.118 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 871' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -141.07 136.16 33.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.158 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 872' ' ' VAL . . . . . 0.733 HG22 HG22 ' A' ' 869' ' ' ILE . 3.2 t -115.1 131.57 66.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.725 -178.728 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 873' ' ' LEU . . . . . 0.467 ' HA ' ' O ' ' A' ' 900' ' ' ILE . 1.9 mt -113.35 118.84 35.69 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 173.635 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 874' ' ' SER . . . . . 0.756 ' HA ' HG13 ' A' ' 830' ' ' VAL . 72.1 p -105.56 97.02 6.91 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.046 0.45 . . . . 0.0 110.282 -178.726 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 875' ' ' ASP . . . . . 0.687 ' O ' ' HA ' ' A' ' 831' ' ' ASP . 0.0 OUTLIER -87.9 105.8 17.67 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.841 -179.317 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 876' ' ' VAL . . . . . 0.593 HG22 ' H ' ' A' ' 878' ' ' MET . 5.1 p -127.19 143.11 41.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-O 121.226 0.536 . . . . 0.0 111.14 -176.203 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -98.12 -0.41 44.43 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.599 179.205 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 878' ' ' MET . . . . . 0.593 ' H ' HG22 ' A' ' 876' ' ' VAL . 2.2 tpp -132.57 80.64 61.73 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.516 -179.692 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 879' ' ' PRO . . . . . 0.806 ' HB3' HG21 ' A' ' 903' ' ' THR . 95.7 Cg_endo -98.98 57.6 0.06 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.838 0 C-N-CA 123.377 2.718 . . . . 0.0 113.187 -178.577 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -156.32 -88.52 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.183 -177.799 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -71.15 -39.4 71.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.051 0.453 . . . . 0.0 110.373 179.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -108.8 -177.46 3.32 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 174.231 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . 79.58 -52.88 4.2 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 121.088 -0.577 . . . . 0.0 113.039 176.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 1.7 p90 -63.52 -22.11 66.71 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.982 0.42 . . . . 0.0 111.541 -174.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 885' ' ' ARG . . . . . 0.47 ' H ' ' HG3' ' A' ' 885' ' ' ARG . 0.2 OUTLIER -66.27 -31.8 72.83 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.865 0.364 . . . . 0.0 110.139 176.594 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -69.39 -49.59 53.89 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 178.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.57 -39.62 94.26 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.072 0.463 . . . . 0.0 110.935 179.797 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 888' ' ' GLN . . . . . 0.795 ' HA ' ' HD3' ' A' ' 891' ' ' ARG . 1.4 tp-100 -61.01 -45.51 94.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.972 175.23 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 889' ' ' ARG . . . . . 0.607 ' HG2' HD13 ' A' ' 861' ' ' LEU . 0.0 OUTLIER -60.34 -42.95 96.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.777 179.564 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 890' ' ' ILE . . . . . 0.551 HD12 HD22 ' A' ' 861' ' ' LEU . 11.4 mm -58.69 -52.3 61.59 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.024 179.657 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 891' ' ' ARG . . . . . 0.795 ' HD3' ' HA ' ' A' ' 888' ' ' GLN . 0.4 OUTLIER -68.38 -30.09 68.94 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.42 -178.153 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -74.23 -34.85 63.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.594 -177.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 893' ' ' LEU . . . . . 0.52 HD23 HD21 ' A' ' 861' ' ' LEU . 0.6 OUTLIER -75.16 -46.73 32.29 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.838 177.608 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 133.23 89.01 0.38 Allowed Glycine 0 N--CA 1.443 -0.89 0 C-N-CA 120.638 -0.792 . . . . 0.0 112.42 179.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 895' ' ' LEU . . . . . 0.676 HD13 ' H ' ' A' ' 895' ' ' LEU . 0.0 OUTLIER -77.93 150.26 34.06 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.041 0.448 . . . . 0.0 110.783 177.918 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -135.54 13.74 3.46 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.985 -178.569 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 897' ' ' LEU . . . . . 0.414 HD21 HD11 ' A' ' 864' ' ' LEU . 1.7 pt? -149.03 154.41 39.48 Favored Pre-proline 0 C--N 1.32 -0.706 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.409 -173.609 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_exo -67.2 122.57 9.87 Favored 'Trans proline' 0 C--O 1.238 0.517 0 C-N-CA 122.873 2.382 . . . . 0.0 112.153 178.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 899' ' ' VAL . . . . . 0.799 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 18.9 t -103.19 108.3 24.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 121.266 0.555 . . . . 0.0 110.451 178.048 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 900' ' ' ILE . . . . . 0.467 ' O ' ' HA ' ' A' ' 873' ' ' LEU . 8.1 mt -96.15 102.84 14.0 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.717 178.355 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -89.94 124.71 7.55 Favored Glycine 0 N--CA 1.44 -1.049 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.475 -176.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 902' ' ' VAL . . . . . 0.51 ' CG2' ' HA ' ' A' ' 925' ' ' LYS . 0.1 OUTLIER -103.33 106.84 20.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 174.438 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 903' ' ' THR . . . . . 0.806 HG21 ' HB3' ' A' ' 879' ' ' PRO . 17.8 p -108.53 144.63 35.94 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.063 -173.447 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 904' ' ' ALA . . . . . 0.478 ' HA ' ' HB2' ' A' ' 925' ' ' LYS . . . -74.59 103.26 4.83 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.789 -0.364 . . . . 0.0 110.586 177.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 42.34 73.33 0.14 Allowed 'General case' 0 N--CA 1.468 0.44 0 O-C-N 124.225 0.953 . . . . 0.0 112.854 176.428 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -81.2 -14.08 57.92 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.244 177.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 51.8 mt 74.29 -60.44 0.52 Allowed 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.501 179.135 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -107.64 54.97 0.65 Allowed 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 175.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -44.71 -46.74 10.52 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.506 -0.77 . . . . 0.0 112.287 -177.09 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 910' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -44.97 95.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.809 0.338 . . . . 0.0 111.413 -177.829 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.82 -38.26 79.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.012 0.434 . . . . 0.0 110.462 -178.847 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 912' ' ' GLN . . . . . 0.633 ' O ' ' HG2' ' A' ' 916' ' ' GLU . 1.7 tt0 -60.81 -45.91 92.59 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.0 176.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -57.76 -35.27 70.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.305 178.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 61.7 m -68.72 -35.64 77.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.475 177.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 915' ' ' LEU . . . . . 0.53 ' HA ' HD22 ' A' ' 915' ' ' LEU . 0.3 OUTLIER -70.17 -32.69 70.75 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.055 0.455 . . . . 0.0 110.424 177.769 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 916' ' ' GLU . . . . . 0.633 ' HG2' ' O ' ' A' ' 912' ' ' GLN . 53.3 mm-40 -67.9 -38.72 83.32 Favored 'General case' 0 C--O 1.226 -0.178 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.651 176.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 50.06 24.66 1.45 Allowed 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.379 0.671 . . . . 0.0 112.755 176.55 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 918' ' ' GLY . . . . . 0.429 ' HA3' ' HB3' ' A' ' 891' ' ' ARG . . . -147.49 25.94 1.52 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.143 -177.502 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 919' ' ' MET . . . . . 0.799 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 2.1 mtt -118.18 -116.89 0.32 Allowed 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.614 0.245 . . . . 0.0 110.671 -175.234 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 920' ' ' ASP . . . . . 0.464 ' H ' ' HB3' ' A' ' 919' ' ' MET . 3.6 t70 175.56 -59.36 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.261 177.017 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 37.6 m -136.6 157.81 45.91 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.876 178.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 922' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -132.12 142.58 49.55 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.688 0.28 . . . . 0.0 111.031 -177.343 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 923' ' ' LEU . . . . . 0.501 HD11 ' HB ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -145.14 170.35 16.4 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 174.362 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 17.3 m -93.33 153.87 18.3 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 120.636 0.255 . . . . 0.0 111.13 -178.173 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 925' ' ' LYS . . . . . 0.559 ' HE3' ' HB3' ' A' ' 875' ' ' ASP . 0.0 OUTLIER -50.02 -49.2 76.34 Favored Pre-proline 0 CA--C 1.538 0.513 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 -178.64 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 926' ' ' PRO . . . . . 0.492 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 16.0 Cg_endo -58.15 103.03 0.14 Allowed 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 121.984 1.789 . . . . 0.0 111.714 174.558 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -125.73 154.72 34.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.709 -175.169 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 928' ' ' THR . . . . . 0.539 ' H ' HG13 ' A' ' 931' ' ' VAL . 0.8 OUTLIER -115.03 161.32 18.51 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.129 177.676 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 929' ' ' LEU . . . . . 0.511 HD22 ' HG2' ' A' ' 843' ' ' GLN . 0.6 OUTLIER -61.74 -42.24 98.71 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.849 0.357 . . . . 0.0 110.418 178.877 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -60.21 -50.01 75.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.275 -179.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 931' ' ' VAL . . . . . 0.539 HG13 ' H ' ' A' ' 928' ' ' THR . 1.4 p -71.65 -30.46 38.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-O 120.516 0.198 . . . . 0.0 111.254 -177.592 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 932' ' ' ILE . . . . . 0.509 ' N ' HG11 ' A' ' 931' ' ' VAL . 0.4 OUTLIER -70.48 -38.42 73.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 177.723 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 933' ' ' LYS . . . . . 0.513 ' HA ' HD23 ' A' ' 847' ' ' LEU . 1.5 tmtm? -67.82 -42.16 81.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.02 176.163 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -48.96 79.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.929 179.383 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 11.9 m -63.72 -43.95 95.02 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.333 -179.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 936' ' ' LEU . . . . . 0.509 HD23 HD21 ' A' ' 847' ' ' LEU . 0.0 OUTLIER -62.22 -56.83 14.76 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.773 179.995 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 25.5 m -59.04 -48.23 82.35 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.708 -178.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.02 -45.97 86.04 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.353 -175.283 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 939' ' ' TYR . . . . . 0.426 ' HA ' ' HB3' ' A' ' 942' ' ' ARG . 0.6 OUTLIER -80.81 -31.48 35.59 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.696 -0.402 . . . . 0.0 111.524 -176.647 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 940' ' ' ALA . . . . . 0.49 ' HB1' ' O ' ' A' ' 936' ' ' LEU . . . -61.26 -43.75 98.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.94 0.4 . . . . 0.0 110.451 176.407 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 941' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.45 -34.59 70.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.341 177.736 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 942' ' ' ARG . . . . . 0.426 ' HB3' ' HA ' ' A' ' 939' ' ' TYR . 6.8 ttt85 -65.08 -48.06 75.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.979 -177.906 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 26.9 m -71.27 -30.76 41.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.799 0.333 . . . . 0.0 110.558 -178.412 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 19.5 mtp85 -71.38 -37.5 71.58 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.819 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.15 -23.95 35.31 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.683 0.278 . . . . 0.0 111.135 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 57.1 m -76.24 -28.54 57.18 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.192 0.52 . . . . 0.0 110.281 175.576 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 1.7 mtp180 -84.94 -19.52 32.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.571 173.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 27.7 t0 69.8 79.77 0.19 Allowed 'General case' 0 CA--C 1.521 -0.165 0 CA-C-N 114.587 -1.188 . . . . 0.0 110.843 -177.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.253 1.272 0 CA-C-O 117.68 -1.153 . . . . 0.0 109.148 176.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 1.9 ttp . . . . . 0 N--CA 1.478 0.944 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 143.02 -99.84 0.23 Allowed Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.957 -0.64 . . . . 0.0 111.802 -179.165 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . 84.57 -64.9 4.18 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.942 -0.647 . . . . 0.0 112.812 179.03 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.93 119.82 11.99 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.805 0.336 . . . . 0.0 110.705 -179.26 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . 135.49 -24.28 3.37 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.349 -178.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 35.5 m -87.27 -169.61 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.649 0.262 . . . . 0.0 110.976 179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -58.45 129.13 40.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.38 177.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 703' ' ' GLY . . . . . 0.524 ' HA2' ' SD ' ' A' ' 803' ' ' MET . . . -85.24 132.71 11.27 Favored Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.804 -175.878 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.877 HD12 ' HA ' ' A' ' 801' ' ' ILE . 5.7 tp 53.74 -100.2 0.1 Allowed 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 123.392 0.677 . . . . 0.0 112.432 175.054 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 705' ' ' SER . . . . . 0.504 ' HA ' ' HA3' ' A' ' 730' ' ' GLY . 2.6 m 69.95 160.05 0.2 Allowed 'General case' 0 CA--C 1.533 0.325 0 O-C-N 123.818 0.699 . . . . 0.0 111.846 -176.332 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 100.1 -23.09 37.29 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.872 -0.68 . . . . 0.0 113.098 174.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 707' ' ' LYS . . . . . 0.695 ' HG3' HD23 ' A' ' 704' ' ' LEU . 17.4 mmtt -82.3 153.0 26.06 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 122.803 -0.234 . . . . 0.0 110.438 -179.7 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 708' ' ' ARG . . . . . 0.462 ' HA ' HG11 ' A' ' 732' ' ' VAL . 0.0 OUTLIER -103.38 159.42 15.58 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.871 0.367 . . . . 0.0 110.863 -176.828 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 709' ' ' CYS . . . . . 0.531 ' HB2' HG23 ' A' ' 731' ' ' ILE . 0.0 OUTLIER -142.44 119.54 11.4 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.635 175.049 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 710' ' ' TRP . . . . . . . . . . . . . 86.5 m95 -98.21 123.57 42.35 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.894 0.378 . . . . 0.0 110.047 -179.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 711' ' ' LEU . . . . . 0.489 ' O ' ' HG ' ' A' ' 711' ' ' LEU . 0.6 OUTLIER -119.99 123.33 43.22 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 121.527 0.679 . . . . 0.0 110.899 -179.164 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -105.82 32.73 4.16 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.111 175.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 713' ' ' VAL . . . . . 0.901 HG13 ' HB2' ' A' ' 750' ' ' ASP . 4.0 t -79.53 102.28 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.894 179.173 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 714' ' ' ARG . . . . . 0.524 ' H ' ' HB3' ' A' ' 750' ' ' ASP . 2.9 mtp180 -73.35 -18.28 61.2 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.682 -178.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -77.36 111.1 12.67 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.591 -0.732 . . . . 0.0 109.789 176.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 716' ' ' ALA . . . . . 0.553 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -63.61 -37.85 88.9 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.769 0.285 . . . . 0.0 111.769 -173.579 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.89 -47.31 75.27 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.008 0.432 . . . . 0.0 110.372 179.64 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 718' ' ' LEU . . . . . 0.543 HD12 ' HA ' ' A' ' 786' ' ' ALA . 0.2 OUTLIER -69.22 -43.54 73.88 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.198 179.229 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 719' ' ' CYS . . . . . 0.553 ' SG ' ' HA ' ' A' ' 716' ' ' ALA . 2.5 p -65.5 -46.54 79.28 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.094 -176.263 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 720' ' ' GLN . . . . . 0.407 ' N ' ' SG ' ' A' ' 719' ' ' CYS . 2.0 tt0 -61.66 -43.32 99.07 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 121.041 -0.263 . . . . 0.0 110.692 -179.73 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -59.53 -57.65 12.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.029 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 9.5 mt -56.73 -46.1 81.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.078 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 723' ' ' GLU . . . . . 0.476 ' HB3' ' O ' ' A' ' 719' ' ' CYS . 0.0 OUTLIER -59.85 -40.42 88.48 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.861 -177.264 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 724' ' ' THR . . . . . . . . . . . . . 9.6 m -67.55 -43.28 81.07 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.793 0.33 . . . . 0.0 111.071 -179.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 48.7 m -64.2 -32.92 74.69 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.657 -179.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 726' ' ' LEU . . . . . 0.442 HD21 ' SG ' ' A' ' 709' ' ' CYS . 3.5 mt -82.15 -45.79 14.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.576 -178.432 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 14.8 pt20 -64.95 -22.23 66.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.698 0.285 . . . . 0.0 111.343 -177.43 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 1.7 ptt-85 -65.61 -21.88 66.62 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.109 0.481 . . . . 0.0 110.629 177.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 3.2 m -100.98 16.13 26.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.15 0.5 . . . . 0.0 110.727 178.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 730' ' ' GLY . . . . . 0.504 ' HA3' ' HA ' ' A' ' 705' ' ' SER . . . 83.74 14.88 71.93 Favored Glycine 0 N--CA 1.449 -0.451 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.921 176.333 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 731' ' ' ILE . . . . . 0.531 HG23 ' HB2' ' A' ' 709' ' ' CYS . 8.0 mm -95.37 105.28 16.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-O 120.841 0.353 . . . . 0.0 110.114 179.491 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 732' ' ' VAL . . . . . 0.462 HG11 ' HA ' ' A' ' 708' ' ' ARG . 1.1 p -69.07 110.14 2.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.684 0.754 . . . . 0.0 110.555 -177.061 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 733' ' ' VAL . . . . . 0.442 ' H ' HG21 ' A' ' 733' ' ' VAL . 0.1 OUTLIER -87.47 134.63 27.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.755 -178.138 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -138.72 139.15 38.27 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.555 -178.656 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 1.9 m -69.12 123.49 21.24 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.641 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 33.1 t80 -84.66 101.75 12.41 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.886 -178.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.2 -50.46 4.13 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.841 176.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -169.6 42.9 0.21 Allowed Glycine 0 N--CA 1.447 -0.592 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.352 178.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 13.9 mp0 -86.39 175.1 8.58 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.731 0.301 . . . . 0.0 110.871 -177.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.38 146.16 50.04 Favored Pre-proline 0 C--N 1.325 -0.496 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.001 -176.508 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 741' ' ' PRO . . . . . 0.551 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 85.3 Cg_endo -83.82 146.91 11.92 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 122.809 2.339 . . . . 0.0 112.731 178.365 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 742' ' ' THR . . . . . 0.814 HG21 ' HD2' ' A' ' 743' ' ' PRO . 0.2 OUTLIER -133.18 141.91 42.49 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.407 178.538 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 743' ' ' PRO . . . . . 0.814 ' HD2' HG21 ' A' ' 742' ' ' THR . 38.2 Cg_endo -66.57 -9.23 23.53 Favored 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 123.025 2.483 . . . . 0.0 113.447 -178.649 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 744' ' ' GLU . . . . . 0.412 ' CD ' ' HZ3' ' A' ' 707' ' ' LYS . 0.3 OUTLIER -107.21 -3.55 19.69 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.963 0.411 . . . . 0.0 110.456 176.928 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -102.36 144.12 31.25 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.847 -174.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 3.4 p -114.9 139.49 40.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.44 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 747' ' ' LEU . . . . . 0.481 HD12 ' HB2' ' A' ' 757' ' ' TRP . 0.1 OUTLIER -104.17 110.7 23.0 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.28 177.893 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -97.26 107.53 20.12 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 176.388 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 17.6 p -104.56 148.57 26.35 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.001 0.429 . . . . 0.0 111.735 -172.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 750' ' ' ASP . . . . . 0.901 ' HB2' HG13 ' A' ' 713' ' ' VAL . 2.9 t70 -96.52 108.78 21.41 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 170.389 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 751' ' ' GLU . . . . . 0.412 ' CD ' ' HB2' ' A' ' 769' ' ' HIS . 18.2 mm-40 62.93 -147.3 0.36 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.238 -174.757 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 752' ' ' VAL . . . . . 0.69 HG12 ' HA3' ' A' ' 771' ' ' GLY . 2.1 t -79.86 133.78 28.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.758 -174.367 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 11.3 p -117.97 141.32 37.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.417 178.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.67 53.31 2.72 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.225 -178.804 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -157.85 131.76 8.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.422 -179.193 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 756' ' ' LYS . . . . . 0.484 ' HA ' ' HD2' ' A' ' 756' ' ' LYS . 0.1 OUTLIER -91.01 81.9 5.61 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.229 0.537 . . . . 0.0 110.114 177.869 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 757' ' ' TRP . . . . . 0.551 ' CH2' ' HA ' ' A' ' 741' ' ' PRO . 64.3 t-105 -65.24 124.57 22.53 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.604 178.304 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -131.49 62.56 1.62 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.206 0.527 . . . . 0.0 110.227 176.394 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 759' ' ' GLY . . . . . . . . . . . . . . . -109.8 -118.98 4.07 Favored Glycine 0 N--CA 1.444 -0.783 0 C-N-CA 120.786 -0.721 . . . . 0.0 111.565 178.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -78.45 -49.66 13.05 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.078 0.466 . . . . 0.0 110.102 177.145 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -168.16 164.64 13.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.533 179.425 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 2.5 p -141.1 126.66 19.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.453 175.195 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 3.6 t -119.52 114.7 45.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.631 -176.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 764' ' ' THR . . . . . . . . . . . . . 23.7 m -95.45 113.29 24.93 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.226 -179.114 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 765' ' ' PHE . . . . . 0.434 ' HA ' ' O ' ' A' ' 783' ' ' HIS . 30.4 m-85 -84.85 109.3 18.0 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 174.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 766' ' ' CYS . . . . . 0.541 ' O ' ' HA ' ' A' ' 784' ' ' SER . 0.0 OUTLIER -96.48 153.9 17.58 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.911 -174.075 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 11.9 ptt85 -140.39 -37.98 0.45 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.123 176.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.26 34.52 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -179.313 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . 0.412 ' HB2' ' CD ' ' A' ' 751' ' ' GLU . 0.1 OUTLIER -135.65 -71.41 0.47 Allowed 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 110.089 -0.337 . . . . 0.0 110.089 174.016 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 3.9 mt 64.09 101.19 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.403 176.264 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 771' ' ' GLY . . . . . 0.69 ' HA3' HG12 ' A' ' 752' ' ' VAL . . . -125.13 -4.92 6.95 Favored Glycine 0 N--CA 1.451 -0.306 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.014 176.731 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 772' ' ' ILE . . . . . 0.458 HG23 ' N ' ' A' ' 773' ' ' PRO . 1.1 mp -104.33 146.45 32.62 Favored Pre-proline 0 C--N 1.325 -0.461 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 178.266 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 773' ' ' PRO . . . . . 0.499 ' O ' ' HB3' ' A' ' 774' ' ' LEU . 32.8 Cg_exo -60.01 -100.77 0.0 OUTLIER 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.932 2.421 . . . . 0.0 112.627 179.387 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . 0.968 ' HA ' HG13 ' A' ' 782' ' ' VAL . 0.4 OUTLIER 172.49 -167.52 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -179.582 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 775' ' ' GLU . . . . . 0.655 ' HG3' ' HA ' ' A' ' 781' ' ' TRP . 1.5 mp0 -61.42 69.24 0.01 OUTLIER 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.824 0.821 . . . . 0.0 112.393 173.455 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.04 6.02 2.36 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 114.573 -1.194 . . . . 0.0 108.771 173.441 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 777' ' ' ALA . . . . . 0.619 ' HB1' ' HB2' ' A' ' 780' ' ' GLU . . . -127.72 162.49 48.97 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-N 114.745 -1.116 . . . . 0.0 109.409 -179.625 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 778' ' ' PRO . . . . . 0.514 ' HD2' ' HB2' ' A' ' 777' ' ' ALA . 55.6 Cg_endo -68.99 66.67 1.31 Allowed 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 122.977 2.451 . . . . 0.0 113.474 -177.196 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 118.48 31.23 1.54 Allowed Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.631 178.038 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 780' ' ' GLU . . . . . 0.629 ' O ' ' HA ' ' A' ' 775' ' ' GLU . 1.4 tt0 -115.29 129.04 56.5 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 178.445 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 781' ' ' TRP . . . . . 0.655 ' HA ' ' HG3' ' A' ' 775' ' ' GLU . 26.6 m95 -134.3 144.58 48.4 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 -179.356 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . 0.968 HG13 ' HA ' ' A' ' 774' ' ' LEU . 10.7 m -134.55 151.76 32.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 120.834 0.35 . . . . 0.0 110.63 172.613 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 783' ' ' HIS . . . . . 0.434 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.3 OUTLIER -162.98 121.88 2.12 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.664 176.362 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 784' ' ' SER . . . . . 0.541 ' HA ' ' O ' ' A' ' 766' ' ' CYS . 0.3 OUTLIER -88.65 100.91 13.47 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.582 177.274 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 785' ' ' VAL . . . . . 0.778 HG11 ' H ' ' A' ' 787' ' ' ALA . 2.0 p 178.55 170.34 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.158 -0.473 . . . . 0.0 109.893 -173.501 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 786' ' ' ALA . . . . . 0.543 ' HA ' HD12 ' A' ' 718' ' ' LEU . . . -103.59 32.23 3.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.575 0.226 . . . . 0.0 111.265 179.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 787' ' ' ALA . . . . . 0.778 ' H ' HG11 ' A' ' 785' ' ' VAL . . . 57.2 70.45 1.36 Allowed Pre-proline 0 N--CA 1.468 0.43 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.145 177.906 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 788' ' ' PRO . . . . . 0.614 ' HD2' ' OE1' ' A' ' 790' ' ' GLU . 24.2 Cg_exo -63.29 -50.15 3.9 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.727 2.284 . . . . 0.0 112.534 -178.213 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 789' ' ' HIS . . . . . 0.46 ' O ' ' HB1' ' A' ' 793' ' ' ALA . 6.5 p-80 -177.12 -29.5 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -178.01 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 790' ' ' GLU . . . . . 0.614 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -74.22 -50.38 19.37 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 111.833 0.308 . . . . 0.0 111.833 -171.105 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 791' ' ' LEU . . . . . 0.514 HD21 ' HA ' ' A' ' 791' ' ' LEU . 0.2 OUTLIER -65.4 -47.47 69.44 Favored Pre-proline 0 CA--C 1.538 0.503 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -176.81 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 792' ' ' PRO . . . . . 0.48 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 9.2 Cg_endo -58.35 -32.01 95.15 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 121.254 1.302 . . . . 0.0 112.03 174.013 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 793' ' ' ALA . . . . . 0.46 ' HB1' ' O ' ' A' ' 789' ' ' HIS . . . -70.45 -37.0 74.26 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 120.83 0.347 . . . . 0.0 110.749 177.222 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 794' ' ' LEU . . . . . 0.417 HD12 ' CH2' ' A' ' 781' ' ' TRP . 0.1 OUTLIER -61.51 -42.26 98.55 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.021 176.016 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 795' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.66 -42.56 93.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.395 178.354 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -64.76 -37.64 88.27 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.002 178.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.3 -26.5 63.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.393 179.075 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -69.12 -36.45 73.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.35 0.595 . . . . 0.0 109.915 177.137 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -77.34 -18.53 57.35 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.195 177.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 800' ' ' LEU . . . . . 0.69 ' HB3' ' HG2' ' A' ' 802' ' ' GLU . 2.9 tp 73.02 -41.04 0.49 Allowed 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 124.244 1.018 . . . . 0.0 112.904 175.455 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 801' ' ' ILE . . . . . 0.877 ' HA ' HD12 ' A' ' 704' ' ' LEU . 2.2 mt 55.57 56.97 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.903 0.859 . . . . 0.0 110.159 -175.454 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 802' ' ' GLU . . . . . 0.69 ' HG2' ' HB3' ' A' ' 800' ' ' LEU . 0.0 OUTLIER -79.85 -0.41 34.6 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.81 -177.572 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 803' ' ' MET . . . . . 0.524 ' SD ' ' HA2' ' A' ' 703' ' ' GLY . 45.5 mmm 67.31 161.56 0.17 Allowed 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.432 -0.804 . . . . 0.0 112.109 179.079 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 804' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -115.79 -163.7 0.91 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.803 -178.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -88.57 172.83 9.02 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.574 -179.673 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 20.4 t0 -77.19 88.03 3.65 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 177.252 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -56.18 117.66 17.39 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.585 -176.157 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 808' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -65.73 118.8 5.79 Favored 'Trans proline' 0 C--O 1.235 0.329 0 C-N-CA 122.71 2.273 . . . . 0.0 111.749 177.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -73.87 165.27 25.43 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.075 -179.303 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -97.59 84.15 3.35 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.476 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -92.85 140.95 28.97 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.029 177.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.09 137.01 40.4 Favored Pre-proline 0 C--N 1.323 -0.572 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.252 -176.337 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -85.14 -150.39 0.04 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 122.83 2.353 . . . . 0.0 111.059 171.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 6.5 m -69.14 93.7 0.62 Allowed 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 121.311 0.576 . . . . 0.0 109.927 177.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -95.67 170.38 9.37 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.677 -177.112 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.23 121.55 15.92 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 178.154 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 817' ' ' LYS . . . . . 0.448 ' HD3' ' HA ' ' A' ' 817' ' ' LYS . 9.0 mmtp -69.01 -38.47 79.26 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.786 -176.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -136.85 155.98 49.08 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.162 177.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 2.8 t -94.95 142.11 14.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 175.172 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -50.76 148.11 4.3 Favored 'General case' 0 C--O 1.241 0.615 0 O-C-N 123.602 0.563 . . . . 0.0 112.061 -176.571 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 20.0 p-10 -74.18 61.59 0.87 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.479 178.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -77.82 56.57 1.55 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.438 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -101.41 109.61 21.47 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.224 -0.898 . . . . 0.0 108.999 177.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -112.99 -68.79 0.9 Allowed 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.353 -178.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 17.5 ttm -109.8 108.25 18.51 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.734 178.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 826' ' ' MET . . . . . 0.465 ' HB2' ' HE1' ' A' ' 826' ' ' MET . 0.5 OUTLIER -95.72 108.79 21.13 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.19 0.519 . . . . 0.0 110.139 -179.346 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 827' ' ' ILE . . . . . 0.442 HG22 HD23 ' A' ' 873' ' ' LEU . 1.6 mt -110.32 125.65 67.57 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.299 179.112 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 828' ' ' LEU . . . . . 0.442 HD22 ' HB3' ' A' ' 852' ' ' LYS . 1.7 tm? -94.9 123.09 38.17 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.859 -178.126 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -117.93 118.03 56.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.05 0.452 . . . . 0.0 110.651 179.704 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 830' ' ' VAL . . . . . 0.506 HG12 ' HB1' ' A' ' 854' ' ' ALA . 0.0 OUTLIER -119.52 84.92 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.498 178.497 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 831' ' ' ASP . . . . . 0.9 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 27.1 t0 -95.28 120.62 35.82 Favored 'General case' 0 CA--C 1.515 -0.39 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 -179.685 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 832' ' ' ASP . . . . . 0.473 ' OD2' ' HB2' ' A' ' 877' ' ' ASN . 0.0 OUTLIER -52.69 -27.49 17.68 Favored 'General case' 0 CA--C 1.537 0.466 0 O-C-N 123.482 0.489 . . . . 0.0 112.187 -177.582 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 833' ' ' HIS . . . . . 0.422 ' HA ' ' HD2' ' A' ' 834' ' ' PRO . 0.5 OUTLIER -98.43 109.56 53.09 Favored Pre-proline 0 C--N 1.325 -0.471 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 -177.99 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 834' ' ' PRO . . . . . 0.422 ' HD2' ' HA ' ' A' ' 833' ' ' HIS . 9.5 Cg_endo -51.59 -44.18 45.77 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 123.443 2.762 . . . . 0.0 113.445 -175.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 835' ' ' ILE . . . . . 0.46 HD13 ' HA ' ' A' ' 835' ' ' ILE . 0.2 OUTLIER -68.32 -39.17 80.56 Favored 'Isoleucine or valine' 0 C--O 1.237 0.415 0 CA-C-O 120.754 0.311 . . . . 0.0 110.972 -177.222 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 836' ' ' ASN . . . . . 0.563 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 1.5 t30 -73.55 -39.83 64.42 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 179.618 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 837' ' ' ARG . . . . . 0.9 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 1.5 ttt180 -53.85 -42.62 68.74 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.171 176.473 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.56 -43.52 89.6 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.839 178.841 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.38 -48.17 71.0 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.143 -172.834 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 840' ' ' LEU . . . . . 0.563 ' HG ' ' O ' ' A' ' 836' ' ' ASN . 0.3 OUTLIER -74.38 -27.27 60.58 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.502 -0.479 . . . . 0.0 111.016 -179.072 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 841' ' ' ALA . . . . . 0.49 ' HB1' ' O ' ' A' ' 837' ' ' ARG . . . -68.88 -29.9 68.29 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.138 0.494 . . . . 0.0 109.848 175.364 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -64.77 -42.55 95.02 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.729 174.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 843' ' ' GLN . . . . . 0.558 ' HG2' HD23 ' A' ' 929' ' ' LEU . 41.5 mt-30 -62.75 -45.49 92.47 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.267 175.859 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 844' ' ' LEU . . . . . 0.428 HD12 HD12 ' A' ' 932' ' ' ILE . 0.1 OUTLIER -58.24 -46.16 86.43 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.244 179.008 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -64.15 -39.75 97.43 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 121.09 -0.576 . . . . 0.0 112.365 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 5.8 m -67.26 -23.44 65.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.884 0.373 . . . . 0.0 110.959 179.101 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 81.4 mt -75.13 -21.43 58.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.927 0.394 . . . . 0.0 110.455 177.445 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 106.62 3.7 37.28 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.618 177.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 39.2 m-85 -95.55 140.4 30.45 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.936 0.398 . . . . 0.0 110.753 -178.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 5.3 mp0 -76.43 115.66 16.38 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.066 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -107.97 135.51 49.23 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.774 -175.32 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 852' ' ' LYS . . . . . 0.442 ' HB3' HD22 ' A' ' 828' ' ' LEU . 0.0 OUTLIER -107.17 110.74 22.89 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 173.463 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 853' ' ' THR . . . . . 0.569 HG23 ' HG3' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -90.69 121.55 32.69 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.991 -0.55 . . . . 0.0 112.479 -171.563 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 854' ' ' ALA . . . . . 0.506 ' HB1' HG12 ' A' ' 830' ' ' VAL . . . -147.97 171.27 16.07 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.062 174.688 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 13.9 p-10 -144.95 75.8 1.46 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.754 0.788 . . . . 0.0 111.258 178.142 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 856' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -171.41 136.1 0.98 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.49 177.323 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -66.69 -41.44 93.83 Favored Glycine 0 N--CA 1.448 -0.512 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.895 -178.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 1.5 t -74.29 -36.24 42.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.645 0.26 . . . . 0.0 111.285 -177.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -63.18 -23.95 67.66 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.847 0.356 . . . . 0.0 111.196 -179.194 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -61.82 -35.61 78.73 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.151 0.5 . . . . 0.0 110.347 176.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 861' ' ' LEU . . . . . 0.649 HD12 ' HB3' ' A' ' 889' ' ' ARG . 0.3 OUTLIER -75.05 -35.8 61.87 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.478 177.074 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -63.01 -49.32 75.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.528 179.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 863' ' ' VAL . . . . . 0.471 HG13 HD13 ' A' ' 869' ' ' ILE . 6.5 p -66.13 -31.3 53.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.941 178.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 864' ' ' LEU . . . . . 0.833 ' HG ' HD13 ' A' ' 895' ' ' LEU . 0.7 OUTLIER -59.55 -40.77 88.37 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.061 0.458 . . . . 0.0 110.327 175.041 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 1.5 m -79.27 -30.22 42.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.99 -179.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.44 -60.53 2.37 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.309 0.576 . . . . 0.0 110.773 178.489 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 867' ' ' ASN . . . . . 0.484 ' HB3' ' H ' ' A' ' 868' ' ' HIS . 1.4 t-20 -104.95 -119.44 0.22 Allowed 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 177.914 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 868' ' ' HIS . . . . . 0.484 ' H ' ' HB3' ' A' ' 867' ' ' ASN . 0.1 OUTLIER -163.8 -45.58 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 110.499 -0.186 . . . . 0.0 110.499 173.183 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 869' ' ' ILE . . . . . 0.471 HD13 HG13 ' A' ' 863' ' ' VAL . 2.7 mp 73.32 146.93 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 O-C-N 123.613 0.571 . . . . 0.0 111.293 174.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 870' ' ' ASP . . . . . 0.452 ' N ' HG21 ' A' ' 869' ' ' ILE . 65.2 m-20 -85.54 -49.97 7.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.204 0.526 . . . . 0.0 110.672 -179.491 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 871' ' ' ILE . . . . . 0.678 HG12 ' HD2' ' A' ' 939' ' ' TYR . 0.8 OUTLIER -135.42 133.64 52.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.936 -0.575 . . . . 0.0 109.905 -179.729 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 872' ' ' VAL . . . . . 0.574 HG23 HD11 ' A' ' 897' ' ' LEU . 64.6 t -115.87 127.94 73.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.592 -178.315 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 873' ' ' LEU . . . . . 0.486 ' HB3' HD13 ' A' ' 900' ' ' ILE . 0.6 OUTLIER -120.14 115.07 22.93 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.144 0.497 . . . . 0.0 110.196 175.298 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -100.19 125.93 46.4 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.162 179.364 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 875' ' ' ASP . . . . . 0.718 ' HB3' ' HA ' ' A' ' 831' ' ' ASP . 1.2 t70 -109.6 123.89 50.22 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.336 0.588 . . . . 0.0 111.012 -179.291 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 876' ' ' VAL . . . . . 0.47 HG21 HG21 ' A' ' 903' ' ' THR . 0.1 OUTLIER -116.29 94.56 3.18 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.285 177.827 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 877' ' ' ASN . . . . . 0.736 ' HA ' ' HB3' ' A' ' 904' ' ' ALA . 68.6 m-80 -63.11 -27.18 69.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.792 174.28 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 878' ' ' MET . . . . . 0.506 ' SD ' ' HB3' ' A' ' 880' ' ' ASN . 0.0 OUTLIER -120.74 104.65 41.88 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.447 174.893 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 879' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -70.4 -13.75 33.38 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.885 2.39 . . . . 0.0 112.731 -177.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 880' ' ' ASN . . . . . 0.506 ' HB3' ' SD ' ' A' ' 878' ' ' MET . 21.7 t30 -75.18 127.05 32.3 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.092 -178.542 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 20.4 ttp 73.25 -65.67 0.34 Allowed 'General case' 0 N--CA 1.467 0.375 0 O-C-N 123.914 0.759 . . . . 0.0 111.708 175.21 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 882' ' ' ASP . . . . . 0.435 ' C ' ' H ' ' A' ' 884' ' ' TYR . 0.4 OUTLIER -70.81 -34.11 71.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.586 0.231 . . . . 0.0 110.572 -177.129 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -77.3 40.89 1.77 Allowed Glycine 0 C--N 1.331 0.264 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.017 176.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 884' ' ' TYR . . . . . 0.435 ' H ' ' C ' ' A' ' 882' ' ' ASP . 8.7 t80 -160.78 -49.01 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 179.453 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -61.6 -46.48 89.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.877 179.436 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 886' ' ' LEU . . . . . 0.571 HD11 HD13 ' A' ' 890' ' ' ILE . 0.0 OUTLIER -66.93 -43.9 82.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.72 -178.031 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.23 -47.2 83.5 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.242 -179.021 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -59.41 -44.21 92.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.11 -179.314 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 889' ' ' ARG . . . . . 0.649 ' HB3' HD12 ' A' ' 861' ' ' LEU . 0.1 OUTLIER -70.13 -38.28 75.52 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.298 -177.518 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 890' ' ' ILE . . . . . 0.571 HD13 HD11 ' A' ' 886' ' ' LEU . 9.8 mt -59.63 -49.21 84.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.041 0.448 . . . . 0.0 110.985 -179.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 891' ' ' ARG . . . . . . . . . . . . . 35.9 ptt85 -75.69 -23.67 56.18 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.102 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.25 -44.66 94.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.158 176.854 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.15 -31.06 64.04 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.943 174.55 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 90.7 66.64 1.18 Allowed Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.25 177.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 895' ' ' LEU . . . . . 0.833 HD13 ' HG ' ' A' ' 864' ' ' LEU . 0.1 OUTLIER -65.78 111.54 3.29 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 110.016 -0.365 . . . . 0.0 110.016 177.889 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.63 -11.99 54.86 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.755 -175.668 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 897' ' ' LEU . . . . . 0.574 HD13 HD23 ' A' ' 864' ' ' LEU . 0.0 OUTLIER -92.64 148.03 35.37 Favored Pre-proline 0 C--N 1.323 -0.548 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.403 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -60.08 128.62 27.11 Favored 'Trans proline' 0 C--O 1.239 0.552 0 C-N-CA 122.844 2.363 . . . . 0.0 112.731 -177.274 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 899' ' ' VAL . . . . . 0.688 HG23 HD22 ' A' ' 895' ' ' LEU . 1.8 t -111.56 129.55 66.73 Favored 'Isoleucine or valine' 0 C--O 1.236 0.387 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.922 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 900' ' ' ILE . . . . . 0.504 HG12 ' CE2' ' A' ' 939' ' ' TYR . 0.0 OUTLIER -107.57 111.31 35.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.096 176.978 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -97.0 105.97 3.28 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.14 -177.201 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 902' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -93.32 130.41 42.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 177.611 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 903' ' ' THR . . . . . 0.47 HG21 HG21 ' A' ' 876' ' ' VAL . 0.2 OUTLIER -123.46 138.36 54.6 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.199 -178.431 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 904' ' ' ALA . . . . . 0.81 ' HA ' ' HB2' ' A' ' 925' ' ' LYS . . . -79.08 117.26 19.97 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.973 176.799 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 61.73 54.93 2.81 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-O 121.327 0.584 . . . . 0.0 110.323 -178.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 906' ' ' ALA . . . . . 0.447 ' HB1' ' HB ' ' A' ' 903' ' ' THR . . . -69.94 85.23 0.51 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.465 178.732 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -83.91 -41.1 17.75 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.891 -178.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -127.7 4.02 6.1 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-O 121.412 0.625 . . . . 0.0 110.472 -178.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -69.7 -17.01 63.44 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.794 -173.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 910' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.11 -37.8 84.51 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.14 0.495 . . . . 0.0 109.921 176.393 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.07 -34.42 66.24 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.806 177.186 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 6.4 mm100 -65.06 -36.82 85.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.483 177.036 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -62.34 -41.45 98.59 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.454 177.182 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 58.8 m -70.89 -31.15 67.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.748 178.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 915' ' ' LEU . . . . . 0.414 ' HA ' HD12 ' A' ' 915' ' ' LEU . 2.9 tp -70.67 -52.12 23.2 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.065 -179.881 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -74.18 -44.76 52.2 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.336 -177.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 51.22 46.6 26.22 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.336 -175.546 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -115.89 24.86 9.86 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.785 -177.127 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 919' ' ' MET . . . . . 0.668 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -141.15 -94.71 0.14 Allowed 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.955 -0.298 . . . . 0.0 110.878 -177.876 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 920' ' ' ASP . . . . . 0.48 ' H ' ' CG ' ' A' ' 919' ' ' MET . 29.7 t70 171.42 -57.2 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 123.934 0.894 . . . . 0.0 108.656 176.176 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -133.17 163.13 29.96 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.517 176.046 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 922' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -123.94 136.63 54.45 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.412 176.466 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 923' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -123.45 173.45 8.0 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.554 -179.094 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 924' ' ' SER . . . . . 0.804 ' HB2' ' HD2' ' A' ' 926' ' ' PRO . 0.4 OUTLIER -95.11 158.77 15.32 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.336 179.709 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 925' ' ' LYS . . . . . 0.81 ' HB2' ' HA ' ' A' ' 904' ' ' ALA . 0.0 OUTLIER -60.34 -46.95 97.64 Favored Pre-proline 0 CA--C 1.538 0.516 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.544 173.537 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 926' ' ' PRO . . . . . 0.804 ' HD2' ' HB2' ' A' ' 924' ' ' SER . 52.8 Cg_exo -58.05 88.82 0.05 OUTLIER 'Trans proline' 0 C--N 1.36 1.142 0 C-N-CA 122.161 1.907 . . . . 0.0 112.552 174.122 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 12.6 t -128.56 114.62 34.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.225 177.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.74 -177.08 3.37 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.83 -179.088 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 929' ' ' LEU . . . . . 0.558 HD23 ' HG2' ' A' ' 843' ' ' GLN . 1.0 OUTLIER -54.07 -45.75 71.81 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 111.917 0.339 . . . . 0.0 111.917 -175.994 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.98 -36.19 81.62 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.131 0.491 . . . . 0.0 110.669 -177.499 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 69.2 t -76.01 -43.0 38.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.588 -175.249 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 932' ' ' ILE . . . . . 0.428 HD12 HD12 ' A' ' 844' ' ' LEU . 15.4 tt -63.01 -38.95 83.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 178.524 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 2.2 tmmt? -65.12 -48.42 73.68 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.407 178.179 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -59.26 -49.33 78.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.328 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 17.6 m -64.92 -44.02 90.91 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.526 -178.394 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 936' ' ' LEU . . . . . 0.425 HD21 ' HG ' ' A' ' 844' ' ' LEU . 0.8 OUTLIER -62.62 -43.33 99.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.452 179.7 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 937' ' ' THR . . . . . 0.419 ' O ' ' HG2' ' A' ' 941' ' ' GLU . 27.5 m -68.34 -36.25 78.97 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.208 -179.776 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 3.5 tp -64.55 -35.42 80.93 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.956 0.408 . . . . 0.0 110.748 178.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 939' ' ' TYR . . . . . 0.678 ' HD2' HG12 ' A' ' 871' ' ' ILE . 1.1 m-85 -79.17 -36.6 40.06 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.732 178.72 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -64.91 -41.6 95.44 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.928 179.211 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 941' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 937' ' ' THR . 9.7 pt-20 -69.06 -36.07 77.26 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.159 -0.312 . . . . 0.0 110.159 177.518 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 942' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -49.17 78.48 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.801 179.093 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 30.9 m -72.38 -30.61 35.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 C-N-CA 120.821 -0.351 . . . . 0.0 110.717 179.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 1.9 ttt-85 -63.56 -50.34 69.89 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.895 179.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.07 -19.89 61.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.856 0.36 . . . . 0.0 111.278 -178.141 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 17.6 m -81.37 -24.84 36.76 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.061 0.457 . . . . 0.0 110.416 175.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -84.05 -53.51 5.49 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.2 0.524 . . . . 0.0 110.443 178.502 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -141.45 145.01 34.73 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.659 -174.73 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 71.4 m . . . . . 0 C--O 1.247 0.921 0 CA-C-O 118.786 -0.625 . . . . 0.0 109.369 176.628 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.48 1.043 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 84.38 -100.19 2.33 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.556 -0.83 . . . . 0.0 111.066 -175.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . 121.21 -32.01 4.88 Favored Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.675 175.211 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.43 138.64 47.27 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.034 0.445 . . . . 0.0 110.728 179.707 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . 179.2 150.52 9.02 Favored Glycine 0 N--CA 1.445 -0.749 0 N-CA-C 110.894 -0.882 . . . . 0.0 110.894 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 2.6 t 54.19 53.51 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-O 121.529 0.681 . . . . 0.0 110.196 -177.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -83.08 -12.49 57.07 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.933 -178.422 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . 162.9 -48.97 0.32 Allowed Glycine 0 N--CA 1.448 -0.561 0 CA-C-N 115.866 -0.607 . . . . 0.0 111.806 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 20.0 mt -104.58 -177.92 3.51 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 178.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 59.97 34.48 21.52 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 121.1 0.476 . . . . 0.0 110.995 -178.286 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . -173.31 19.51 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.951 -0.643 . . . . 0.0 112.159 -179.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 8.6 mmtm -121.45 145.59 47.77 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 178.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 708' ' ' ARG . . . . . 0.517 ' HG2' HG11 ' A' ' 732' ' ' VAL . 24.3 mtm180 -102.13 161.77 13.43 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.372 0.605 . . . . 0.0 110.685 -178.549 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 1.6 m -135.77 110.5 8.68 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.241 -0.891 . . . . 0.0 108.822 170.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 710' ' ' TRP . . . . . 0.498 ' CZ3' ' HB ' ' A' ' 734' ' ' THR . 97.2 m95 -90.53 103.77 16.43 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.951 -175.489 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 711' ' ' LEU . . . . . 0.507 ' O ' ' HG ' ' A' ' 711' ' ' LEU . 0.8 OUTLIER -102.3 120.48 40.56 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 121.596 0.713 . . . . 0.0 110.655 -177.969 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 712' ' ' ALA . . . . . 0.402 ' HB1' HG22 ' A' ' 749' ' ' THR . . . -104.29 43.46 1.1 Allowed 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.355 -0.839 . . . . 0.0 108.926 175.018 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 713' ' ' VAL . . . . . 0.735 ' HA ' ' CB ' ' A' ' 750' ' ' ASP . 16.4 t -101.42 124.18 54.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.426 -177.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 5.5 mtm-85 -108.43 0.57 21.12 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.404 0.621 . . . . 0.0 110.115 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -82.09 111.11 17.93 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.436 173.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -54.46 -55.03 33.09 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -171.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 717' ' ' SER . . . . . 0.403 ' O ' ' HB2' ' A' ' 721' ' ' PHE . 0.3 OUTLIER -60.4 -36.97 79.37 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.174 0.511 . . . . 0.0 110.926 -178.66 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 718' ' ' LEU . . . . . 0.699 HD23 HG11 ' A' ' 713' ' ' VAL . 0.9 OUTLIER -73.97 -49.81 22.82 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.206 -177.547 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 719' ' ' CYS . . . . . 0.438 ' O ' ' HB3' ' A' ' 723' ' ' GLU . 19.7 p -67.7 -44.09 78.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.622 -176.393 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.6 -43.65 98.47 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.101 -179.035 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 721' ' ' PHE . . . . . 0.403 ' HB2' ' O ' ' A' ' 717' ' ' SER . 0.8 OUTLIER -58.62 -55.97 28.2 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.911 0.386 . . . . 0.0 111.058 -179.806 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.36 -44.81 93.74 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.127 -177.214 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 723' ' ' GLU . . . . . 0.581 ' HA ' HG13 ' A' ' 733' ' ' VAL . 0.4 OUTLIER -60.68 -48.26 82.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.288 -176.247 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 724' ' ' THR . . . . . . . . . . . . . 8.3 m -63.48 -36.99 85.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.995 0.426 . . . . 0.0 111.087 -177.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 725' ' ' SER . . . . . 0.42 ' HA ' ' HD3' ' A' ' 728' ' ' ARG . 12.4 m -70.09 -37.11 75.32 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.203 -179.921 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 726' ' ' LEU . . . . . . . . . . . . . 20.9 mt -75.15 -43.94 49.6 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.239 -177.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -69.04 -10.63 58.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.133 0.492 . . . . 0.0 111.029 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 728' ' ' ARG . . . . . 0.42 ' HD3' ' HA ' ' A' ' 725' ' ' SER . 0.0 OUTLIER -67.84 -33.05 74.02 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.303 176.6 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.31 5.94 49.81 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.655 -176.152 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 730' ' ' GLY . . . . . . . . . . . . . . . 86.98 14.66 64.27 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.439 -0.886 . . . . 0.0 112.422 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 731' ' ' ILE . . . . . . . . . . . . . 14.9 mm -86.63 129.41 38.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 174.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 732' ' ' VAL . . . . . 0.517 HG11 ' HG2' ' A' ' 708' ' ' ARG . 1.4 p -83.97 103.94 11.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.636 0.731 . . . . 0.0 110.441 -177.426 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 733' ' ' VAL . . . . . 0.581 HG13 ' HA ' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -80.71 115.41 23.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.358 178.543 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 734' ' ' THR . . . . . 0.498 ' HB ' ' CZ3' ' A' ' 710' ' ' TRP . 0.2 OUTLIER -122.9 131.22 53.64 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.431 -177.605 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.27 122.53 17.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.304 -179.06 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 736' ' ' TYR . . . . . 0.453 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 21.8 t80 -86.57 98.0 10.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.157 0.504 . . . . 0.0 110.919 -178.572 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -95.71 -28.64 14.69 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.382 174.359 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 161.2 52.96 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.512 0 N-CA-C 110.774 -0.93 . . . . 0.0 110.774 179.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 8.4 mp0 -101.75 -171.32 1.96 Allowed 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -171.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 740' ' ' GLU . . . . . 0.49 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 1.0 OUTLIER -69.5 134.68 88.61 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.799 -176.719 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 741' ' ' PRO . . . . . 0.49 ' HD3' ' HA ' ' A' ' 740' ' ' GLU . 3.9 Cg_endo -88.42 137.41 3.58 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 123.478 2.785 . . . . 0.0 111.614 174.017 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 742' ' ' THR . . . . . 0.748 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.2 OUTLIER -131.55 140.21 37.67 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-O 120.777 0.322 . . . . 0.0 111.082 -179.362 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 743' ' ' PRO . . . . . 0.748 ' HD2' HG22 ' A' ' 742' ' ' THR . 38.3 Cg_endo -66.13 -11.19 30.11 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 123.364 2.71 . . . . 0.0 113.254 -177.401 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -108.95 2.71 21.58 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.05 0.453 . . . . 0.0 110.399 178.328 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 745' ' ' ASP . . . . . 0.428 ' CG ' ' HB2' ' A' ' 708' ' ' ARG . 56.5 m-20 -109.63 152.04 26.06 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.45 -175.625 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 29.2 m -120.25 147.02 24.23 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.082 -178.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 747' ' ' LEU . . . . . 0.465 HD22 ' O ' ' A' ' 710' ' ' TRP . 0.3 OUTLIER -105.05 108.72 20.38 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.112 177.153 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 19.8 mt -94.56 106.54 18.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 N-CA-C 108.82 -0.808 . . . . 0.0 108.82 173.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 749' ' ' THR . . . . . 0.402 HG22 ' HB1' ' A' ' 712' ' ' ALA . 0.0 OUTLIER -100.94 153.76 19.24 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 116.056 -0.52 . . . . 0.0 112.23 -170.842 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 750' ' ' ASP . . . . . 0.735 ' CB ' ' HA ' ' A' ' 713' ' ' VAL . 9.3 t0 -113.27 113.41 25.25 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 175.361 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 751' ' ' GLU . . . . . 0.554 ' HG3' ' H ' ' A' ' 752' ' ' VAL . 3.1 tp10 68.15 -173.71 0.19 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.274 179.754 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 752' ' ' VAL . . . . . 0.554 ' H ' ' HG3' ' A' ' 751' ' ' GLU . 0.9 OUTLIER -61.0 127.17 20.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.5 178.092 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 8.8 p -114.93 -12.91 11.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.896 179.256 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 6.6 m 55.53 53.43 9.72 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.404 -178.193 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.03 167.96 28.6 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.407 178.612 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 756' ' ' LYS . . . . . 0.456 ' O ' ' HB3' ' A' ' 757' ' ' TRP . 6.1 tptm -111.3 -40.16 4.49 Favored 'General case' 0 C--N 1.322 -0.587 0 O-C-N 123.118 0.261 . . . . 0.0 110.705 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 757' ' ' TRP . . . . . 0.456 ' HB3' ' O ' ' A' ' 756' ' ' LYS . 5.5 t-105 73.11 134.86 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.294 0 O-C-N 124.094 0.871 . . . . 0.0 111.005 179.024 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -114.0 115.4 27.55 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.065 178.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 759' ' ' GLY . . . . . . . . . . . . . . . -177.25 -139.65 3.37 Favored Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.826 -0.702 . . . . 0.0 111.813 -178.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 8.2 ttt180 -79.22 -54.5 5.91 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.885 0.374 . . . . 0.0 110.08 177.025 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -162.69 163.95 26.71 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.583 179.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 762' ' ' VAL . . . . . 0.431 HG22 ' HB3' ' A' ' 747' ' ' LEU . 2.5 p -131.88 126.43 56.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.233 -0.44 . . . . 0.0 109.996 176.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 1.9 t -119.97 109.59 26.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.953 -178.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 764' ' ' THR . . . . . 0.439 ' O ' ' HA ' ' A' ' 782' ' ' VAL . 42.5 m -104.35 121.29 43.05 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.169 0.509 . . . . 0.0 112.072 -174.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 765' ' ' PHE . . . . . 0.532 ' CE1' HD21 ' A' ' 791' ' ' LEU . 29.9 m-85 -75.98 150.21 37.47 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 171.772 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -132.75 137.8 46.97 Favored 'General case' 0 C--N 1.318 -0.803 0 C-N-CA 120.923 -0.311 . . . . 0.0 110.591 179.65 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 767' ' ' ARG . . . . . 0.488 ' HB2' ' OE1' ' A' ' 751' ' ' GLU . 6.6 mmm-85 -117.78 43.73 2.33 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.162 0.506 . . . . 0.0 109.732 175.786 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 70.69 12.0 7.24 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 114.976 -1.011 . . . . 0.0 112.331 176.671 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . 0.514 ' HB2' ' CD ' ' A' ' 751' ' ' GLU . 41.1 m80 -102.8 60.66 0.8 Allowed 'General case' 0 C--N 1.328 -0.345 0 O-C-N 122.219 -0.301 . . . . 0.0 110.391 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 49.6 mt 73.11 130.45 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.101 -178.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -92.91 145.25 17.51 Favored Glycine 0 N--CA 1.444 -0.81 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.973 -179.037 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 772' ' ' ILE . . . . . 0.933 HG13 ' HD2' ' A' ' 773' ' ' PRO . 1.0 OUTLIER -89.31 161.9 38.69 Favored Pre-proline 0 C--N 1.323 -0.563 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 174.658 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 773' ' ' PRO . . . . . 0.933 ' HD2' HG13 ' A' ' 772' ' ' ILE . 10.3 Cg_endo -54.37 125.39 18.76 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.512 2.141 . . . . 0.0 112.581 177.021 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . 0.492 ' HB3' HG23 ' A' ' 782' ' ' VAL . 0.8 OUTLIER -93.29 -151.0 0.29 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.162 178.486 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 775' ' ' GLU . . . . . 0.535 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 2.8 mp0 -68.68 50.76 0.07 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.85 0.833 . . . . 0.0 112.947 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . 0.426 ' H ' ' C ' ' A' ' 774' ' ' LEU . 0.0 OUTLIER -103.88 2.12 32.23 Favored 'General case' 0 C--N 1.308 -1.207 0 N-CA-C 107.152 -1.425 . . . . 0.0 107.152 168.342 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 777' ' ' ALA . . . . . 0.46 ' HB1' ' CD ' ' A' ' 778' ' ' PRO . . . -136.51 170.36 11.08 Favored Pre-proline 0 N--CA 1.447 -0.62 0 CA-C-N 113.816 -1.538 . . . . 0.0 109.003 -179.181 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 778' ' ' PRO . . . . . 0.46 ' CD ' ' HB1' ' A' ' 777' ' ' ALA . 31.1 Cg_exo -59.6 -26.94 83.69 Favored 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 122.943 2.429 . . . . 0.0 115.707 -169.011 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . -155.47 32.28 0.64 Allowed Glycine 0 C--N 1.331 0.266 0 C-N-CA 119.777 -1.201 . . . . 0.0 112.671 -174.39 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 780' ' ' GLU . . . . . 0.535 ' O ' ' HG3' ' A' ' 775' ' ' GLU . 10.9 mp0 -103.62 130.04 51.01 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 -177.592 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 22.9 m95 -134.94 151.64 51.03 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.655 -0.248 . . . . 0.0 110.438 -176.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . 0.492 HG23 ' HB3' ' A' ' 774' ' ' LEU . 35.2 m -139.33 157.72 27.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.377 173.643 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 783' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 -167.3 121.63 1.01 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.97 0.414 . . . . 0.0 110.633 173.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -90.37 101.38 14.11 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.476 176.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -157.84 179.39 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.937 179.48 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -108.12 31.81 5.26 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.013 179.682 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 63.6 71.74 0.6 Allowed Pre-proline 0 C--O 1.232 0.141 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.8 178.032 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 788' ' ' PRO . . . . . 0.537 ' HB2' ' H ' ' A' ' 789' ' ' HIS . 5.9 Cg_exo -79.95 -119.25 0.01 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 123.033 2.489 . . . . 0.0 110.885 172.455 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 789' ' ' HIS . . . . . 0.538 ' HA ' ' HG2' ' A' ' 792' ' ' PRO . 1.0 OUTLIER -130.77 12.57 5.3 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.037 -0.665 . . . . 0.0 111.835 175.993 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 790' ' ' GLU . . . . . 0.442 ' H ' ' HG3' ' A' ' 790' ' ' GLU . 0.0 OUTLIER -83.95 -54.02 5.16 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.103 -179.275 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 791' ' ' LEU . . . . . 0.532 HD21 ' CE1' ' A' ' 765' ' ' PHE . 0.3 OUTLIER -63.31 -47.38 84.58 Favored Pre-proline 0 CA--C 1.535 0.396 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 179.32 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 792' ' ' PRO . . . . . 0.538 ' HG2' ' HA ' ' A' ' 789' ' ' HIS . 9.4 Cg_endo -55.81 -29.95 74.34 Favored 'Trans proline' 0 C--N 1.357 0.975 0 C-N-CA 121.775 1.65 . . . . 0.0 112.19 175.102 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -69.24 -41.23 77.27 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-O 120.881 0.372 . . . . 0.0 110.317 176.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.71 -43.33 97.96 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.825 176.23 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 795' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -63.34 -45.07 92.94 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.782 178.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 796' ' ' ALA . . . . . 0.483 ' HA ' HD13 ' A' ' 801' ' ' ILE . . . -63.4 -37.38 87.06 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.227 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.91 -34.66 71.76 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.455 -0.338 . . . . 0.0 110.372 178.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -62.47 -42.37 95.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.585 179.661 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -88.15 4.63 44.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.766 0.317 . . . . 0.0 110.913 179.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 40.1 mt 57.17 46.08 19.52 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.843 178.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 801' ' ' ILE . . . . . 0.483 HD13 ' HA ' ' A' ' 796' ' ' ALA . 12.9 mt -73.21 -46.88 49.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 176.682 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 54.62 62.55 2.5 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.663 -0.699 . . . . 0.0 112.096 175.028 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 803' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -134.23 91.65 2.83 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.899 0.38 . . . . 0.0 111.335 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 804' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -142.68 19.09 2.01 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.452 0.644 . . . . 0.0 110.025 177.723 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.14 140.46 30.18 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.636 -174.134 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -160.25 122.48 3.27 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.727 176.023 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -127.76 126.96 24.03 Favored Pre-proline 0 C--N 1.326 -0.443 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -175.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 808' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -78.85 88.14 1.48 Allowed 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 122.666 2.244 . . . . 0.0 111.299 172.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -79.99 -37.62 33.89 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.082 -0.508 . . . . 0.0 112.225 -173.31 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 21.2 t30 -108.31 120.49 42.54 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.936 0.398 . . . . 0.0 111.879 -173.32 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -169.74 78.95 0.1 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.439 176.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -143.79 102.95 4.91 Favored Pre-proline 0 C--N 1.327 -0.376 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 -171.721 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -91.75 144.07 2.95 Favored 'Trans proline' 0 CA--C 1.535 0.544 0 C-N-CA 123.222 2.615 . . . . 0.0 111.703 170.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -141.2 115.97 9.7 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 111.842 0.312 . . . . 0.0 111.842 -179.443 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -157.34 124.47 5.15 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.058 175.314 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -135.39 125.08 25.29 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.864 0.364 . . . . 0.0 110.382 177.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.26 61.37 1.03 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.376 0.607 . . . . 0.0 110.134 -177.091 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -93.14 100.78 13.11 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.711 -178.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 5.4 p -142.04 143.94 25.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 120.935 0.397 . . . . 0.0 110.672 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -130.6 175.7 8.79 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.442 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -85.53 159.99 19.77 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.016 0.436 . . . . 0.0 110.725 178.308 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 822' ' ' ASN . . . . . 0.434 ' HB3' ' H ' ' A' ' 823' ' ' ASP . 0.6 OUTLIER -84.79 -105.95 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.216 -178.411 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 823' ' ' ASP . . . . . 0.434 ' H ' ' HB3' ' A' ' 822' ' ' ASN . 37.9 t70 50.8 99.32 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.766 0 O-C-N 123.92 0.762 . . . . 0.0 112.513 -176.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -155.51 91.71 1.34 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.133 0.492 . . . . 0.0 110.805 -179.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -98.12 101.13 12.52 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.346 177.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 826' ' ' MET . . . . . 0.417 ' HB2' ' HE3' ' A' ' 826' ' ' MET . 2.6 tpp -104.76 116.54 32.19 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.84 -178.047 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 827' ' ' ILE . . . . . 0.655 ' HB ' HD23 ' A' ' 844' ' ' LEU . 14.4 mm -114.44 137.19 48.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.309 -179.536 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 828' ' ' LEU . . . . . 0.632 HD12 HG22 ' A' ' 872' ' ' VAL . 0.4 OUTLIER -98.24 131.84 44.24 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.709 -179.479 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 829' ' ' VAL . . . . . 0.763 HG22 HD13 ' A' ' 840' ' ' LEU . 0.2 OUTLIER -122.1 104.09 14.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 174.919 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 830' ' ' VAL . . . . . 0.457 HG21 HD22 ' A' ' 828' ' ' LEU . 0.1 OUTLIER -120.67 100.57 9.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.196 -177.838 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 831' ' ' ASP . . . . . 0.8 ' HB2' ' HB3' ' A' ' 875' ' ' ASP . 0.2 OUTLIER -117.63 154.4 31.64 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.36 -177.173 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -94.01 -16.42 23.91 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -173.411 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 833' ' ' HIS . . . . . 0.416 ' HB2' ' HB2' ' A' ' 877' ' ' ASN . 1.1 m170 -124.5 98.87 37.05 Favored Pre-proline 0 C--N 1.328 -0.354 0 O-C-N 122.068 -0.395 . . . . 0.0 111.196 -178.427 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_exo -30.64 -39.34 0.06 OUTLIER 'Trans proline' 0 C--N 1.353 0.793 1 C-N-CA 126.032 4.488 . . . . 0.0 116.871 -168.654 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 835' ' ' ILE . . . . . 0.521 ' O ' ' HG3' ' A' ' 838' ' ' ARG . 8.2 tp -59.38 -41.57 84.78 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-N 117.846 0.293 . . . . 0.0 111.689 -176.625 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 836' ' ' ASN . . . . . 0.573 ' HA ' ' HB2' ' A' ' 839' ' ' LEU . 0.8 OUTLIER -79.79 -31.95 40.8 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 -178.802 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 837' ' ' ARG . . . . . 0.505 ' O ' ' HB1' ' A' ' 841' ' ' ALA . 0.7 OUTLIER -52.73 -48.01 66.98 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.4 176.217 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 838' ' ' ARG . . . . . 0.521 ' HG3' ' O ' ' A' ' 835' ' ' ILE . 0.0 OUTLIER -73.99 -28.72 61.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.737 177.609 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 839' ' ' LEU . . . . . 0.573 ' HB2' ' HA ' ' A' ' 836' ' ' ASN . 0.2 OUTLIER -62.35 -53.92 47.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.728 -0.215 . . . . 0.0 111.442 -178.342 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 840' ' ' LEU . . . . . 0.763 HD13 HG22 ' A' ' 829' ' ' VAL . 0.0 OUTLIER -74.21 -29.55 61.78 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.393 -0.523 . . . . 0.0 110.731 -179.502 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 841' ' ' ALA . . . . . 0.505 ' HB1' ' O ' ' A' ' 837' ' ' ARG . . . -64.49 -38.65 91.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.233 0.539 . . . . 0.0 110.509 177.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -61.6 -49.53 76.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.408 -0.814 . . . . 0.0 109.941 176.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 843' ' ' GLN . . . . . 0.874 ' HG3' HD21 ' A' ' 929' ' ' LEU . 0.0 OUTLIER -58.99 -46.46 88.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.84 -179.811 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 844' ' ' LEU . . . . . 0.655 HD23 ' HB ' ' A' ' 827' ' ' ILE . 0.0 OUTLIER -60.07 -39.87 87.55 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.635 178.073 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -61.71 -39.29 97.22 Favored Glycine 0 N--CA 1.448 -0.506 0 CA-C-N 115.697 -0.683 . . . . 0.0 112.317 176.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.24 -30.49 66.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.972 0.415 . . . . 0.0 110.485 179.769 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 29.3 mt -73.98 -21.25 60.07 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.812 178.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 86.86 38.28 8.1 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 121.087 -0.578 . . . . 0.0 112.962 175.675 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 75.0 m-85 -118.2 150.54 39.23 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 178.263 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -72.25 109.67 6.15 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 179.344 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 851' ' ' CYS . . . . . 0.606 ' HB3' HD21 ' A' ' 844' ' ' LEU . 0.0 OUTLIER -102.15 112.07 24.6 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.241 -174.61 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 852' ' ' LYS . . . . . 0.419 ' HG3' ' HZ3' ' A' ' 852' ' ' LYS . 0.7 OUTLIER -86.99 108.9 19.04 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 176.079 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 853' ' ' THR . . . . . 0.411 HG23 ' HG2' ' A' ' 837' ' ' ARG . 0.3 OUTLIER -104.1 123.43 47.24 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.015 0.436 . . . . 0.0 111.89 -171.355 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 854' ' ' ALA . . . . . . . . . . . . . . . -140.16 146.9 39.38 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.474 176.62 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 855' ' ' ASN . . . . . 0.418 ' HA ' ' O ' ' A' ' 831' ' ' ASP . 6.1 t-20 -114.76 76.47 0.99 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.109 0.48 . . . . 0.0 110.479 179.629 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 856' ' ' ASP . . . . . . . . . . . . . 8.8 t0 178.95 167.97 0.93 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.154 178.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -91.25 -53.39 2.18 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 121.21 -0.519 . . . . 0.0 111.831 178.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 6.6 m -58.23 -32.12 43.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.73 0.3 . . . . 0.0 111.707 -179.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -68.23 -20.1 64.79 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.41 -177.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -67.39 -39.9 85.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.171 0.51 . . . . 0.0 110.059 176.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 861' ' ' LEU . . . . . 0.534 HD12 ' HG ' ' A' ' 893' ' ' LEU . 0.2 OUTLIER -74.31 -37.37 63.64 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.126 176.784 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -65.37 -43.26 91.36 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.137 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 863' ' ' VAL . . . . . 0.644 ' HA ' ' HB2' ' A' ' 866' ' ' LYS . 9.3 p -71.88 -31.54 41.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.739 -0.209 . . . . 0.0 110.662 179.229 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 864' ' ' LEU . . . . . 0.405 ' HA ' HD23 ' A' ' 864' ' ' LEU . 0.2 OUTLIER -57.92 -36.06 71.95 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.175 0.512 . . . . 0.0 109.886 173.546 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 3.6 m -87.13 -16.7 34.67 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.718 178.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 866' ' ' LYS . . . . . 0.644 ' HB2' ' HA ' ' A' ' 863' ' ' VAL . 17.8 mttt -70.76 -55.42 8.65 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.39 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -143.67 -174.81 4.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.197 179.225 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -98.03 125.31 42.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.076 0.465 . . . . 0.0 111.354 -177.064 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 869' ' ' ILE . . . . . 0.627 HG21 ' HB2' ' A' ' 828' ' ' LEU . 3.4 mp -122.27 148.54 25.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.825 179.288 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -94.58 -58.79 2.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.782 0.325 . . . . 0.0 111.314 -176.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 871' ' ' ILE . . . . . 0.621 HG13 ' HG2' ' A' ' 898' ' ' PRO . 0.9 OUTLIER -116.27 135.72 55.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 179.227 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 872' ' ' VAL . . . . . 0.632 HG22 HD12 ' A' ' 828' ' ' LEU . 97.3 t -119.08 125.26 74.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.802 -178.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 873' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -109.79 116.0 30.87 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.908 0.385 . . . . 0.0 109.979 174.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -104.11 112.57 25.62 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 177.825 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 875' ' ' ASP . . . . . 0.8 ' HB3' ' HB2' ' A' ' 831' ' ' ASP . 58.6 t0 -109.52 124.54 51.26 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.576 -175.144 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -124.75 133.86 68.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.024 0.44 . . . . 0.0 110.721 -177.767 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 877' ' ' ASN . . . . . 0.484 ' HA ' ' HD2' ' A' ' 925' ' ' LYS . 0.1 OUTLIER -88.38 -18.32 28.65 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.067 176.886 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 28.1 mmt -102.06 156.52 35.13 Favored Pre-proline 0 C--N 1.321 -0.665 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.85 179.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 879' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -58.79 164.26 9.97 Favored 'Trans proline' 0 C--O 1.236 0.415 0 C-N-CA 122.775 2.317 . . . . 0.0 112.128 176.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 10.4 t30 -76.01 54.63 0.86 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.277 0.56 . . . . 0.0 111.749 -175.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 1.2 tpp -95.58 -40.53 9.38 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.002 177.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -84.54 -34.29 23.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.894 177.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -80.36 59.54 4.59 Favored Glycine 0 C--O 1.223 -0.566 0 CA-C-N 115.465 -0.789 . . . . 0.0 113.025 -176.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 22.2 t80 -118.16 -50.37 2.47 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 173.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 885' ' ' ARG . . . . . 0.405 ' O ' ' HB2' ' A' ' 889' ' ' ARG . 0.0 OUTLIER -64.53 -34.44 78.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.438 179.067 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -62.54 -52.76 62.17 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 116.253 -0.43 . . . . 0.0 109.848 177.19 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 887' ' ' THR . . . . . 0.525 HG21 ' HE2' ' A' ' 919' ' ' MET . 0.0 OUTLIER -60.67 -42.79 97.79 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.171 0.51 . . . . 0.0 111.094 -178.849 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 888' ' ' GLN . . . . . 0.406 ' OE1' ' HA ' ' A' ' 888' ' ' GLN . 2.5 tp-100 -62.66 -42.81 99.82 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.892 178.592 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 889' ' ' ARG . . . . . 0.505 ' HD3' ' HA ' ' A' ' 889' ' ' ARG . 0.0 OUTLIER -71.82 -44.18 64.34 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.546 -176.32 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 890' ' ' ILE . . . . . 0.45 HG23 ' N ' ' A' ' 891' ' ' ARG . 3.3 tt -67.08 -37.54 79.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.826 -0.17 . . . . 0.0 111.449 -176.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 891' ' ' ARG . . . . . 0.79 ' HA ' ' HB2' ' A' ' 895' ' ' LEU . 5.6 ptm180 -72.01 -35.49 69.45 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.808 -0.357 . . . . 0.0 110.493 178.602 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -73.24 -22.71 60.36 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.994 -179.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 893' ' ' LEU . . . . . 0.534 ' HG ' HD12 ' A' ' 861' ' ' LEU . 0.1 OUTLIER -82.53 0.94 40.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.131 -178.538 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 101.11 51.45 1.15 Allowed Glycine 0 N--CA 1.448 -0.511 0 CA-C-N 115.712 -0.677 . . . . 0.0 112.484 176.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 895' ' ' LEU . . . . . 0.79 ' HB2' ' HA ' ' A' ' 891' ' ' ARG . 0.4 OUTLIER -72.91 114.21 10.81 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.975 0.417 . . . . 0.0 110.34 178.435 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -120.66 -12.74 8.83 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.075 -179.789 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 897' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -100.08 153.5 37.73 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.474 -175.877 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 898' ' ' PRO . . . . . 0.621 ' HG2' HG13 ' A' ' 871' ' ' ILE . 55.1 Cg_endo -71.12 126.56 12.54 Favored 'Trans proline' 0 C--O 1.239 0.527 0 C-N-CA 122.592 2.195 . . . . 0.0 112.697 -178.913 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 899' ' ' VAL . . . . . 0.734 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 97.7 t -112.4 119.38 60.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.117 177.305 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 900' ' ' ILE . . . . . . . . . . . . . 5.5 mt -95.8 115.58 35.3 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.977 179.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -95.06 93.79 1.66 Allowed Glycine 0 N--CA 1.444 -0.796 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.666 -174.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 902' ' ' VAL . . . . . 0.597 ' O ' ' HA ' ' A' ' 875' ' ' ASP . 1.3 t -76.8 125.24 36.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 175.584 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -139.35 149.24 43.93 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.233 0.539 . . . . 0.0 111.134 -179.019 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -71.13 113.67 8.41 Favored 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 168.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -52.43 102.64 0.05 Allowed 'General case' 0 C--O 1.234 0.246 0 O-C-N 123.463 0.477 . . . . 0.0 110.531 -176.161 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -102.53 -77.68 0.55 Allowed 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.824 -174.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 5.7 mt -147.9 -86.97 0.09 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.847 0.356 . . . . 0.0 111.748 -176.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 908' ' ' ALA . . . . . 0.4 ' O ' ' HG2' ' A' ' 912' ' ' GLN . . . -102.0 24.88 9.4 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -170.073 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -56.73 -33.46 66.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.97 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 910' ' ' GLU . . . . . 0.503 ' H ' ' HG3' ' A' ' 910' ' ' GLU . 0.0 OUTLIER -63.21 -50.89 68.46 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.667 179.14 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -58.21 -47.73 82.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.822 178.215 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 912' ' ' GLN . . . . . 0.4 ' HG2' ' O ' ' A' ' 908' ' ' ALA . 10.7 mm100 -61.14 -45.73 93.46 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.227 -178.211 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 913' ' ' ARG . . . . . 0.596 ' HA ' ' HE3' ' A' ' 919' ' ' MET . 0.0 OUTLIER -55.78 -44.35 77.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.225 -178.729 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 10.8 m -73.83 -34.04 64.38 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.161 -178.37 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 2.8 tp -70.31 -40.47 74.21 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.796 0.331 . . . . 0.0 111.4 -178.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -77.95 -44.5 26.64 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.122 179.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 50.45 45.1 26.76 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.8 -0.637 . . . . 0.0 111.278 -177.635 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -116.42 24.68 9.65 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.814 -0.708 . . . . 0.0 111.948 -179.011 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 919' ' ' MET . . . . . 0.734 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -137.0 -100.44 0.2 Allowed 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 179.555 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 920' ' ' ASP . . . . . 0.426 ' H ' ' HB2' ' A' ' 919' ' ' MET . 15.4 t70 171.46 -64.96 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.45 175.358 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -121.59 175.34 6.27 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.649 -177.532 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 922' ' ' CYS . . . . . 0.471 ' SG ' ' HD2' ' A' ' 913' ' ' ARG . 0.4 OUTLIER -137.14 135.26 37.22 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.325 176.78 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 923' ' ' LEU . . . . . 0.506 HD13 HG21 ' A' ' 935' ' ' THR . 13.7 mt -120.67 167.62 12.25 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.284 -179.029 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -93.43 135.01 35.09 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 174.748 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 925' ' ' LYS . . . . . 0.531 ' HZ2' ' CG ' ' A' ' 875' ' ' ASP . 0.1 OUTLIER -49.16 -44.17 71.76 Favored Pre-proline 0 CA--C 1.539 0.555 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -177.647 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -66.01 75.85 0.33 Allowed 'Trans proline' 0 C--N 1.356 0.935 0 C-N-CA 122.03 1.82 . . . . 0.0 112.402 174.215 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -87.96 159.43 3.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.395 179.495 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 928' ' ' THR . . . . . 0.459 ' O ' ' HB ' ' A' ' 932' ' ' ILE . 0.0 OUTLIER -131.97 172.9 11.77 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.639 -179.623 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 929' ' ' LEU . . . . . 0.874 HD21 ' HG3' ' A' ' 843' ' ' GLN . 1.3 tm? -61.67 -48.25 81.68 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.695 0.283 . . . . 0.0 111.699 -176.201 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -78.01 -32.0 50.89 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.864 -0.334 . . . . 0.0 111.327 -175.264 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -74.74 -36.19 39.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 C-N-CA 120.964 -0.295 . . . . 0.0 110.667 179.48 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 932' ' ' ILE . . . . . 0.576 HG21 ' HB3' ' A' ' 843' ' ' GLN . 0.4 OUTLIER -69.03 -34.73 65.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 174.611 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.9 -46.01 91.23 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.991 -0.55 . . . . 0.0 109.876 174.508 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -54.81 -58.27 8.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.766 177.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 935' ' ' THR . . . . . 0.506 HG21 HD13 ' A' ' 923' ' ' LEU . 1.9 m -57.55 -51.46 69.39 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.96 -178.363 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 936' ' ' LEU . . . . . . . . . . . . . 1.8 tp -61.68 -45.72 92.79 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.513 -177.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 41.3 m -67.4 -36.31 81.05 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.377 -178.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 938' ' ' LEU . . . . . 0.44 ' O ' ' HG3' ' A' ' 941' ' ' GLU . 3.6 tp -71.43 -36.64 71.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.158 0.504 . . . . 0.0 111.307 -178.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 939' ' ' TYR . . . . . 0.683 ' HA ' ' HB2' ' A' ' 942' ' ' ARG . 40.0 m-85 -86.49 -25.63 25.03 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 121.877 -0.514 . . . . 0.0 111.521 -178.076 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -67.53 -39.82 85.04 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.947 0.403 . . . . 0.0 110.282 173.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 941' ' ' GLU . . . . . 0.44 ' HG3' ' O ' ' A' ' 938' ' ' LEU . 0.2 OUTLIER -72.53 -27.91 62.53 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 174.647 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 942' ' ' ARG . . . . . 0.683 ' HB2' ' HA ' ' A' ' 939' ' ' TYR . 0.0 OUTLIER -60.5 -49.42 77.63 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.881 -179.578 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 6.5 m -72.46 -31.87 39.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.711 178.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.61 -36.17 82.94 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.226 -179.404 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.58 -23.51 29.61 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.596 0.236 . . . . 0.0 111.067 179.393 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 51.0 m -72.66 -39.03 67.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.129 0.49 . . . . 0.0 109.963 177.004 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 2.3 mtp180 -84.35 -30.05 25.8 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.579 177.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 58.63 77.27 0.31 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.466 -175.256 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 13.0 m . . . . . 0 C--O 1.253 1.26 0 CA-C-N 114.966 -1.015 . . . . 0.0 110.889 -178.3 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.935 0 CA-C-O 120.8 0.334 . . . . 0.0 110.276 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 143.41 92.77 0.17 Allowed Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 111.254 -0.738 . . . . 0.0 111.254 -179.065 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . -113.39 152.37 18.03 Favored Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.997 -0.621 . . . . 0.0 112.773 -177.519 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -107.56 135.27 49.3 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.634 0.254 . . . . 0.0 110.357 179.354 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . -134.41 145.67 17.73 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.896 -0.669 . . . . 0.0 112.111 -178.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 10.1 t 59.55 77.77 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-O 121.248 0.547 . . . . 0.0 110.587 -179.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -80.58 -77.22 0.2 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.845 -178.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 703' ' ' GLY . . . . . 0.462 ' O ' ' HE2' ' A' ' 707' ' ' LYS . . . -128.92 -84.67 0.41 Allowed Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.018 -179.448 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.741 HD11 ' HB3' ' A' ' 729' ' ' SER . 58.0 mt -79.63 73.4 6.33 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.252 0.549 . . . . 0.0 110.184 -179.003 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -151.81 70.41 0.94 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.933 -178.369 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 119.31 20.72 3.9 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.269 -178.134 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 707' ' ' LYS . . . . . 0.654 ' HB2' HG12 ' A' ' 731' ' ' ILE . 15.0 mmtt -81.79 165.38 20.95 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 177.67 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 708' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -121.01 130.51 53.82 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -172.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -118.02 111.71 19.29 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.345 177.074 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 710' ' ' TRP . . . . . 0.437 ' O ' HD23 ' A' ' 747' ' ' LEU . 98.3 m95 -97.24 112.08 24.04 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 175.337 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 711' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -121.87 131.64 54.14 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.16 0.505 . . . . 0.0 111.285 -174.741 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -125.23 57.57 1.3 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.598 179.152 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 713' ' ' VAL . . . . . 0.797 ' HA ' ' HB2' ' A' ' 750' ' ' ASP . 12.5 t -103.97 125.15 58.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.566 -177.004 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 714' ' ' ARG . . . . . 0.47 ' NH2' ' HG3' ' A' ' 751' ' ' GLU . 18.9 mtm180 -82.66 -38.38 23.54 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.029 0.442 . . . . 0.0 109.883 179.262 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -65.83 102.75 0.8 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.74 176.03 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 716' ' ' ALA . . . . . 0.495 ' HA ' ' HB3' ' A' ' 719' ' ' CYS . . . -63.63 -26.32 68.62 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.071 -174.856 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 4.3 m -65.01 -46.22 82.3 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.118 0.485 . . . . 0.0 109.913 176.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 718' ' ' LEU . . . . . 0.548 HD12 ' HA ' ' A' ' 786' ' ' ALA . 0.9 OUTLIER -74.14 -39.57 63.2 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.543 178.385 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 719' ' ' CYS . . . . . 0.633 ' HB2' ' HB ' ' A' ' 713' ' ' VAL . 0.7 OUTLIER -59.59 -51.56 69.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.7 179.683 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 720' ' ' GLN . . . . . 0.776 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -64.99 -33.7 76.67 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.524 -179.383 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -54.73 -55.8 26.07 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.172 0.511 . . . . 0.0 110.145 177.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -68.26 -48.5 64.9 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.177 -177.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 723' ' ' GLU . . . . . 0.776 ' HG2' ' HA ' ' A' ' 720' ' ' GLN . 10.4 pt-20 -60.77 -41.86 96.33 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 111.601 0.222 . . . . 0.0 111.601 -174.495 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 724' ' ' THR . . . . . . . . . . . . . 53.7 m -67.35 -44.37 79.2 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.948 0.404 . . . . 0.0 110.732 -179.239 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 74.0 m -66.57 -39.48 88.51 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.717 -177.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 726' ' ' LEU . . . . . 0.546 HD21 HD11 ' A' ' 731' ' ' ILE . 67.1 mt -74.96 -39.37 61.36 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.264 -178.253 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 1.6 pp0? -72.07 -23.75 61.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.792 -0.185 . . . . 0.0 111.062 -179.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 9.1 ptt85 -66.74 -22.25 66.05 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 121.278 0.561 . . . . 0.0 110.42 177.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 729' ' ' SER . . . . . 0.741 ' HB3' HD11 ' A' ' 704' ' ' LEU . 19.9 m -88.01 -78.39 0.32 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.299 179.695 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 730' ' ' GLY . . . . . 0.536 ' HA3' ' O ' ' A' ' 704' ' ' LEU . . . 177.76 39.85 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 111.053 -0.819 . . . . 0.0 111.053 179.176 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 731' ' ' ILE . . . . . 0.654 HG12 ' HB2' ' A' ' 707' ' ' LYS . 27.0 mt -119.24 127.98 75.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 115.165 -0.518 . . . . 0.0 110.165 -177.454 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 732' ' ' VAL . . . . . 0.5 HG21 ' O ' ' A' ' 707' ' ' LYS . 10.6 m -81.21 118.45 29.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.339 0.59 . . . . 0.0 110.538 179.311 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 733' ' ' VAL . . . . . 0.432 HG13 ' HB2' ' A' ' 723' ' ' GLU . 21.9 t -89.71 125.04 42.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.628 -178.105 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 734' ' ' THR . . . . . 0.425 ' HB ' ' CZ3' ' A' ' 710' ' ' TRP . 0.3 OUTLIER -133.11 136.26 45.72 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.438 0.637 . . . . 0.0 110.571 -178.898 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.29 113.56 3.68 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.759 -1.11 . . . . 0.0 111.075 178.145 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -80.09 78.95 6.7 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.455 0.645 . . . . 0.0 109.605 176.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -78.36 -28.78 47.17 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.031 179.694 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 164.89 55.08 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.53 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 179.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 17.3 mp0 -96.63 -171.41 2.26 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.851 0.358 . . . . 0.0 111.331 -174.058 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -98.94 147.37 33.12 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.776 -176.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 741' ' ' PRO . . . . . 0.625 ' HA ' ' CZ3' ' A' ' 757' ' ' TRP . 73.0 Cg_endo -78.43 131.1 10.35 Favored 'Trans proline' 0 N--CA 1.463 -0.314 0 C-N-CA 122.825 2.35 . . . . 0.0 113.132 179.266 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 742' ' ' THR . . . . . 0.664 HG23 ' HD2' ' A' ' 743' ' ' PRO . 0.2 OUTLIER -118.21 135.39 23.49 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.394 176.411 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 743' ' ' PRO . . . . . 0.855 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 19.6 Cg_endo -60.7 -18.15 53.8 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 123.149 2.566 . . . . 0.0 113.152 -177.64 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -105.89 10.52 32.43 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.55 -0.296 . . . . 0.0 110.608 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -118.74 156.31 29.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.203 -174.342 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 1.5 m -122.29 147.67 26.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.277 -178.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 747' ' ' LEU . . . . . 0.437 HD23 ' O ' ' A' ' 710' ' ' TRP . 0.3 OUTLIER -118.13 134.65 54.8 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.97 178.944 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 748' ' ' ILE . . . . . 0.403 HG21 ' HB ' ' A' ' 763' ' ' VAL . 0.0 OUTLIER -127.58 107.79 17.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 172.846 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 749' ' ' THR . . . . . 0.563 HG22 ' HA ' ' A' ' 764' ' ' THR . 1.4 t -109.07 146.04 34.66 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.467 0.651 . . . . 0.0 112.016 -172.629 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 750' ' ' ASP . . . . . 0.797 ' HB2' ' HA ' ' A' ' 713' ' ' VAL . 59.8 t0 -91.88 108.56 20.01 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.968 -1.015 . . . . 0.0 109.442 175.569 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 751' ' ' GLU . . . . . 0.47 ' HG3' ' NH2' ' A' ' 714' ' ' ARG . 3.1 mm-40 63.47 -159.74 0.31 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.865 -174.858 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 752' ' ' VAL . . . . . . . . . . . . . 3.8 t -86.58 119.78 35.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.02 0.438 . . . . 0.0 112.099 -170.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 3.4 m -107.51 -3.31 10.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.462 172.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 13.0 m 53.88 55.02 8.93 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.61 -179.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.48 137.62 52.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.541 -179.335 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 756' ' ' LYS . . . . . 0.453 ' HZ2' ' CD ' ' A' ' 780' ' ' GLU . 20.7 tptt -100.4 87.48 3.41 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.346 0.593 . . . . 0.0 109.674 176.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 757' ' ' TRP . . . . . 0.625 ' CZ3' ' HA ' ' A' ' 741' ' ' PRO . 76.1 t-105 -67.93 106.03 2.19 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.631 -178.747 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.95 87.83 6.36 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 173.64 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 759' ' ' GLY . . . . . 0.855 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -159.18 -139.58 2.71 Favored Glycine 0 N--CA 1.444 -0.811 0 C-N-CA 120.512 -0.852 . . . . 0.0 112.377 -178.159 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -71.18 -55.64 7.73 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.989 -0.284 . . . . 0.0 110.573 178.6 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -170.59 150.69 3.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.874 179.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 762' ' ' VAL . . . . . 0.512 HG13 ' HB3' ' A' ' 757' ' ' TRP . 4.5 p -130.23 127.44 63.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.248 175.446 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 763' ' ' VAL . . . . . 0.566 HG11 HD23 ' A' ' 791' ' ' LEU . 85.6 t -112.46 128.65 69.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.515 178.455 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 764' ' ' THR . . . . . 0.563 ' HA ' HG22 ' A' ' 749' ' ' THR . 35.5 m -109.17 118.27 36.31 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.105 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 765' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -84.51 107.29 16.67 Favored 'General case' 0 C--O 1.223 -0.313 0 N-CA-C 109.813 -0.439 . . . . 0.0 109.813 177.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.06 134.31 36.61 Favored 'General case' 0 C--N 1.317 -0.848 0 C-N-CA 120.844 -0.343 . . . . 0.0 110.196 -175.474 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.79 -65.35 1.07 Allowed 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.803 -0.359 . . . . 0.0 111.312 -179.632 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 3.7 mtp85 -143.67 -4.82 0.84 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -176.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 2.3 m170 -84.17 -67.74 0.77 Allowed 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.294 -0.562 . . . . 0.0 110.863 -178.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 770' ' ' ILE . . . . . 0.516 HG21 ' N ' ' A' ' 771' ' ' GLY . 25.4 mt 68.65 144.6 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 CA-C-O 121.202 0.525 . . . . 0.0 111.395 -179.447 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 771' ' ' GLY . . . . . 0.516 ' N ' HG21 ' A' ' 770' ' ' ILE . . . 158.88 -32.2 0.47 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.825 -0.703 . . . . 0.0 111.624 -178.297 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 772' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -82.09 154.24 69.73 Favored Pre-proline 0 C--N 1.324 -0.531 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 176.136 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 773' ' ' PRO . . . . . 0.476 ' HB2' ' H ' ' A' ' 774' ' ' LEU . 12.7 Cg_exo -70.58 -119.88 0.01 OUTLIER 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.792 2.328 . . . . 0.0 112.913 -179.732 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . 0.917 ' HA ' HG11 ' A' ' 782' ' ' VAL . 1.1 pt? 178.25 -167.04 0.06 Allowed 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 122.676 0.39 . . . . 0.0 110.105 -177.606 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 775' ' ' GLU . . . . . 0.708 ' HG3' ' HA ' ' A' ' 781' ' ' TRP . 2.4 mp0 -63.03 68.87 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 121.603 0.716 . . . . 0.0 112.631 174.472 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -127.82 6.61 6.11 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 114.642 -1.163 . . . . 0.0 108.214 171.712 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -145.42 144.3 22.61 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 114.314 -1.312 . . . . 0.0 108.946 179.233 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -60.62 100.57 0.16 Allowed 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 122.496 2.131 . . . . 0.0 112.97 -177.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 779' ' ' GLY . . . . . 0.467 ' O ' HG11 ' A' ' 762' ' ' VAL . . . 116.75 -3.92 19.36 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.996 176.436 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 780' ' ' GLU . . . . . 0.616 ' O ' ' HG3' ' A' ' 775' ' ' GLU . 10.2 tt0 -103.71 123.67 47.45 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 -177.296 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 781' ' ' TRP . . . . . 0.708 ' HA ' ' HG3' ' A' ' 775' ' ' GLU . 23.2 m95 -134.76 137.41 43.41 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 -179.606 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . 0.917 HG11 ' HA ' ' A' ' 774' ' ' LEU . 3.6 m -136.28 151.65 28.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 120.775 0.322 . . . . 0.0 110.29 173.075 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 783' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -167.5 129.18 1.56 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.477 -0.328 . . . . 0.0 110.492 178.858 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.61 101.92 11.11 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 174.255 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 785' ' ' VAL . . . . . 0.691 HG11 ' H ' ' A' ' 787' ' ' ALA . 1.8 p -170.91 168.15 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.202 -175.802 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 786' ' ' ALA . . . . . 0.548 ' HA ' HD12 ' A' ' 718' ' ' LEU . . . -108.58 27.78 9.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.754 0.311 . . . . 0.0 110.781 -179.677 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 787' ' ' ALA . . . . . 0.691 ' H ' HG11 ' A' ' 785' ' ' VAL . . . 49.12 57.27 18.35 Favored Pre-proline 0 N--CA 1.47 0.527 0 CA-C-N 115.209 -0.905 . . . . 0.0 112.905 178.877 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 788' ' ' PRO . . . . . 0.51 ' HD3' ' N ' ' A' ' 787' ' ' ALA . 2.7 Cg_exo -76.35 -42.26 0.39 Allowed 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 122.285 1.99 . . . . 0.0 113.414 -178.049 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 4.9 p-80 -151.64 -14.62 0.2 Allowed 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 -170.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 790' ' ' GLU . . . . . 0.438 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -112.75 -41.92 3.71 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -169.393 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 791' ' ' LEU . . . . . 0.566 HD23 HG11 ' A' ' 763' ' ' VAL . 0.3 OUTLIER -67.89 -50.42 33.04 Favored Pre-proline 0 C--N 1.325 -0.487 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.035 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 792' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -63.9 -26.73 66.94 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 121.3 1.333 . . . . 0.0 111.411 179.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -75.0 -39.11 61.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.33 176.359 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 794' ' ' LEU . . . . . 0.432 HD21 ' HA ' ' A' ' 794' ' ' LEU . 1.1 tm? -62.66 -41.07 98.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.76 176.382 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 795' ' ' LEU . . . . . 0.522 HD13 HD11 ' A' ' 726' ' ' LEU . 0.2 OUTLIER -60.26 -45.53 92.96 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.454 177.624 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -63.54 -38.72 92.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.925 178.456 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 797' ' ' ARG . . . . . 0.483 ' HA ' HD11 ' A' ' 800' ' ' LEU . 0.0 OUTLIER -67.18 -32.71 73.98 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.9 0.381 . . . . 0.0 110.526 178.959 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -70.77 -28.04 32.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.063 0.459 . . . . 0.0 110.694 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 799' ' ' TYR . . . . . 0.513 ' CE2' ' HB3' ' A' ' 707' ' ' LYS . 0.2 OUTLIER -104.26 9.32 36.06 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.171 176.882 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 800' ' ' LEU . . . . . 0.483 HD11 ' HA ' ' A' ' 797' ' ' ARG . 3.9 mt -76.07 -18.68 59.1 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 177.121 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 801' ' ' ILE . . . . . 0.448 HG22 HD11 ' A' ' 801' ' ' ILE . 1.5 mm 56.06 54.55 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 CA-C-O 122.356 1.074 . . . . 0.0 110.322 176.766 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 802' ' ' GLU . . . . . 0.401 ' H ' ' HG3' ' A' ' 802' ' ' GLU . 0.0 OUTLIER -88.22 48.93 1.71 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.275 -1.329 . . . . 0.0 110.745 -176.373 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 803' ' ' MET . . . . . 0.506 ' O ' ' HG2' ' A' ' 803' ' ' MET . 0.0 OUTLIER -138.97 133.04 31.24 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.861 -179.075 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 804' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -170.05 -175.45 2.02 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.549 175.827 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 52.73 -94.97 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 123.557 0.743 . . . . 0.0 111.86 -176.322 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 806' ' ' ASP . . . . . 0.435 ' O ' ' HD3' ' A' ' 808' ' ' PRO . 6.2 t70 -161.15 -37.3 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.767 -172.036 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -109.77 104.16 54.8 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.006 -173.406 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 808' ' ' PRO . . . . . 0.435 ' HD3' ' O ' ' A' ' 806' ' ' ASP . 6.0 Cg_exo -80.73 -46.77 0.08 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.449 0 C-N-CA 123.052 2.501 . . . . 0.0 111.644 169.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . 56.83 -154.36 0.34 Allowed 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.477 0.711 . . . . 0.0 112.627 178.066 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 810' ' ' ASN . . . . . 0.439 ' HB3' ' H ' ' A' ' 811' ' ' ALA . 2.1 t-20 63.85 -95.73 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.846 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 811' ' ' ALA . . . . . 0.439 ' H ' ' HB3' ' A' ' 810' ' ' ASN . . . -75.86 86.47 2.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.942 0.401 . . . . 0.0 110.95 -176.62 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 9.5 tp -148.63 96.25 3.88 Favored Pre-proline 0 C--N 1.322 -0.615 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.159 -178.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_exo -72.51 -65.57 0.03 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 122.678 2.252 . . . . 0.0 111.203 176.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -148.43 154.66 40.19 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.835 178.379 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.91 34.56 2.45 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.162 0.506 . . . . 0.0 111.082 -178.384 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -72.28 -22.68 61.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.494 -176.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 4.8 mttp -110.77 32.95 4.85 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.015 0.436 . . . . 0.0 110.613 179.744 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -80.89 126.66 31.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.286 -178.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 21.9 t -115.14 102.96 14.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.657 176.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -83.19 49.54 1.57 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.163 0.506 . . . . 0.0 110.914 -177.84 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -82.15 73.01 9.21 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.419 0.628 . . . . 0.0 110.672 -178.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -138.08 29.89 2.5 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.457 176.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -119.67 121.14 38.6 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.977 -1.01 . . . . 0.0 109.274 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -144.73 -93.23 0.1 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.043 -178.189 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 825' ' ' MET . . . . . 0.431 ' HB3' ' HE1' ' A' ' 849' ' ' TYR . 0.0 OUTLIER -93.28 129.92 39.18 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.02 179.508 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 826' ' ' MET . . . . . 0.498 ' HG3' ' O ' ' A' ' 868' ' ' HIS . 0.0 OUTLIER -124.54 139.25 54.06 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.561 0.696 . . . . 0.0 112.14 -174.777 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 827' ' ' ILE . . . . . 0.537 HG23 ' HB ' ' A' ' 871' ' ' ILE . 3.5 mm -121.25 137.43 54.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.051 -0.977 . . . . 0.0 109.534 177.894 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 13.5 tp -98.4 122.47 41.62 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 179.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 829' ' ' VAL . . . . . 0.418 HG11 HD11 ' A' ' 840' ' ' LEU . 0.0 OUTLIER -112.49 113.57 44.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 120.867 0.365 . . . . 0.0 110.424 -179.277 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 830' ' ' VAL . . . . . 0.499 ' HA ' ' O ' ' A' ' 854' ' ' ALA . 2.9 t -118.21 86.37 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.713 -177.247 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 831' ' ' ASP . . . . . 0.787 ' HA ' ' HB2' ' A' ' 875' ' ' ASP . 13.8 t70 -93.39 154.83 17.73 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.143 0.497 . . . . 0.0 111.475 -173.35 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 832' ' ' ASP . . . . . 1.051 ' HB3' ' HB ' ' A' ' 876' ' ' VAL . 0.0 OUTLIER -60.75 -33.67 73.28 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.818 -177.238 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 833' ' ' HIS . . . . . 0.634 ' HB2' ' ND2' ' A' ' 836' ' ' ASN . 34.8 m170 -136.4 138.61 27.36 Favored Pre-proline 0 N--CA 1.463 0.186 0 CA-C-O 120.517 0.198 . . . . 0.0 110.519 -178.822 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 834' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 833' ' ' HIS . 52.1 Cg_exo -56.12 -25.6 55.69 Favored 'Trans proline' 0 CA--C 1.532 0.415 0 C-N-CA 123.115 2.543 . . . . 0.0 113.511 -178.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -69.68 -48.18 66.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.946 0.403 . . . . 0.0 111.058 -179.092 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 836' ' ' ASN . . . . . 0.634 ' ND2' ' HB2' ' A' ' 833' ' ' HIS . 0.1 OUTLIER -74.35 -33.3 63.08 Favored 'General case' 0 CA--C 1.515 -0.396 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 178.508 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 837' ' ' ARG . . . . . 0.598 ' HA ' HD13 ' A' ' 840' ' ' LEU . 6.5 ttp180 -53.45 -43.2 67.89 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.193 175.042 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.75 -30.32 67.89 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.665 178.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.98 -49.13 66.36 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.312 178.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 840' ' ' LEU . . . . . 0.598 HD13 ' HA ' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -69.05 -32.94 72.79 Favored 'General case' 0 CA--C 1.521 -0.146 0 C-N-CA 120.704 -0.399 . . . . 0.0 110.139 178.216 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 841' ' ' ALA . . . . . 0.437 ' HB2' ' O ' ' A' ' 837' ' ' ARG . . . -64.97 -32.05 73.59 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.009 177.117 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.24 -42.62 88.35 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.04 0.447 . . . . 0.0 109.829 176.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 843' ' ' GLN . . . . . 0.575 ' HG3' HD23 ' A' ' 929' ' ' LEU . 0.0 OUTLIER -65.24 -46.88 78.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.842 178.868 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 844' ' ' LEU . . . . . 0.64 HD22 HD22 ' A' ' 936' ' ' LEU . 0.1 OUTLIER -59.18 -40.95 87.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.331 177.783 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -70.2 -27.39 72.92 Favored Glycine 0 N--CA 1.453 -0.205 0 C-N-CA 121.306 -0.473 . . . . 0.0 112.537 -179.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 18.4 m -79.34 -23.69 43.25 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.059 0.457 . . . . 0.0 110.449 177.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.04 -22.49 42.32 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.266 177.116 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 84.48 58.31 2.19 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.894 -0.669 . . . . 0.0 112.116 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 849' ' ' TYR . . . . . 0.431 ' HE1' ' HB3' ' A' ' 825' ' ' MET . 2.4 m-85 -132.75 147.26 52.32 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 29.1 mm-40 -72.99 115.39 12.24 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 176.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 851' ' ' CYS . . . . . 0.457 ' SG ' ' HB3' ' A' ' 844' ' ' LEU . 0.0 OUTLIER -109.48 136.08 49.45 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.986 0.422 . . . . 0.0 111.029 -176.277 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.3 116.45 31.03 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 173.757 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 853' ' ' THR . . . . . 0.473 ' HB ' ' CZ ' ' A' ' 837' ' ' ARG . 0.2 OUTLIER -91.02 134.11 34.76 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -171.464 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 854' ' ' ALA . . . . . 0.499 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -151.47 164.55 36.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.935 175.128 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 855' ' ' ASN . . . . . 0.536 ' O ' ' HB3' ' A' ' 856' ' ' ASP . 0.2 OUTLIER -153.5 74.02 0.99 Allowed 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.74 0.305 . . . . 0.0 110.978 176.63 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 856' ' ' ASP . . . . . 0.536 ' HB3' ' O ' ' A' ' 855' ' ' ASN . 4.3 p-10 163.82 173.65 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 124.28 1.032 . . . . 0.0 109.712 178.647 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -87.04 -44.2 5.75 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.732 -0.747 . . . . 0.0 113.898 -175.094 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 858' ' ' VAL . . . . . 0.454 ' H ' HG22 ' A' ' 858' ' ' VAL . 0.0 OUTLIER -67.5 -38.21 80.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 112.011 0.374 . . . . 0.0 112.011 -174.324 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -67.89 -37.28 81.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.914 0.388 . . . . 0.0 110.622 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 860' ' ' ALA . . . . . 0.418 ' O ' HG11 ' A' ' 863' ' ' VAL . . . -61.63 -38.83 89.1 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.417 177.577 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 861' ' ' LEU . . . . . 0.49 HD11 ' HB3' ' A' ' 889' ' ' ARG . 0.1 OUTLIER -74.73 -31.31 61.8 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.957 178.036 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -64.68 -49.75 69.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.301 177.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 863' ' ' VAL . . . . . 0.566 HG12 HD12 ' A' ' 869' ' ' ILE . 7.9 p -66.99 -31.2 52.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.428 177.638 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 864' ' ' LEU . . . . . 0.502 HD21 ' HA ' ' A' ' 864' ' ' LEU . 0.7 OUTLIER -65.63 -33.86 76.87 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.824 175.683 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 27.2 m -65.9 -37.79 87.04 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.072 0.463 . . . . 0.0 109.861 178.164 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.05 -28.7 68.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.721 174.016 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 7.2 t30 56.12 73.0 0.46 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 114.575 -1.193 . . . . 0.0 111.976 176.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 868' ' ' HIS . . . . . 0.498 ' O ' ' HG3' ' A' ' 826' ' ' MET . 64.7 m-70 -135.14 46.24 2.43 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 174.558 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 869' ' ' ILE . . . . . 0.566 HD12 HG12 ' A' ' 863' ' ' VAL . 2.0 mp -142.2 145.79 23.35 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.132 -0.94 . . . . 0.0 109.835 -177.896 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 870' ' ' ASP . . . . . 0.439 ' N ' HG22 ' A' ' 869' ' ' ILE . 0.4 OUTLIER -101.43 -52.42 3.24 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.88 0.372 . . . . 0.0 110.426 177.173 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 871' ' ' ILE . . . . . 0.537 ' HB ' HG23 ' A' ' 827' ' ' ILE . 38.4 mm -115.42 129.49 71.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.139 179.029 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 872' ' ' VAL . . . . . 0.897 HG22 HD11 ' A' ' 897' ' ' LEU . 9.7 t -106.53 124.39 62.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 120.728 0.299 . . . . 0.0 110.697 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 873' ' ' LEU . . . . . 0.421 ' HA ' ' O ' ' A' ' 900' ' ' ILE . 52.1 mt -109.96 132.34 54.25 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.141 -0.481 . . . . 0.0 109.719 174.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -120.8 95.2 4.61 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.065 0.459 . . . . 0.0 110.011 178.01 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 875' ' ' ASP . . . . . 0.787 ' HB2' ' HA ' ' A' ' 831' ' ' ASP . 0.9 OUTLIER -88.66 105.63 17.8 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.978 -179.512 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 876' ' ' VAL . . . . . 1.051 ' HB ' ' HB3' ' A' ' 832' ' ' ASP . 2.9 t 50.92 65.56 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.558 0.694 . . . . 0.0 111.519 -179.372 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -90.48 33.17 0.91 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.827 176.392 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 878' ' ' MET . . . . . 0.461 ' HE1' ' HB2' ' A' ' 878' ' ' MET . 4.7 tpp -100.16 112.5 64.22 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.162 -0.927 . . . . 0.0 109.473 179.861 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 879' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo -62.3 -58.82 0.31 Allowed 'Trans proline' 0 N--CA 1.462 -0.332 0 C-N-CA 122.704 2.269 . . . . 0.0 111.412 179.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -176.47 -60.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.586 178.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 4.2 tmm? -98.4 88.46 4.14 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.37 177.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 68.85 147.29 0.06 Allowed 'General case' 0 N--CA 1.468 0.454 0 O-C-N 123.886 0.741 . . . . 0.0 111.361 178.817 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -118.81 24.42 8.4 Favored Glycine 0 CA--C 1.51 -0.273 0 C-N-CA 120.845 -0.693 . . . . 0.0 111.39 177.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 6.5 p90 -80.31 -18.84 48.04 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.296 -0.452 . . . . 0.0 110.687 -171.566 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.89 -32.12 73.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.857 0.36 . . . . 0.0 110.344 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -72.62 -50.73 23.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.15 179.807 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 887' ' ' THR . . . . . 0.613 ' HB ' ' HB3' ' A' ' 916' ' ' GLU . 0.0 OUTLIER -63.28 -40.6 97.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.139 -179.144 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 40.0 tp60 -65.31 -42.77 92.68 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.331 178.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 889' ' ' ARG . . . . . 0.49 ' HB3' HD11 ' A' ' 861' ' ' LEU . 0.7 OUTLIER -64.86 -45.75 84.75 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.992 -178.401 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 890' ' ' ILE . . . . . 0.465 HD12 ' HG ' ' A' ' 864' ' ' LEU . 1.1 tt -69.05 -34.15 62.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.62 0.247 . . . . 0.0 111.017 -177.882 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 891' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.17 -23.07 57.68 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.905 0.383 . . . . 0.0 110.475 178.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 -77.84 -52.21 9.25 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.456 176.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.82 -60.53 3.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.852 -175.116 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 171.3 77.99 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.712 0 C-N-CA 120.394 -0.908 . . . . 0.0 112.02 -176.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 895' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -92.27 110.28 21.67 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.023 0.44 . . . . 0.0 110.071 178.843 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -123.25 -26.5 4.29 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.617 178.08 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 897' ' ' LEU . . . . . 0.897 HD11 HG22 ' A' ' 872' ' ' VAL . 2.5 pt? -97.52 151.9 37.89 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.349 -177.35 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -66.91 128.55 18.98 Favored 'Trans proline' 0 C--O 1.239 0.555 0 C-N-CA 122.763 2.309 . . . . 0.0 112.732 -177.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 899' ' ' VAL . . . . . 0.629 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 58.7 t -105.9 109.37 27.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.225 176.748 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 900' ' ' ILE . . . . . 0.421 ' O ' ' HA ' ' A' ' 873' ' ' LEU . 3.6 mp -101.01 114.39 39.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 178.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -112.57 116.47 4.05 Favored Glycine 0 N--CA 1.442 -0.916 0 C-N-CA 120.448 -0.882 . . . . 0.0 112.599 -174.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 902' ' ' VAL . . . . . 0.691 HG22 ' HA ' ' A' ' 925' ' ' LYS . 0.8 OUTLIER -89.55 138.71 18.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 108.76 -0.829 . . . . 0.0 108.76 176.031 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -138.27 160.5 39.3 Favored 'General case' 0 C--N 1.319 -0.739 0 O-C-N 121.957 -0.464 . . . . 0.0 111.686 -176.597 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -85.4 105.85 16.33 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.327 174.319 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 905' ' ' ASN . . . . . 0.444 ' HB3' ' H ' ' A' ' 906' ' ' ALA . 11.8 t-20 62.29 -96.41 0.06 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.778 -174.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 906' ' ' ALA . . . . . 0.486 ' O ' ' HG3' ' A' ' 909' ' ' GLU . . . 53.22 55.61 8.57 Favored 'General case' 0 N--CA 1.462 0.141 0 O-C-N 123.487 0.492 . . . . 0.0 111.05 -179.413 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 907' ' ' LEU . . . . . 0.529 ' O ' ' HB1' ' A' ' 908' ' ' ALA . 2.1 tp -49.31 143.1 6.65 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.394 -179.281 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 908' ' ' ALA . . . . . 0.529 ' HB1' ' O ' ' A' ' 907' ' ' LEU . . . 76.5 39.38 0.26 Allowed 'General case' 0 N--CA 1.465 0.315 0 O-C-N 124.33 1.018 . . . . 0.0 109.685 -173.898 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 909' ' ' GLU . . . . . 0.486 ' HG3' ' O ' ' A' ' 906' ' ' ALA . 1.0 OUTLIER -57.79 -45.41 86.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.951 -178.307 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 910' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.42 -44.17 88.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.586 179.077 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.54 -33.95 76.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.847 -178.469 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.17 -57.9 8.99 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.327 177.396 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.83 -33.46 71.79 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.37 -176.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 77.0 m -76.24 -33.53 59.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.116 179.398 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 4.6 tp -70.8 -47.75 57.85 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.868 0.365 . . . . 0.0 110.63 179.372 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 916' ' ' GLU . . . . . 0.613 ' HB3' ' HB ' ' A' ' 887' ' ' THR . 28.5 mt-10 -69.87 -27.51 64.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.155 -178.225 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.59 35.63 15.18 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.294 178.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -140.77 24.71 2.59 Favored Glycine 0 C--O 1.226 -0.351 0 C-N-CA 120.517 -0.849 . . . . 0.0 112.488 -179.002 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 919' ' ' MET . . . . . 0.629 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -125.29 -119.29 0.27 Allowed 'General case' 0 C--N 1.323 -0.577 0 O-C-N 122.812 -0.228 . . . . 0.0 110.686 -177.233 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 920' ' ' ASP . . . . . 0.403 ' H ' ' HB3' ' A' ' 919' ' ' MET . 20.1 t70 173.29 -68.28 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 123.683 0.793 . . . . 0.0 109.429 174.252 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 25.5 m -128.67 137.73 51.79 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.065 -177.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 922' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -103.42 129.89 50.63 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.54 -179.666 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 923' ' ' LEU . . . . . 0.404 HD22 ' HA ' ' A' ' 923' ' ' LEU . 14.3 mt -126.11 178.0 6.04 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.126 -179.763 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -108.27 148.04 30.57 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 176.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 925' ' ' LYS . . . . . 0.691 ' HA ' HG22 ' A' ' 902' ' ' VAL . 0.8 OUTLIER -67.16 -48.76 47.69 Favored Pre-proline 0 CA--C 1.533 0.316 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.298 177.881 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 926' ' ' PRO . . . . . 0.448 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 56.2 Cg_endo -71.58 64.88 3.01 Favored 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 121.914 1.743 . . . . 0.0 111.789 172.831 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -105.9 149.17 9.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.603 -178.801 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.91 153.9 40.8 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.89 179.688 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 929' ' ' LEU . . . . . 0.575 HD23 ' HG3' ' A' ' 843' ' ' GLN . 1.1 tm? -59.95 -31.78 70.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.005 -176.898 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -71.26 -26.53 62.93 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.971 -178.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 21.3 t -78.54 -44.98 26.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.839 -0.164 . . . . 0.0 111.314 -178.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 932' ' ' ILE . . . . . 0.419 HG21 ' O ' ' A' ' 929' ' ' LEU . 0.0 OUTLIER -60.61 -41.86 89.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 174.775 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -44.72 96.18 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.651 176.402 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 934' ' ' GLN . . . . . 0.538 ' O ' ' HB2' ' A' ' 938' ' ' LEU . 0.7 OUTLIER -58.16 -53.09 62.25 Favored 'General case' 0 C--O 1.222 -0.39 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.05 179.888 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 4.0 m -61.46 -43.23 99.24 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.812 0.339 . . . . 0.0 111.309 -177.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 936' ' ' LEU . . . . . 0.64 HD22 HD22 ' A' ' 844' ' ' LEU . 0.0 OUTLIER -64.55 -51.32 63.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.954 -179.178 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 24.0 m -66.61 -39.38 88.34 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.381 -176.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 938' ' ' LEU . . . . . 0.538 ' HB2' ' O ' ' A' ' 934' ' ' GLN . 0.3 OUTLIER -61.94 -47.46 84.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.813 -179.277 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -76.68 -32.78 58.14 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.002 -177.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -61.85 -49.38 76.48 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.86 0.362 . . . . 0.0 110.564 177.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 941' ' ' GLU . . . . . 0.586 ' O ' ' HB3' ' A' ' 945' ' ' LYS . 7.9 pt-20 -67.08 -30.71 70.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.36 179.29 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 942' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.71 -49.27 54.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.565 -178.443 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 18.5 m -70.38 -34.13 56.83 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 CA-C-O 121.263 0.554 . . . . 0.0 110.282 -178.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.56 -18.62 61.61 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.287 176.457 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 945' ' ' LYS . . . . . 0.586 ' HB3' ' O ' ' A' ' 941' ' ' GLU . 0.0 OUTLIER -85.17 -23.37 28.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.727 179.31 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -74.06 -39.74 63.28 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.971 0.415 . . . . 0.0 110.137 173.683 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 6.8 mtt180 -72.8 -50.01 26.97 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.202 176.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -117.03 102.44 9.34 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.977 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 C--O 1.251 1.142 0 CA-C-O 118.85 -0.595 . . . . 0.0 111.144 -174.975 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 0.98 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 178.68 -128.72 1.29 Allowed Glycine 0 N--CA 1.447 -0.633 0 N-CA-C 111.604 -0.599 . . . . 0.0 111.604 179.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . 92.37 94.84 1.4 Allowed Glycine 0 N--CA 1.448 -0.539 0 C-N-CA 120.828 -0.701 . . . . 0.0 111.805 179.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -83.78 103.03 12.74 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 120.86 0.362 . . . . 0.0 111.415 -177.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . -89.24 118.11 5.1 Favored Glycine 0 N--CA 1.449 -0.496 0 N-CA-C 110.391 -1.083 . . . . 0.0 110.391 172.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 18.0 m -132.97 157.07 42.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -172.28 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 76.22 157.05 0.18 Allowed 'General case' 0 C--O 1.234 0.271 0 CA-C-N 114.85 -1.068 . . . . 0.0 112.622 169.479 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . 89.94 -61.93 3.34 Favored Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 115.039 -0.982 . . . . 0.0 113.13 173.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.645 ' HA ' ' H ' ' A' ' 802' ' ' GLU . 1.5 mt 65.76 -74.62 0.06 Allowed 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -169.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 1.3 m 70.44 116.04 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 167.486 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 94.18 -11.19 70.93 Favored Glycine 0 C--N 1.33 0.238 0 CA-C-N 115.416 -0.811 . . . . 0.0 114.187 166.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 707' ' ' LYS . . . . . 0.46 ' O ' HG21 ' A' ' 732' ' ' VAL . 0.1 OUTLIER -81.85 142.16 32.78 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 117.377 0.589 . . . . 0.0 111.196 -176.968 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 708' ' ' ARG . . . . . 0.521 ' HG2' HG22 ' A' ' 732' ' ' VAL . 0.0 OUTLIER -95.18 143.1 26.88 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.164 178.87 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -117.82 119.06 33.73 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 174.78 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 710' ' ' TRP . . . . . . . . . . . . . 77.4 m95 -91.56 115.7 28.26 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 711' ' ' LEU . . . . . 0.43 HD11 ' HB2' ' A' ' 719' ' ' CYS . 0.7 OUTLIER -119.74 129.72 54.64 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.476 0.655 . . . . 0.0 110.945 -178.576 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -126.43 56.88 1.44 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.019 175.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 713' ' ' VAL . . . . . 0.76 HG12 ' HB3' ' A' ' 750' ' ' ASP . 24.0 t -107.23 118.3 54.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 115.031 -0.986 . . . . 0.0 109.713 179.158 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.46 -3.17 58.5 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.402 0.62 . . . . 0.0 110.005 -179.425 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 715' ' ' ASN . . . . . 0.588 ' HB3' ' HB2' ' A' ' 718' ' ' LEU . 1.8 m-80 -86.74 103.13 14.89 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.507 -0.769 . . . . 0.0 109.553 175.687 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 716' ' ' ALA . . . . . 0.527 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -54.6 -46.78 73.87 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -172.346 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.2 -39.42 93.95 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.141 0.496 . . . . 0.0 110.714 -179.756 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 718' ' ' LEU . . . . . 0.595 HD22 ' HB2' ' A' ' 787' ' ' ALA . 0.2 OUTLIER -69.5 -50.06 48.82 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.089 -178.911 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 719' ' ' CYS . . . . . 0.7 ' HB3' ' HB ' ' A' ' 713' ' ' VAL . 31.9 p -67.61 -39.51 84.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.687 -176.411 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 720' ' ' GLN . . . . . 0.427 ' HA ' ' OE1' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -59.59 -43.98 93.51 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.335 178.277 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -59.33 -49.6 77.19 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.831 0.348 . . . . 0.0 110.998 -178.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 722' ' ' LEU . . . . . 0.408 HD23 ' HG3' ' A' ' 792' ' ' PRO . 4.8 mt -65.83 -45.34 82.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.785 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 723' ' ' GLU . . . . . 0.583 ' HG2' ' N ' ' A' ' 724' ' ' THR . 0.0 OUTLIER -57.82 -49.19 77.47 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.822 -177.204 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 724' ' ' THR . . . . . 0.583 ' N ' ' HG2' ' A' ' 723' ' ' GLU . 6.1 m -67.15 -36.77 82.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.304 -174.616 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 27.7 m -69.91 -35.95 74.98 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.02 0.438 . . . . 0.0 111.022 179.544 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 726' ' ' LEU . . . . . 0.561 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 29.4 mt -75.74 -44.16 43.18 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.305 -177.845 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.65 -25.88 65.05 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.888 0.375 . . . . 0.0 110.394 177.649 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 728' ' ' ARG . . . . . 0.578 ' HB2' ' O ' ' A' ' 724' ' ' THR . 0.0 OUTLIER -65.74 -33.57 76.17 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.582 175.57 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 19.0 m -85.4 -56.7 3.39 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.002 -177.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 730' ' ' GLY . . . . . . . . . . . . . . . 155.42 28.2 0.03 OUTLIER Glycine 0 N--CA 1.453 -0.172 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.617 -179.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 731' ' ' ILE . . . . . 0.561 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 11.1 mm -113.66 129.73 68.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 178.549 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 732' ' ' VAL . . . . . 0.521 HG22 ' HG2' ' A' ' 708' ' ' ARG . 3.9 m -85.62 114.83 26.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.445 0.641 . . . . 0.0 110.707 -179.203 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 733' ' ' VAL . . . . . 0.451 ' H ' HG22 ' A' ' 733' ' ' VAL . 0.0 OUTLIER -78.19 115.22 19.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.661 -177.637 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -121.92 126.37 48.49 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.434 179.705 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.41 127.84 34.14 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.911 177.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -73.59 90.79 1.8 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.303 0.573 . . . . 0.0 110.037 177.641 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -73.53 -73.75 0.2 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.085 176.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -168.74 63.56 0.19 Allowed Glycine 0 N--CA 1.449 -0.494 0 N-CA-C 111.078 -0.809 . . . . 0.0 111.078 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -103.67 155.2 18.75 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.62 0.248 . . . . 0.0 110.632 -175.403 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 740' ' ' GLU . . . . . 0.42 ' CD ' ' H ' ' A' ' 740' ' ' GLU . 1.5 pm0 -71.47 129.58 88.59 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 116.112 -0.494 . . . . 0.0 109.708 177.53 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 741' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -57.64 122.81 12.39 Favored 'Trans proline' 0 C--O 1.233 0.244 0 C-N-CA 122.938 2.425 . . . . 0.0 112.912 -175.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 742' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -93.78 129.23 38.77 Favored Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.146 176.717 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 743' ' ' PRO . . . . . 0.595 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 41.2 Cg_endo -67.22 -5.73 14.48 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 123.087 2.525 . . . . 0.0 113.328 -175.324 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -112.57 4.98 17.63 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.662 0.268 . . . . 0.0 110.62 176.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -112.6 157.99 20.53 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.167 0.508 . . . . 0.0 110.849 -175.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 746' ' ' VAL . . . . . 0.754 HG21 HD12 ' A' ' 795' ' ' LEU . 10.2 m -120.57 147.76 24.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.601 -178.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 747' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -119.78 107.82 13.65 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.098 178.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 748' ' ' ILE . . . . . 0.437 HD13 ' HG ' ' A' ' 795' ' ' LEU . 6.7 mt -94.66 108.44 20.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 176.202 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 749' ' ' THR . . . . . 0.411 HG22 HG12 ' A' ' 753' ' ' VAL . 4.8 t -121.36 165.52 15.41 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.655 -0.248 . . . . 0.0 110.63 -176.154 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 750' ' ' ASP . . . . . 0.76 ' HB3' HG12 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -122.93 148.22 45.71 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.032 0.444 . . . . 0.0 111.306 179.357 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 61.2 -119.64 0.77 Allowed 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.064 -177.032 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 752' ' ' VAL . . . . . . . . . . . . . 29.9 t -125.51 93.8 2.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.041 0.448 . . . . 0.0 111.002 -175.542 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 753' ' ' VAL . . . . . 0.411 HG12 HG22 ' A' ' 749' ' ' THR . 9.8 p -74.74 -21.96 17.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.868 178.162 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 55.42 53.95 9.19 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.108 -179.025 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.25 134.33 32.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.847 -177.622 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -90.25 85.9 6.36 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 175.558 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 77.1 t-105 -68.97 94.47 0.64 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.901 179.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 61.2 mt-30 -82.61 67.59 8.72 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.298 0.57 . . . . 0.0 109.964 176.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 759' ' ' GLY . . . . . 0.595 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -128.91 -136.9 4.22 Favored Glycine 0 N--CA 1.44 -1.071 0 CA-C-N 115.64 -0.709 . . . . 0.0 112.188 -178.44 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 7.5 ttm-85 -86.43 -47.84 8.96 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.818 0.342 . . . . 0.0 110.456 178.1 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 761' ' ' ALA . . . . . 0.411 ' O ' ' HA ' ' A' ' 746' ' ' VAL . . . -164.66 138.42 5.08 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.921 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 2.4 p -113.92 130.53 67.92 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 172.44 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 763' ' ' VAL . . . . . 0.442 HG12 HD11 ' A' ' 791' ' ' LEU . 0.7 OUTLIER -115.65 113.13 42.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-O 120.971 0.415 . . . . 0.0 110.5 -178.032 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 764' ' ' THR . . . . . 0.466 HG21 HG13 ' A' ' 772' ' ' ILE . 44.5 m -102.66 112.78 25.71 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.983 -175.509 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 765' ' ' PHE . . . . . 0.721 ' HE1' HG23 ' A' ' 785' ' ' VAL . 6.2 m-85 -88.58 105.72 17.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.818 174.706 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.23 134.02 37.13 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.691 0.281 . . . . 0.0 110.949 -173.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 767' ' ' ARG . . . . . 0.411 ' HA ' ' HD3' ' A' ' 767' ' ' ARG . 0.1 OUTLIER -112.66 -64.52 1.29 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.114 -178.092 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.15 -31.97 3.52 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.783 0.325 . . . . 0.0 111.395 -176.152 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 9.6 t-80 -115.31 133.5 55.97 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.182 0.515 . . . . 0.0 110.779 -177.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 770' ' ' ILE . . . . . 0.521 HG23 ' H ' ' A' ' 771' ' ' GLY . 2.0 mt -106.07 158.77 6.28 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.459 176.322 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 771' ' ' GLY . . . . . 0.521 ' H ' HG23 ' A' ' 770' ' ' ILE . . . -175.78 -37.76 0.05 OUTLIER Glycine 0 CA--C 1.507 -0.468 0 N-CA-C 110.806 -0.918 . . . . 0.0 110.806 -178.823 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 772' ' ' ILE . . . . . 0.768 HG21 ' HD2' ' A' ' 773' ' ' PRO . 1.6 mm -83.8 133.92 45.36 Favored Pre-proline 0 C--N 1.324 -0.52 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 172.835 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 773' ' ' PRO . . . . . 0.768 ' HD2' HG21 ' A' ' 772' ' ' ILE . 23.6 Cg_endo -62.41 -92.86 0.0 OUTLIER 'Trans proline' 0 CA--C 1.535 0.531 0 C-N-CA 122.93 2.42 . . . . 0.0 113.75 -175.633 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . 0.711 ' HA ' HG12 ' A' ' 782' ' ' VAL . 1.3 pt? 165.98 -171.8 0.01 OUTLIER 'General case' 0 C--O 1.234 0.268 0 C-N-CA 123.147 0.579 . . . . 0.0 110.218 -174.569 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 775' ' ' GLU . . . . . 0.587 ' HG3' ' HA ' ' A' ' 781' ' ' TRP . 1.5 mp0 -62.07 69.18 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 O-C-N 123.834 0.709 . . . . 0.0 112.036 172.806 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 18.7 pttt -128.79 7.87 5.7 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 172.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 777' ' ' ALA . . . . . 0.41 ' HA ' ' HD3' ' A' ' 778' ' ' PRO . . . -145.07 149.37 41.84 Favored Pre-proline 0 N--CA 1.449 -0.515 0 CA-C-N 114.348 -1.296 . . . . 0.0 109.122 -179.157 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 778' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 777' ' ' ALA . 24.7 Cg_exo -64.16 93.92 0.19 Allowed 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.72 2.28 . . . . 0.0 112.407 -179.452 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 112.15 19.62 7.1 Favored Glycine 0 C--O 1.228 -0.255 0 C-N-CA 120.923 -0.656 . . . . 0.0 113.2 176.794 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 780' ' ' GLU . . . . . 0.522 ' O ' ' HA ' ' A' ' 775' ' ' GLU . 0.1 OUTLIER -119.73 124.88 47.29 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 177.593 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 781' ' ' TRP . . . . . 0.62 ' HZ3' HD13 ' A' ' 794' ' ' LEU . 17.0 m95 -137.24 136.02 37.73 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 -176.556 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . 0.711 HG12 ' HA ' ' A' ' 774' ' ' LEU . 32.6 m -129.69 155.67 41.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.981 0.419 . . . . 0.0 110.875 176.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 783' ' ' HIS . . . . . 0.53 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.2 OUTLIER -161.18 126.92 3.77 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.931 176.189 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -96.67 99.48 11.09 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 120.874 0.369 . . . . 0.0 110.03 177.703 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 785' ' ' VAL . . . . . 0.721 HG23 ' HE1' ' A' ' 765' ' ' PHE . 0.0 OUTLIER -171.24 -170.52 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.225 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -179.747 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 786' ' ' ALA . . . . . 0.471 ' HA ' HD11 ' A' ' 718' ' ' LEU . . . -123.67 56.72 1.2 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.733 0.301 . . . . 0.0 110.824 178.111 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 787' ' ' ALA . . . . . 0.595 ' HB2' HD22 ' A' ' 718' ' ' LEU . . . 53.57 63.23 8.31 Favored Pre-proline 0 N--CA 1.467 0.382 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.34 178.717 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 788' ' ' PRO . . . . . 0.616 ' HD2' ' OE1' ' A' ' 790' ' ' GLU . 5.2 Cg_exo -76.01 43.27 1.1 Allowed 'Trans proline' 0 CA--C 1.534 0.498 0 C-N-CA 123.086 2.524 . . . . 0.0 113.292 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 69.71 -0.02 2.82 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 171.0 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 790' ' ' GLU . . . . . 0.616 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -94.55 -46.08 7.13 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 121.882 -0.511 . . . . 0.0 111.305 -177.447 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 791' ' ' LEU . . . . . 0.493 HD13 ' CZ ' ' A' ' 765' ' ' PHE . 0.2 OUTLIER -58.82 -45.05 99.64 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -179.926 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 792' ' ' PRO . . . . . 0.408 ' HG3' HD23 ' A' ' 722' ' ' LEU . 51.7 Cg_exo -54.17 -31.87 67.7 Favored 'Trans proline' 0 C--N 1.356 0.941 0 C-N-CA 121.717 1.611 . . . . 0.0 111.974 175.917 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -70.44 -44.37 67.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.774 179.006 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 794' ' ' LEU . . . . . 0.62 HD13 ' HZ3' ' A' ' 781' ' ' TRP . 0.3 OUTLIER -71.55 -28.76 64.09 Favored 'General case' 0 C--O 1.219 -0.51 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.732 179.784 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 795' ' ' LEU . . . . . 0.754 HD12 HG21 ' A' ' 746' ' ' VAL . 0.1 OUTLIER -62.99 -39.42 94.69 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.116 0.484 . . . . 0.0 110.072 177.037 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -62.94 -48.85 77.13 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.262 177.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 797' ' ' ARG . . . . . 0.636 ' HA ' HD21 ' A' ' 800' ' ' LEU . 8.8 ptp180 -71.45 -32.99 68.95 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.684 -177.541 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 798' ' ' ILE . . . . . 0.425 ' HB ' ' O ' ' A' ' 794' ' ' LEU . 0.1 OUTLIER -60.95 -34.01 57.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.622 0.249 . . . . 0.0 111.061 175.569 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 799' ' ' TYR . . . . . 0.436 ' HD1' ' HA ' ' A' ' 799' ' ' TYR . 0.5 OUTLIER -83.19 -61.48 1.84 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.658 -0.246 . . . . 0.0 110.424 177.631 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 800' ' ' LEU . . . . . 0.636 HD21 ' HA ' ' A' ' 797' ' ' ARG . 0.2 OUTLIER 48.45 74.94 0.15 Allowed 'General case' 0 N--CA 1.468 0.436 0 O-C-N 123.666 0.604 . . . . 0.0 112.122 178.661 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 801' ' ' ILE . . . . . 0.475 HD13 HD22 ' A' ' 704' ' ' LEU . 1.4 mp -104.89 -50.14 8.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 178.62 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 802' ' ' GLU . . . . . 0.645 ' H ' ' HA ' ' A' ' 704' ' ' LEU . 1.0 OUTLIER 49.0 42.75 21.32 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.521 176.909 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 803' ' ' MET . . . . . 0.464 ' HB2' HG22 ' A' ' 801' ' ' ILE . 0.4 OUTLIER -81.87 138.16 35.11 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.166 -177.942 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 804' ' ' GLU . . . . . 0.428 ' H ' ' HG2' ' A' ' 804' ' ' GLU . 0.3 OUTLIER -74.31 107.41 6.46 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.016 178.663 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.64 170.26 14.86 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.186 0.517 . . . . 0.0 111.552 -177.361 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -139.36 -71.97 0.39 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.386 178.174 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 3.8 t70 52.54 81.13 0.27 Allowed Pre-proline 0 N--CA 1.468 0.454 0 O-C-N 123.597 0.561 . . . . 0.0 111.761 176.107 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 808' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.14 162.49 41.56 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.781 2.321 . . . . 0.0 112.71 -177.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -89.8 171.12 9.85 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.987 -179.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 33.9 t30 -151.9 142.74 22.96 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.14 179.047 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -125.71 151.29 46.81 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.995 0.426 . . . . 0.0 111.201 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -132.3 127.76 20.95 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.577 177.51 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -83.09 174.58 9.18 Favored 'Trans proline' 0 N--CA 1.462 -0.331 0 C-N-CA 123.016 2.477 . . . . 0.0 113.085 -176.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 1.2 m -135.98 145.38 46.09 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.915 176.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.87 82.8 1.83 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.391 0.615 . . . . 0.0 111.054 -179.2 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -90.72 154.55 19.46 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.07 -178.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.36 165.54 35.49 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 120.777 0.323 . . . . 0.0 110.966 -178.925 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -144.93 140.97 28.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.947 175.564 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -119.17 118.22 56.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.925 0.393 . . . . 0.0 111.253 -177.694 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -93.52 -156.98 0.51 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.475 -178.755 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -114.31 158.83 20.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.563 -179.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 822' ' ' ASN . . . . . 0.422 ' HB3' ' H ' ' A' ' 823' ' ' ASP . 12.2 t-20 -104.81 -101.56 0.32 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.943 -176.677 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 823' ' ' ASP . . . . . 0.422 ' H ' ' HB3' ' A' ' 822' ' ' ASN . 5.1 t70 51.46 101.08 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.634 0.774 . . . . 0.0 111.869 -174.069 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 824' ' ' ASP . . . . . 0.445 ' HB3' ' H ' ' A' ' 825' ' ' MET . 19.2 t0 -90.77 -100.77 0.1 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.816 -173.428 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 825' ' ' MET . . . . . 0.555 ' O ' ' HB2' ' A' ' 850' ' ' GLN . 0.0 OUTLIER -115.76 139.0 50.58 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.915 -175.551 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 826' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -105.39 123.13 47.36 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.041 -176.496 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 827' ' ' ILE . . . . . . . . . . . . . 1.2 mm -119.87 124.28 72.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.699 177.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 828' ' ' LEU . . . . . 0.58 HD11 HG12 ' A' ' 863' ' ' VAL . 3.1 tp -109.01 123.31 48.92 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.648 0.261 . . . . 0.0 110.699 -178.229 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 27.0 m -105.43 128.36 59.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.822 177.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 830' ' ' VAL . . . . . 0.5 ' HA ' ' O ' ' A' ' 854' ' ' ALA . 0.2 OUTLIER -126.09 87.48 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 116.771 -0.195 . . . . 0.0 111.047 -177.775 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 831' ' ' ASP . . . . . 0.573 ' HA ' ' O ' ' A' ' 875' ' ' ASP . 9.9 t70 -107.67 137.97 44.73 Favored 'General case' 0 CA--C 1.515 -0.397 0 C-N-CA 120.631 -0.428 . . . . 0.0 110.388 -178.893 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.38 -31.2 72.29 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.125 -178.307 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 833' ' ' HIS . . . . . 0.401 ' HA ' ' HD3' ' A' ' 834' ' ' PRO . 0.2 OUTLIER -108.81 128.77 24.9 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-O 120.781 0.324 . . . . 0.0 111.697 -173.549 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 834' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 833' ' ' HIS . 67.6 Cg_exo -53.81 -45.26 42.3 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 123.51 2.807 . . . . 0.0 113.584 -178.711 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 835' ' ' ILE . . . . . 0.433 ' HA ' ' HD2' ' A' ' 838' ' ' ARG . 1.1 pt -65.35 -37.17 79.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 121.074 0.464 . . . . 0.0 110.778 -179.29 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 836' ' ' ASN . . . . . 0.405 ' N ' HG13 ' A' ' 835' ' ' ILE . 3.0 t30 -72.06 -45.47 60.61 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.692 179.563 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 837' ' ' ARG . . . . . 0.485 ' HA ' HD13 ' A' ' 840' ' ' LEU . 19.2 ttp180 -53.73 -47.73 70.32 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.377 -0.828 . . . . 0.0 111.07 177.386 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 838' ' ' ARG . . . . . 0.433 ' HD2' ' HA ' ' A' ' 835' ' ' ILE . 0.0 OUTLIER -66.01 -29.6 70.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.806 -179.827 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.92 -51.4 62.06 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.727 179.475 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 840' ' ' LEU . . . . . 0.485 HD13 ' HA ' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -72.32 -29.6 63.99 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.673 0.273 . . . . 0.0 110.873 -179.859 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -66.65 -31.14 71.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.045 0.45 . . . . 0.0 110.442 176.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -68.5 -44.16 75.29 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.806 175.05 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 843' ' ' GLN . . . . . 0.592 ' HG3' HD23 ' A' ' 929' ' ' LEU . 0.0 OUTLIER -60.39 -52.42 65.32 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.861 178.929 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 844' ' ' LEU . . . . . 0.496 ' HG ' HD22 ' A' ' 847' ' ' LEU . 0.2 OUTLIER -61.63 -31.62 71.72 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.91 177.555 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -65.36 -33.63 87.17 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 121.122 -0.561 . . . . 0.0 112.364 177.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.29 -22.85 51.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.963 0.411 . . . . 0.0 110.291 175.721 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 847' ' ' LEU . . . . . 0.496 HD22 ' HG ' ' A' ' 844' ' ' LEU . 1.0 OUTLIER -72.98 -44.33 61.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.06 177.478 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 100.19 25.48 8.88 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.54 -0.838 . . . . 0.0 113.912 172.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 6.0 m-30 -103.68 169.12 8.71 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 117.254 0.527 . . . . 0.0 109.865 176.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 850' ' ' GLN . . . . . 0.555 ' HB2' ' O ' ' A' ' 825' ' ' MET . 2.2 mt-30 -69.1 111.33 5.0 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 110.368 -0.234 . . . . 0.0 110.368 -178.577 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -98.63 112.94 24.84 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.055 0.455 . . . . 0.0 111.409 -175.092 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 852' ' ' LYS . . . . . 0.577 ' HB3' HD13 ' A' ' 828' ' ' LEU . 0.2 OUTLIER -101.56 110.48 22.48 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 173.851 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.26 117.6 29.78 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.666 -175.868 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 854' ' ' ALA . . . . . 0.5 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -136.83 162.28 33.65 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.626 178.796 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 26.7 p-10 -153.01 75.53 1.09 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.095 0.474 . . . . 0.0 111.689 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 856' ' ' ASP . . . . . . . . . . . . . 27.9 t70 173.1 150.94 0.07 Allowed 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.176 176.159 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -72.33 -47.85 27.28 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 121.183 -0.532 . . . . 0.0 112.656 -179.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -73.16 -34.14 43.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.027 0.442 . . . . 0.0 110.232 -177.099 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -61.49 -35.14 76.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.793 176.005 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -66.28 -39.5 89.43 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.681 177.573 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 861' ' ' LEU . . . . . 0.538 HD12 ' HB3' ' A' ' 889' ' ' ARG . 1.9 mt -67.17 -40.92 86.66 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.156 0.503 . . . . 0.0 110.337 177.348 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -63.0 -45.72 91.06 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.522 178.692 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 863' ' ' VAL . . . . . 0.58 HG12 HD11 ' A' ' 828' ' ' LEU . 0.3 OUTLIER -66.36 -31.99 56.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.918 179.913 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 864' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.6 -35.75 80.55 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.913 0.387 . . . . 0.0 110.084 175.851 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 2.2 m -74.4 -37.97 63.24 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.438 178.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -65.03 -54.03 36.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.164 -179.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -144.17 143.19 30.98 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.505 -179.416 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -73.5 140.56 46.48 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.962 -179.742 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 869' ' ' ILE . . . . . 0.416 HG21 ' N ' ' A' ' 870' ' ' ASP . 1.9 mp -120.55 134.05 65.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.023 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 870' ' ' ASP . . . . . 0.416 ' N ' HG21 ' A' ' 869' ' ' ILE . 8.9 m-20 -74.88 -55.46 5.78 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.039 0.447 . . . . 0.0 110.617 -177.769 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 871' ' ' ILE . . . . . 0.66 HD12 ' HB3' ' A' ' 939' ' ' TYR . 28.4 mm -117.2 120.83 66.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.157 -177.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 872' ' ' VAL . . . . . 0.45 ' H ' HG21 ' A' ' 872' ' ' VAL . 0.0 OUTLIER -105.82 125.56 61.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.821 -178.055 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 873' ' ' LEU . . . . . . . . . . . . . 26.5 mt -110.95 108.77 18.64 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 177.01 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 2.1 m -94.39 96.72 9.71 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 177.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 875' ' ' ASP . . . . . 0.573 ' O ' ' HA ' ' A' ' 831' ' ' ASP . 3.1 m-20 -93.03 104.41 16.63 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.822 0.82 . . . . 0.0 110.78 -173.762 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 876' ' ' VAL . . . . . 0.474 ' HB ' HG22 ' A' ' 903' ' ' THR . 0.2 OUTLIER -104.65 89.07 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.752 -178.244 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -68.54 -43.45 76.67 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 174.683 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 10.6 ptm -154.32 148.94 19.58 Favored Pre-proline 0 N--CA 1.452 -0.346 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.496 173.022 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 879' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -75.0 58.43 4.89 Favored 'Trans proline' 0 N--CA 1.464 -0.244 0 C-N-CA 122.682 2.255 . . . . 0.0 111.796 178.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 44.6 t30 -73.09 -57.09 4.28 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.993 -178.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.61 -59.64 2.66 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.699 -179.528 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -166.16 152.25 9.01 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.526 -178.347 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -149.36 22.77 1.22 Allowed Glycine 0 N--CA 1.443 -0.866 0 C-N-CA 121.056 -0.592 . . . . 0.0 111.951 178.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -149.17 -36.99 0.17 Allowed 'General case' 0 C--O 1.235 0.312 0 CA-C-O 120.47 0.176 . . . . 0.0 111.462 -179.727 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -68.44 -46.24 70.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.495 -176.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -55.89 -49.78 72.48 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.394 177.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.1 -45.35 87.36 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.437 -177.884 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -64.67 -49.99 68.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.929 179.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 889' ' ' ARG . . . . . 0.538 ' HB3' HD12 ' A' ' 861' ' ' LEU . 0.0 OUTLIER -64.15 -41.16 97.29 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.853 -174.659 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 890' ' ' ILE . . . . . 0.563 HG23 ' N ' ' A' ' 891' ' ' ARG . 0.9 OUTLIER -68.5 -40.41 82.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 111.511 0.189 . . . . 0.0 111.511 -176.646 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 891' ' ' ARG . . . . . 0.563 ' N ' HG23 ' A' ' 890' ' ' ILE . 0.4 OUTLIER -75.31 -24.38 57.44 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.068 0.461 . . . . 0.0 110.425 178.988 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -73.36 -54.79 7.48 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.795 178.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -67.2 -50.85 59.37 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.306 -174.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 166.46 82.96 0.05 OUTLIER Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 119.775 -1.202 . . . . 0.0 112.887 -178.223 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 895' ' ' LEU . . . . . 0.495 HD13 HG12 ' A' ' 890' ' ' ILE . 4.6 tp -89.93 109.33 20.36 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 175.462 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.16 6.26 5.9 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.054 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 897' ' ' LEU . . . . . 0.417 HD11 HG23 ' A' ' 872' ' ' VAL . 0.0 OUTLIER -123.81 141.22 36.22 Favored Pre-proline 0 C--N 1.325 -0.461 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 179.89 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -61.8 114.67 2.38 Favored 'Trans proline' 0 C--O 1.236 0.422 0 C-N-CA 122.799 2.333 . . . . 0.0 112.847 -176.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 899' ' ' VAL . . . . . 0.646 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 27.1 t -98.64 113.4 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-O 121.361 0.601 . . . . 0.0 110.257 177.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 900' ' ' ILE . . . . . 0.413 HG13 ' OG ' ' A' ' 921' ' ' SER . 1.7 mp -85.63 112.5 22.45 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.688 176.648 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -89.87 104.33 3.11 Favored Glycine 0 N--CA 1.443 -0.878 0 C-N-CA 120.595 -0.812 . . . . 0.0 111.464 177.486 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 902' ' ' VAL . . . . . 0.531 ' HA ' ' O ' ' A' ' 923' ' ' LEU . 0.2 OUTLIER -110.59 103.34 15.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.632 0.729 . . . . 0.0 109.663 179.537 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 903' ' ' THR . . . . . 0.474 HG22 ' HB ' ' A' ' 876' ' ' VAL . 0.2 OUTLIER -108.64 149.13 29.37 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.356 -174.44 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -94.76 135.87 35.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.668 175.336 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 61.28 -156.77 0.34 Allowed 'General case' 0 C--N 1.33 -0.268 0 O-C-N 123.676 0.61 . . . . 0.0 110.247 -176.328 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . 68.92 -71.84 0.11 Allowed 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.39 0.676 . . . . 0.0 111.959 176.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 97.6 mt 68.92 176.33 0.27 Allowed 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 123.203 0.601 . . . . 0.0 111.069 -179.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . 65.49 30.36 10.78 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.518 0.675 . . . . 0.0 109.759 -173.189 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -67.65 -18.02 64.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.842 -1.072 . . . . 0.0 111.546 -174.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 910' ' ' GLU . . . . . 0.434 ' HA ' ' SG ' ' A' ' 922' ' ' CYS . 0.4 OUTLIER -66.13 -42.02 89.69 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.956 0.408 . . . . 0.0 109.963 176.431 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.3 -34.05 65.53 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.043 178.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -66.1 -43.33 87.57 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.859 178.365 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 913' ' ' ARG . . . . . 0.448 ' HA ' ' SD ' ' A' ' 919' ' ' MET . 0.0 OUTLIER -63.12 -35.67 81.05 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.71 179.649 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 82.6 m -71.8 -37.23 70.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.902 0.382 . . . . 0.0 110.349 176.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.53 -51.76 66.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.168 -179.252 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -77.5 -33.0 54.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.299 -177.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.21 48.84 22.29 Favored 'General case' 0 N--CA 1.464 0.266 0 O-C-N 123.675 0.61 . . . . 0.0 111.433 -177.402 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -140.15 25.02 2.66 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.295 -178.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 919' ' ' MET . . . . . 0.646 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -129.72 -111.66 0.26 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.623 0.249 . . . . 0.0 110.757 -177.473 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 920' ' ' ASP . . . . . . . . . . . . . 10.8 t70 169.33 -60.13 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 123.986 0.914 . . . . 0.0 109.034 177.375 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 921' ' ' SER . . . . . 0.413 ' OG ' HG13 ' A' ' 900' ' ' ILE . 0.0 OUTLIER -123.17 170.08 10.6 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.808 178.363 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 922' ' ' CYS . . . . . 0.434 ' SG ' ' HA ' ' A' ' 910' ' ' GLU . 0.8 OUTLIER -144.64 130.39 19.15 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.7 0.286 . . . . 0.0 110.804 -179.34 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 923' ' ' LEU . . . . . 0.531 ' O ' ' HA ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -139.04 165.62 26.67 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 177.327 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -87.43 147.9 25.22 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.004 177.804 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 925' ' ' LYS . . . . . 0.477 ' HA ' ' CG2' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -47.56 -38.81 18.1 Favored Pre-proline 0 CA--C 1.539 0.545 0 N-CA-C 114.02 1.118 . . . . 0.0 114.02 -179.008 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -58.66 77.28 0.04 OUTLIER 'Trans proline' 0 C--N 1.358 1.066 0 C-N-CA 122.039 1.826 . . . . 0.0 112.777 170.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 927' ' ' VAL . . . . . 0.425 HG12 HG11 ' A' ' 931' ' ' VAL . 88.9 t -107.76 97.05 5.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.872 178.202 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.87 170.26 14.07 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.436 -179.674 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 929' ' ' LEU . . . . . 0.592 HD23 ' HG3' ' A' ' 843' ' ' GLN . 0.7 OUTLIER -52.29 -45.84 65.65 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.139 -0.482 . . . . 0.0 112.06 -177.314 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 930' ' ' ASP . . . . . 0.43 ' HA ' ' HE3' ' A' ' 933' ' ' LYS . 0.5 OUTLIER -69.89 -33.6 72.43 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.764 -0.375 . . . . 0.0 110.437 -177.738 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 931' ' ' VAL . . . . . 0.425 HG11 HG12 ' A' ' 927' ' ' VAL . 43.1 t -66.48 -52.12 49.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.768 -179.875 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 932' ' ' ILE . . . . . . . . . . . . . 3.8 tt -65.15 -36.4 77.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.92 0.391 . . . . 0.0 110.582 -179.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 933' ' ' LYS . . . . . 0.43 ' HE3' ' HA ' ' A' ' 930' ' ' ASP . 0.3 OUTLIER -68.2 -47.6 67.46 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.139 -179.398 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 934' ' ' GLN . . . . . 0.538 ' HG3' ' N ' ' A' ' 935' ' ' THR . 0.4 OUTLIER -68.34 -36.52 79.37 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.694 -0.23 . . . . 0.0 111.231 -177.551 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 935' ' ' THR . . . . . 0.538 ' N ' ' HG3' ' A' ' 934' ' ' GLN . 22.9 m -67.34 -43.89 80.45 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.896 0.379 . . . . 0.0 110.531 178.534 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 936' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.5 -47.5 81.45 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.639 179.073 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 34.2 m -62.92 -42.12 99.69 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.004 -179.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 938' ' ' LEU . . . . . 0.457 ' HB2' ' O ' ' A' ' 934' ' ' GLN . 0.6 OUTLIER -60.39 -45.24 94.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.022 179.505 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 939' ' ' TYR . . . . . 0.66 ' HB3' HD12 ' A' ' 871' ' ' ILE . 7.9 m-85 -78.63 -27.33 45.38 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.699 -175.295 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -64.3 -43.61 94.18 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.382 0.611 . . . . 0.0 110.089 174.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 941' ' ' GLU . . . . . 0.419 ' HG3' ' N ' ' A' ' 942' ' ' ARG . 0.0 OUTLIER -73.63 -29.67 62.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.109 177.152 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 942' ' ' ARG . . . . . 0.429 HH11 ' HD3' ' A' ' 942' ' ' ARG . 0.2 OUTLIER -65.9 -47.09 75.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.137 179.973 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 27.5 m -68.17 -29.83 45.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.893 0.378 . . . . 0.0 110.439 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.4 -31.39 71.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.583 174.453 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 20.4 mmtm -70.06 -36.37 74.93 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.071 178.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.96 -45.12 12.49 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.409 -176.223 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.88 -52.59 12.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.28 -177.893 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -102.11 -140.15 0.35 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.71 0.291 . . . . 0.0 110.842 -175.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.246 0.894 0 CA-C-O 118.753 -0.641 . . . . 0.0 110.441 -176.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 1.7 ttt . . . . . 0 N--CA 1.478 0.942 0 CA-C-O 120.982 0.42 . . . . 0.0 110.07 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 177.27 46.37 0.06 OUTLIER Glycine 0 N--CA 1.446 -0.659 0 N-CA-C 111.054 -0.818 . . . . 0.0 111.054 -179.25 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . 171.82 148.23 6.05 Favored Glycine 0 N--CA 1.445 -0.764 0 C-N-CA 121.224 -0.512 . . . . 0.0 111.824 -176.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -110.51 -77.59 0.59 Allowed 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.83 0.348 . . . . 0.0 110.446 -179.509 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . -170.05 -156.76 11.41 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.981 -0.628 . . . . 0.0 111.636 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER 50.46 37.73 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-O 121.318 0.58 . . . . 0.0 111.083 -179.685 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -84.14 -24.78 30.08 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.154 -179.735 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . 147.21 121.78 1.3 Allowed Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.947 -0.644 . . . . 0.0 111.949 178.154 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.778 HD21 HG12 ' A' ' 801' ' ' ILE . 1.3 tp -81.29 -29.17 34.37 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 177.077 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 705' ' ' SER . . . . . 0.743 ' HA ' ' O ' ' A' ' 730' ' ' GLY . 0.9 OUTLIER -63.88 89.4 0.05 Allowed 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.619 172.74 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 154.71 -19.77 0.59 Allowed Glycine 0 N--CA 1.448 -0.513 0 N-CA-C 111.033 -0.827 . . . . 0.0 111.033 -175.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 707' ' ' LYS . . . . . 0.436 ' O ' HG13 ' A' ' 732' ' ' VAL . 4.1 mmtt -77.48 130.99 37.72 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 174.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 708' ' ' ARG . . . . . . . . . . . . . 5.9 mtm-85 -95.64 139.55 31.73 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.235 0.54 . . . . 0.0 111.86 -171.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 709' ' ' CYS . . . . . 0.812 ' HG ' ' HH ' ' A' ' 799' ' ' TYR . 0.0 OUTLIER -122.39 116.58 24.26 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.612 174.897 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 710' ' ' TRP . . . . . 0.692 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 93.0 m95 -99.65 118.55 36.43 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.721 0.295 . . . . 0.0 110.298 -177.296 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 711' ' ' LEU . . . . . 0.535 HD21 ' C ' ' A' ' 710' ' ' TRP . 5.2 mt -111.25 118.15 35.13 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.836 0.351 . . . . 0.0 111.424 -176.038 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 712' ' ' ALA . . . . . 0.537 ' HB2' ' HB ' ' A' ' 749' ' ' THR . . . -108.08 44.53 1.1 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.573 0.701 . . . . 0.0 109.382 174.769 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 713' ' ' VAL . . . . . 0.713 HG13 ' HB3' ' A' ' 750' ' ' ASP . 16.3 t -100.29 124.84 54.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.583 -177.655 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 2.1 mtp180 -88.73 -21.02 24.07 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 177.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -71.39 102.4 2.62 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.876 174.665 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 716' ' ' ALA . . . . . 0.537 ' O ' ' HB2' ' A' ' 720' ' ' GLN . . . -59.95 -35.93 75.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.333 -177.21 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.44 -46.35 88.92 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.134 0.492 . . . . 0.0 110.549 178.615 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 718' ' ' LEU . . . . . 0.53 ' HB3' HG11 ' A' ' 713' ' ' VAL . 0.3 OUTLIER -69.38 -48.98 59.52 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.84 -179.76 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 719' ' ' CYS . . . . . 0.64 ' HB2' ' HB ' ' A' ' 713' ' ' VAL . 12.2 t -60.92 -51.77 67.85 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.702 -177.354 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 720' ' ' GLN . . . . . 0.754 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 1.2 mt-30 -63.03 -36.28 83.05 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.767 -176.713 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -59.48 -52.89 63.63 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.169 0.509 . . . . 0.0 110.4 179.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 722' ' ' LEU . . . . . 0.503 HD23 HD13 ' A' ' 791' ' ' LEU . 48.9 mt -66.9 -48.25 69.3 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.316 -178.034 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 723' ' ' GLU . . . . . 0.754 ' HG2' ' HA ' ' A' ' 720' ' ' GLN . 1.4 pt-20 -60.94 -44.76 96.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.825 -173.684 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 724' ' ' THR . . . . . 0.62 ' N ' ' HG3' ' A' ' 723' ' ' GLU . 16.0 m -64.75 -43.3 93.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.79 0.329 . . . . 0.0 110.775 -179.394 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 18.5 m -63.73 -40.16 96.05 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.342 179.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 726' ' ' LEU . . . . . 0.446 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 11.0 mt -71.95 -37.96 69.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.842 0.354 . . . . 0.0 111.211 -179.041 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -66.17 -15.25 62.98 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.862 0.363 . . . . 0.0 111.319 179.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.44 -16.12 60.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.096 0.474 . . . . 0.0 110.612 176.906 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -104.39 -1.08 27.34 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.157 0.503 . . . . 0.0 110.783 177.435 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 730' ' ' GLY . . . . . 0.743 ' O ' ' HA ' ' A' ' 705' ' ' SER . . . 98.13 -0.63 58.88 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.52 179.23 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 731' ' ' ILE . . . . . 0.446 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 36.6 mm -66.22 120.05 12.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 120.683 0.278 . . . . 0.0 110.402 -178.539 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 732' ' ' VAL . . . . . 0.436 HG13 ' O ' ' A' ' 707' ' ' LYS . 1.5 p -78.22 98.14 2.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 122.028 0.918 . . . . 0.0 110.06 -179.384 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 733' ' ' VAL . . . . . 0.494 HG12 ' HB2' ' A' ' 723' ' ' GLU . 82.8 t -81.96 119.95 32.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 114.915 -1.039 . . . . 0.0 110.601 179.746 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.33 125.46 44.39 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.945 177.603 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -59.74 114.42 2.76 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.646 177.334 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 736' ' ' TYR . . . . . 0.692 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 65.1 t80 -72.19 95.31 1.65 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.96 -179.871 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 737' ' ' GLU . . . . . 0.444 ' H ' ' HG3' ' A' ' 737' ' ' GLU . 0.0 OUTLIER -92.86 -52.83 4.42 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.139 0.495 . . . . 0.0 109.912 176.82 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -165.62 68.53 0.2 Allowed Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 111.083 -0.807 . . . . 0.0 111.083 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 15.7 mp0 -117.12 179.71 3.95 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.778 0.323 . . . . 0.0 110.581 -175.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -98.91 142.99 25.56 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.479 -179.123 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 741' ' ' PRO . . . . . 0.569 ' HB2' ' O ' ' A' ' 758' ' ' GLN . 71.8 Cg_endo -79.27 147.5 20.55 Favored 'Trans proline' 0 CA--C 1.532 0.414 0 C-N-CA 122.865 2.377 . . . . 0.0 113.446 -177.911 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 742' ' ' THR . . . . . 0.74 HG21 ' HD2' ' A' ' 743' ' ' PRO . 0.1 OUTLIER -132.61 144.24 52.11 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.597 179.122 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 743' ' ' PRO . . . . . 0.786 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 28.7 Cg_endo -62.5 -12.6 28.69 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 123.573 2.849 . . . . 0.0 113.777 -175.13 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 31.8 tp10 -98.08 -9.99 25.02 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.061 0.457 . . . . 0.0 110.792 179.39 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -106.65 158.47 16.93 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.321 -167.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 746' ' ' VAL . . . . . 0.404 HG23 ' N ' ' A' ' 747' ' ' LEU . 6.4 p -126.64 138.56 54.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.731 -179.053 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 747' ' ' LEU . . . . . 0.478 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 0.0 OUTLIER -103.79 103.35 13.22 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.916 177.167 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 27.5 mt -94.93 107.64 19.75 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 175.377 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 749' ' ' THR . . . . . 0.537 ' HB ' ' HB2' ' A' ' 712' ' ' ALA . 1.9 t -119.92 148.19 43.81 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.611 -174.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 750' ' ' ASP . . . . . 0.713 ' HB3' HG13 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -109.54 126.32 53.44 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 176.421 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 751' ' ' GLU . . . . . 0.483 ' HB2' ' O ' ' A' ' 750' ' ' ASP . 3.6 mm-40 74.5 173.93 0.27 Allowed 'General case' 0 C--O 1.235 0.325 0 CA-C-N 114.684 -1.143 . . . . 0.0 110.372 -170.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 752' ' ' VAL . . . . . 0.564 HG11 HG13 ' A' ' 772' ' ' ILE . 27.7 t -81.31 102.82 7.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.243 -176.208 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 7.1 p -80.7 -1.21 4.67 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.09 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 40.7 m 58.88 40.3 22.86 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.404 178.618 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -130.14 153.87 48.08 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.579 178.28 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 756' ' ' LYS . . . . . 0.539 ' O ' ' HD2' ' A' ' 756' ' ' LYS . 0.0 OUTLIER -95.78 -49.26 5.42 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 123.071 0.232 . . . . 0.0 111.136 -178.079 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 757' ' ' TRP . . . . . 0.478 ' CD2' ' HB2' ' A' ' 747' ' ' LEU . 71.4 t-105 76.88 139.47 0.07 Allowed 'General case' 0 N--CA 1.467 0.402 0 O-C-N 123.88 0.737 . . . . 0.0 110.634 179.486 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 758' ' ' GLN . . . . . 0.569 ' O ' ' HB2' ' A' ' 741' ' ' PRO . 0.0 OUTLIER -128.37 105.02 8.05 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.81 178.341 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 759' ' ' GLY . . . . . 0.786 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -178.03 -140.77 3.93 Favored Glycine 0 N--CA 1.44 -1.085 0 C-N-CA 119.733 -1.222 . . . . 0.0 112.824 -178.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 7.2 ttm105 -67.19 -52.76 37.36 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.927 0.394 . . . . 0.0 110.086 -179.219 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -170.44 165.32 8.63 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.53 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 2.2 p -131.66 120.52 45.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.845 174.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 57.9 t -104.92 104.03 16.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 116.165 -0.471 . . . . 0.0 109.929 -178.436 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 764' ' ' THR . . . . . 0.759 HG23 HD13 ' A' ' 772' ' ' ILE . 38.5 m -103.18 117.5 34.67 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.415 -177.816 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 765' ' ' PHE . . . . . 0.598 ' HZ ' ' HG ' ' A' ' 791' ' ' LEU . 75.9 m-85 -81.84 133.3 35.31 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.046 176.477 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -95.93 136.43 36.38 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 -179.032 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 767' ' ' ARG . . . . . 0.447 ' HB3' ' HD2' ' A' ' 768' ' ' ARG . 0.0 OUTLIER -136.92 -73.04 0.43 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.722 0.296 . . . . 0.0 110.953 -178.253 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 768' ' ' ARG . . . . . 0.447 ' HD2' ' HB3' ' A' ' 767' ' ' ARG . 0.0 OUTLIER -112.25 -35.28 5.66 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.028 -176.396 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 74.3 m80 -100.33 136.94 39.45 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.308 -178.298 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 2.6 mt -129.92 127.74 64.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.955 -179.199 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . 148.72 26.1 0.07 OUTLIER Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.317 -0.944 . . . . 0.0 112.972 179.293 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 772' ' ' ILE . . . . . 0.759 HD13 HG23 ' A' ' 764' ' ' THR . 0.0 OUTLIER -104.56 146.49 32.72 Favored Pre-proline 0 C--N 1.324 -0.5 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 176.912 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 773' ' ' PRO . . . . . 0.479 ' HD2' HG12 ' A' ' 772' ' ' ILE . 26.4 Cg_endo -61.73 125.76 17.42 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.615 2.21 . . . . 0.0 112.82 -178.398 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . 0.565 ' HA ' HG12 ' A' ' 782' ' ' VAL . 0.4 OUTLIER -98.13 -162.14 0.93 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.893 176.666 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 775' ' ' GLU . . . . . 0.596 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 2.4 mp0 -67.62 59.6 0.06 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 122.099 0.952 . . . . 0.0 112.691 177.903 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . 0.51 ' HE3' HD22 ' A' ' 774' ' ' LEU . 14.5 ptpt -128.19 10.9 6.39 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 167.908 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 777' ' ' ALA . . . . . 0.579 ' HB3' ' HD2' ' A' ' 778' ' ' PRO . . . -133.79 164.63 42.61 Favored Pre-proline 0 N--CA 1.446 -0.645 0 CA-C-N 113.741 -1.572 . . . . 0.0 108.692 178.485 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 778' ' ' PRO . . . . . 0.579 ' HD2' ' HB3' ' A' ' 777' ' ' ALA . 14.2 Cg_endo -55.44 -24.35 43.22 Favored 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 123.591 2.861 . . . . 0.0 115.64 -169.756 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . -158.49 27.62 0.42 Allowed Glycine 0 CA--C 1.507 -0.407 0 C-N-CA 119.804 -1.189 . . . . 0.0 112.316 -174.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 780' ' ' GLU . . . . . 0.596 ' O ' ' HG3' ' A' ' 775' ' ' GLU . 13.8 mp0 -103.67 129.13 50.95 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -175.384 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 14.3 m95 -133.01 140.6 47.83 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 -177.561 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . 0.565 HG12 ' HA ' ' A' ' 774' ' ' LEU . 4.4 m -135.7 148.71 28.03 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.319 0 CA-C-O 120.53 0.205 . . . . 0.0 110.637 174.008 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 783' ' ' HIS . . . . . 0.546 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.1 OUTLIER -169.98 148.72 3.5 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.793 0.33 . . . . 0.0 110.978 177.771 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -105.48 102.32 11.8 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.078 175.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 1.4 p -171.03 160.02 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 -179.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -94.63 25.01 4.22 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.787 0.327 . . . . 0.0 111.289 -178.574 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 52.43 64.47 7.41 Favored Pre-proline 0 CA--C 1.535 0.378 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.972 -179.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 788' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -65.43 -50.68 1.78 Allowed 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.55 2.166 . . . . 0.0 111.947 -178.113 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 789' ' ' HIS . . . . . 0.403 ' O ' ' HB1' ' A' ' 793' ' ' ALA . 0.0 OUTLIER -161.98 -30.84 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.06 -179.685 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 790' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.57 -45.17 95.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.914 -0.584 . . . . 0.0 112.14 -178.183 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 791' ' ' LEU . . . . . 0.598 ' HG ' ' HZ ' ' A' ' 765' ' ' PHE . 0.3 OUTLIER -66.41 -53.66 29.2 Favored Pre-proline 0 CA--C 1.534 0.363 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -177.469 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 792' ' ' PRO . . . . . 0.409 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 9.7 Cg_endo -56.97 -34.58 97.76 Favored 'Trans proline' 0 C--N 1.357 0.98 0 C-N-CA 121.441 1.427 . . . . 0.0 112.17 176.187 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 793' ' ' ALA . . . . . 0.403 ' HB1' ' O ' ' A' ' 789' ' ' HIS . . . -64.05 -44.79 91.39 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.76 0.314 . . . . 0.0 110.624 176.408 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 794' ' ' LEU . . . . . 0.611 ' HA ' ' HD3' ' A' ' 797' ' ' ARG . 1.3 tm? -58.97 -49.13 79.05 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.16 178.678 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 795' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -65.42 -41.24 93.76 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.336 -176.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -60.12 -50.36 74.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.286 -179.521 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 797' ' ' ARG . . . . . 0.611 ' HD3' ' HA ' ' A' ' 794' ' ' LEU . 0.0 OUTLIER -71.82 -25.4 61.97 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.583 -177.423 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 798' ' ' ILE . . . . . 0.493 HD12 HD13 ' A' ' 794' ' ' LEU . 0.0 OUTLIER -73.93 -23.73 19.1 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 CA-C-O 120.942 0.401 . . . . 0.0 111.29 178.436 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 799' ' ' TYR . . . . . 0.812 ' HH ' ' HG ' ' A' ' 709' ' ' CYS . 5.7 m-85 -80.26 -19.3 47.1 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.787 177.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 5.3 mt 67.8 92.45 0.08 Allowed 'General case' 0 C--O 1.234 0.265 0 O-C-N 124.291 0.995 . . . . 0.0 112.011 177.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 801' ' ' ILE . . . . . 0.778 HG12 HD21 ' A' ' 704' ' ' LEU . 1.0 OUTLIER -105.8 106.17 20.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 175.607 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -108.32 63.32 0.61 Allowed 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.762 -175.41 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 803' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -58.8 130.12 45.38 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.418 177.715 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 804' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -109.32 145.59 35.75 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.404 -179.375 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -94.74 155.72 16.71 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.244 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -115.95 112.05 21.29 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 177.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -118.24 96.48 49.8 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.866 -174.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 808' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -90.22 136.78 2.46 Favored 'Trans proline' 0 N--CA 1.451 -0.982 0 C-N-CA 123.471 2.781 . . . . 0.0 112.544 -179.048 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -169.15 154.99 6.27 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.769 177.642 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -166.34 60.74 0.1 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-O 121.018 0.437 . . . . 0.0 111.139 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -84.6 112.22 20.24 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.852 178.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 812' ' ' LEU . . . . . 0.401 ' HA ' ' HD3' ' A' ' 813' ' ' PRO . 0.0 OUTLIER -128.63 107.65 18.82 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.006 -177.564 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 813' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 812' ' ' LEU . 2.0 Cg_endo -82.32 122.4 3.67 Favored 'Trans proline' 0 N--CA 1.46 -0.441 0 C-N-CA 123.138 2.558 . . . . 0.0 111.786 177.673 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 2.5 m -144.8 115.48 7.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.796 0.332 . . . . 0.0 110.951 178.595 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 1.4 m -143.61 125.46 15.18 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.635 177.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -118.64 142.11 47.96 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.79 179.954 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 7.6 ptmm? -172.43 122.68 0.45 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.079 177.563 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -147.19 123.81 11.13 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.742 0.306 . . . . 0.0 111.527 -179.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 9.8 p -159.64 142.65 5.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.893 175.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 72.7 m -156.92 142.92 17.91 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 110.494 -0.187 . . . . 0.0 110.494 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -166.62 136.4 3.11 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.246 -0.433 . . . . 0.0 109.977 179.537 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 13.4 t30 -153.92 45.45 0.6 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.362 0.601 . . . . 0.0 110.577 178.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -130.96 159.62 36.93 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.554 178.484 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 824' ' ' ASP . . . . . 0.431 ' HB3' ' H ' ' A' ' 825' ' ' MET . 13.9 t0 -162.63 -102.42 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -177.057 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 825' ' ' MET . . . . . 0.456 ' HB2' ' HE3' ' A' ' 825' ' ' MET . 35.9 ttm -96.32 137.62 35.13 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.715 -175.863 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 826' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.66 120.23 37.38 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.886 -177.713 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 827' ' ' ILE . . . . . 0.73 HD12 ' HB ' ' A' ' 871' ' ' ILE . 13.0 mm -107.59 125.21 63.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.5 176.213 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 828' ' ' LEU . . . . . 0.488 HD12 HG11 ' A' ' 863' ' ' VAL . 6.7 tp -98.66 130.11 45.16 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.883 0.373 . . . . 0.0 110.613 -177.529 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 829' ' ' VAL . . . . . 0.767 HG23 HD13 ' A' ' 840' ' ' LEU . 0.2 OUTLIER -118.92 117.08 53.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.852 179.117 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 830' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -112.54 99.36 8.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 115.617 -0.719 . . . . 0.0 109.521 178.021 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 831' ' ' ASP . . . . . 0.642 ' HB3' ' HG3' ' A' ' 837' ' ' ARG . 0.2 OUTLIER -117.29 146.98 42.97 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.834 0.349 . . . . 0.0 110.385 -178.609 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 832' ' ' ASP . . . . . 0.463 ' HB3' HG13 ' A' ' 876' ' ' VAL . 0.0 OUTLIER -91.75 -14.29 30.18 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.272 -172.449 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 2.5 m80 -124.98 98.42 36.35 Favored Pre-proline 0 C--N 1.327 -0.408 0 C-N-CA 120.881 -0.328 . . . . 0.0 111.346 -176.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 834' ' ' PRO . . . . . 0.56 ' HA ' ' HD3' ' A' ' 837' ' ' ARG . 15.1 Cg_exo -31.37 -41.98 0.11 Allowed 'Trans proline' 0 C--N 1.352 0.744 1 C-N-CA 125.899 4.399 . . . . 0.0 117.0 -169.29 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -58.94 -35.38 56.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.824 0.345 . . . . 0.0 111.569 -177.469 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 836' ' ' ASN . . . . . 0.586 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 62.1 m-80 -72.32 -38.84 68.57 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 -179.002 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 837' ' ' ARG . . . . . 0.642 ' HG3' ' HB3' ' A' ' 831' ' ' ASP . 0.0 OUTLIER -51.72 -45.33 63.56 Favored 'General case' 0 C--O 1.224 -0.263 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.112 177.002 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 838' ' ' ARG . . . . . 0.488 ' HD3' ' N ' ' A' ' 839' ' ' LEU . 0.0 OUTLIER -59.09 -50.39 74.26 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.248 176.843 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 839' ' ' LEU . . . . . 0.488 ' N ' ' HD3' ' A' ' 838' ' ' ARG . 0.1 OUTLIER -62.99 -52.87 61.32 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.706 -0.679 . . . . 0.0 112.551 -170.045 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 840' ' ' LEU . . . . . 0.767 HD13 HG23 ' A' ' 829' ' ' VAL . 0.0 OUTLIER -72.24 -33.11 67.28 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 120.293 -0.563 . . . . 0.0 110.964 -176.703 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -67.54 -39.3 85.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.933 0.397 . . . . 0.0 110.37 179.412 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.97 -41.18 97.63 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.089 177.396 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 843' ' ' GLN . . . . . 0.889 ' HG2' HD21 ' A' ' 929' ' ' LEU . 11.4 mt-30 -58.62 -48.05 82.3 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.214 175.672 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 844' ' ' LEU . . . . . 0.644 ' HG ' HD23 ' A' ' 936' ' ' LEU . 0.1 OUTLIER -59.81 -34.69 73.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.751 -0.658 . . . . 0.0 111.038 177.495 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -65.2 -40.2 96.6 Favored Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.89 -0.596 . . . . 0.0 112.411 178.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.81 -25.02 64.46 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.884 0.373 . . . . 0.0 110.574 178.416 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.18 -27.51 61.68 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.145 0.498 . . . . 0.0 110.196 176.06 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 94.39 25.46 16.1 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.755 -0.736 . . . . 0.0 113.16 175.206 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -115.91 161.98 18.01 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.986 0.393 . . . . 0.0 110.654 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.55 131.0 37.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.321 -177.545 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -116.63 142.99 46.18 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.665 -178.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.11 109.84 13.4 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 175.603 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 853' ' ' THR . . . . . 0.678 HG23 HG13 ' A' ' 829' ' ' VAL . 0.0 OUTLIER -94.21 133.99 37.15 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.945 0.402 . . . . 0.0 111.395 -175.988 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 854' ' ' ALA . . . . . . . . . . . . . . . -146.79 177.15 9.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.783 178.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 855' ' ' ASN . . . . . 0.575 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 42.5 t30 -154.58 80.72 1.1 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.349 177.754 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 856' ' ' ASP . . . . . 0.575 ' HB2' ' O ' ' A' ' 855' ' ' ASN . 2.1 t0 164.85 145.27 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.538 0 O-C-N 123.979 0.799 . . . . 0.0 110.151 177.285 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -73.59 -42.33 40.54 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.179 179.617 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 3.6 m -69.41 -31.34 49.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.778 0.323 . . . . 0.0 111.015 -178.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -73.96 -37.19 64.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.847 0.356 . . . . 0.0 110.539 179.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -61.1 -36.64 80.24 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.09 175.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 861' ' ' LEU . . . . . 0.594 HD11 ' HB3' ' A' ' 889' ' ' ARG . 6.8 mt -68.41 -43.46 77.14 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.574 176.763 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 32.5 t30 -58.69 -50.28 74.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.817 179.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 863' ' ' VAL . . . . . 0.488 HG11 HD12 ' A' ' 828' ' ' LEU . 1.6 p -64.4 -30.99 51.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.987 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 864' ' ' LEU . . . . . 0.493 ' HA ' HD13 ' A' ' 869' ' ' ILE . 0.7 OUTLIER -63.24 -38.02 89.53 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.002 0.429 . . . . 0.0 110.973 177.307 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -83.34 -18.89 37.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.909 0.385 . . . . 0.0 111.03 -177.45 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 11.6 tptp -87.54 -46.54 9.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.121 -178.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -130.9 165.49 22.96 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.874 -174.529 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 53.5 t60 -87.66 128.77 35.28 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.929 0.395 . . . . 0.0 110.695 -179.01 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 869' ' ' ILE . . . . . 0.493 HD13 ' HA ' ' A' ' 864' ' ' LEU . 4.4 mt -117.31 136.68 53.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.389 174.738 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 870' ' ' ASP . . . . . 0.401 ' OD2' ' HG3' ' A' ' 825' ' ' MET . 23.0 m-20 -88.53 -48.72 7.38 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.814 0.34 . . . . 0.0 110.856 -177.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 871' ' ' ILE . . . . . 0.73 ' HB ' HD12 ' A' ' 827' ' ' ILE . 6.6 mm -128.4 137.26 57.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.316 -179.127 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 872' ' ' VAL . . . . . 0.476 ' N ' HG22 ' A' ' 871' ' ' ILE . 0.0 OUTLIER -110.4 117.9 55.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.66 0.267 . . . . 0.0 111.173 -179.36 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 873' ' ' LEU . . . . . 0.413 HD13 ' HB ' ' A' ' 829' ' ' VAL . 0.3 OUTLIER -105.09 113.0 26.33 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 175.192 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -104.71 96.85 6.85 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 177.671 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 875' ' ' ASP . . . . . 0.639 ' O ' ' HA ' ' A' ' 831' ' ' ASP . 52.8 t0 -104.83 106.95 17.66 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.395 0.617 . . . . 0.0 110.395 -174.876 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 876' ' ' VAL . . . . . 0.463 HG13 ' HB3' ' A' ' 832' ' ' ASP . 0.0 OUTLIER -124.56 134.66 66.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.302 -176.273 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -72.1 -50.39 28.5 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 173.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 3.2 ptm -166.86 145.18 4.33 Favored Pre-proline 0 C--N 1.325 -0.479 0 CA-C-N 115.315 -0.857 . . . . 0.0 108.805 174.414 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 879' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -56.07 -37.54 96.16 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.715 2.277 . . . . 0.0 112.739 -177.595 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 5.5 t30 62.73 25.29 15.03 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.131 0.491 . . . . 0.0 110.946 178.03 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 2.8 ttm -178.45 -78.21 0.01 OUTLIER 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.476 -177.387 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -154.24 150.97 28.62 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.046 -0.525 . . . . 0.0 109.923 175.727 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -121.98 42.52 1.64 Allowed Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 111.264 -0.735 . . . . 0.0 111.264 176.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 30.7 t80 -122.68 -44.34 2.22 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.082 0.468 . . . . 0.0 110.423 -177.015 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.46 -38.51 80.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.074 -177.793 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.33 -48.89 73.85 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.62 -178.48 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.53 -42.68 98.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.442 -178.704 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.16 -48.52 81.19 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.37 178.562 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 889' ' ' ARG . . . . . 0.594 ' HB3' HD11 ' A' ' 861' ' ' LEU . 0.0 OUTLIER -63.15 -41.87 99.35 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.768 -176.651 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 890' ' ' ILE . . . . . 0.57 ' HA ' HD22 ' A' ' 861' ' ' LEU . 8.1 mm -58.8 -52.81 55.74 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 121.131 0.491 . . . . 0.0 111.023 -178.888 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 891' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -71.48 -22.72 61.77 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.795 -179.1 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.31 -45.85 78.91 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.832 0.349 . . . . 0.0 110.41 177.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -67.82 -43.8 78.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.301 178.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 125.41 81.5 0.44 Allowed Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 120.219 -0.991 . . . . 0.0 112.567 178.133 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 895' ' ' LEU . . . . . 0.615 ' HG ' ' O ' ' A' ' 895' ' ' LEU . 0.3 OUTLIER -70.33 120.67 16.34 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.244 0.545 . . . . 0.0 110.211 178.452 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -113.97 8.86 17.29 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.601 0.715 . . . . 0.0 110.895 179.22 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 897' ' ' LEU . . . . . 0.484 HD23 ' O ' ' A' ' 869' ' ' ILE . 0.0 OUTLIER -130.43 137.85 31.74 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.541 -176.481 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -58.97 120.38 8.21 Favored 'Trans proline' 0 C--O 1.236 0.406 0 C-N-CA 122.656 2.237 . . . . 0.0 112.104 -178.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 899' ' ' VAL . . . . . 0.695 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 7.4 t -95.36 127.71 47.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.096 0.474 . . . . 0.0 110.629 -179.118 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 900' ' ' ILE . . . . . . . . . . . . . 4.5 mt -107.95 109.6 28.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.851 176.215 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 901' ' ' GLY . . . . . 0.45 ' HA3' ' SD ' ' A' ' 919' ' ' MET . . . -92.95 97.82 2.31 Favored Glycine 0 N--CA 1.444 -0.812 0 CA-C-N 115.865 -0.607 . . . . 0.0 112.319 -178.124 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 902' ' ' VAL . . . . . 0.92 ' HB ' ' HB3' ' A' ' 923' ' ' LEU . 0.2 OUTLIER -94.07 119.77 42.47 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.218 0.532 . . . . 0.0 109.797 175.981 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 903' ' ' THR . . . . . 0.484 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.3 OUTLIER -125.68 154.68 42.02 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.562 -179.098 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -88.22 102.56 14.93 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.636 -0.426 . . . . 0.0 110.685 178.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 14.2 t30 40.65 67.55 0.5 Allowed 'General case' 0 N--CA 1.47 0.574 0 O-C-N 124.135 0.897 . . . . 0.0 112.168 176.64 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -72.83 -53.36 11.68 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.035 -177.088 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 167.52 -53.68 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 -176.937 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -163.87 86.6 0.49 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.379 -1.282 . . . . 0.0 109.164 178.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -55.15 -36.46 65.84 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.576 -176.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 910' ' ' GLU . . . . . 0.573 ' HG2' ' N ' ' A' ' 911' ' ' LYS . 8.0 pm0 -68.43 -40.48 81.16 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.661 -179.684 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 911' ' ' LYS . . . . . 0.573 ' N ' ' HG2' ' A' ' 910' ' ' GLU . 7.2 tttt -71.07 -35.11 71.76 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.127 -178.884 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 912' ' ' GLN . . . . . 0.564 ' O ' ' HG3' ' A' ' 916' ' ' GLU . 5.0 tp60 -60.03 -48.05 83.32 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.765 175.191 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 913' ' ' ARG . . . . . 0.562 ' HA ' ' OE2' ' A' ' 916' ' ' GLU . 0.0 OUTLIER -59.75 -34.78 73.4 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.123 179.017 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 66.3 m -70.71 -33.91 71.36 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.906 0.384 . . . . 0.0 110.607 177.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.71 -52.87 15.57 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.559 -178.968 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 916' ' ' GLU . . . . . 0.564 ' HG3' ' O ' ' A' ' 912' ' ' GLN . 1.2 pp20? -78.17 -46.73 19.77 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.215 -176.135 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 1.4 m 51.16 43.94 28.94 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.727 -175.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -122.86 -32.55 0.92 Allowed Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.024 179.238 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 919' ' ' MET . . . . . 0.7 ' O ' ' HB2' ' A' ' 920' ' ' ASP . 75.0 mtm -72.58 -91.01 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 176.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 920' ' ' ASP . . . . . 0.7 ' HB2' ' O ' ' A' ' 919' ' ' MET . 14.8 t0 149.31 -49.09 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.923 1.289 . . . . 0.0 110.43 172.682 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -113.62 148.8 35.59 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.832 0.349 . . . . 0.0 110.69 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 922' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -117.26 141.96 47.65 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.056 178.842 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 923' ' ' LEU . . . . . 0.92 ' HB3' ' HB ' ' A' ' 902' ' ' VAL . 0.3 OUTLIER -148.4 167.68 24.62 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.843 0.354 . . . . 0.0 110.553 -179.401 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 924' ' ' SER . . . . . 0.484 ' HA ' ' O ' ' A' ' 903' ' ' THR . 3.9 m -115.88 150.0 37.76 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.997 175.498 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 925' ' ' LYS . . . . . 0.506 ' N ' ' HD2' ' A' ' 926' ' ' PRO . 1.4 tttp -51.62 -43.72 88.23 Favored Pre-proline 0 CA--C 1.54 0.595 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 926' ' ' PRO . . . . . 0.506 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 42.7 Cg_endo -69.01 63.24 1.36 Allowed 'Trans proline' 0 C--N 1.357 1.003 0 C-N-CA 121.987 1.792 . . . . 0.0 113.073 174.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 3.4 p -92.97 147.19 5.56 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.807 175.482 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -103.56 167.54 9.73 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.011 -177.593 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 929' ' ' LEU . . . . . 0.889 HD21 ' HG2' ' A' ' 843' ' ' GLN . 1.6 tm? -63.84 -35.8 81.81 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.152 179.04 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.28 -47.44 79.53 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.256 0.551 . . . . 0.0 110.359 -179.198 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 82.3 t -67.49 -44.94 86.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.924 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 932' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -62.43 -36.18 73.49 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-O 120.569 0.223 . . . . 0.0 110.426 -179.702 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 1.6 ttmt -68.28 -47.87 66.51 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.409 179.227 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.91 -43.02 95.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.907 179.425 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 17.8 m -65.45 -50.08 66.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.214 -178.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 936' ' ' LEU . . . . . 0.644 HD23 ' HG ' ' A' ' 844' ' ' LEU . 0.3 OUTLIER -63.33 -44.38 95.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.943 -178.45 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 36.2 m -62.94 -43.33 99.09 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.814 0.34 . . . . 0.0 111.48 -179.198 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 938' ' ' LEU . . . . . 0.451 HD21 ' HA ' ' A' ' 938' ' ' LEU . 0.3 OUTLIER -67.29 -49.36 64.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.954 -179.662 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 939' ' ' TYR . . . . . 0.602 ' HD2' HD13 ' A' ' 871' ' ' ILE . 11.6 m-85 -66.21 -34.65 78.5 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.213 -177.192 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -63.13 -45.57 91.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.794 0.33 . . . . 0.0 111.063 178.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 941' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.81 -34.11 76.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.121 179.266 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 942' ' ' ARG . . . . . 0.58 ' HG3' ' N ' ' A' ' 943' ' ' VAL . 0.0 OUTLIER -63.96 -47.56 79.94 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.967 -178.668 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 943' ' ' VAL . . . . . 0.58 ' N ' ' HG3' ' A' ' 942' ' ' ARG . 15.9 m -73.08 -29.9 30.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.551 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.49 -40.48 95.75 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.011 178.821 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 945' ' ' LYS . . . . . 0.419 ' HG2' ' O ' ' A' ' 942' ' ' ARG . 0.4 OUTLIER -79.63 -20.76 46.0 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 121.098 -0.241 . . . . 0.0 111.473 -179.161 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 16.1 m -72.93 -30.4 63.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.561 0.696 . . . . 0.0 109.797 171.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -82.55 -17.6 44.36 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.08 174.265 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 10.1 t70 71.29 77.26 0.17 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-N 114.858 -1.065 . . . . 0.0 110.771 -178.609 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.248 1.024 0 CA-C-N 115.415 -0.812 . . . . 0.0 109.959 179.367 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.96 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 145.86 167.03 12.3 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.752 -0.737 . . . . 0.0 111.657 -178.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . -149.69 91.42 0.14 Allowed Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.781 -0.724 . . . . 0.0 112.139 -178.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -76.58 105.61 7.74 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 177.901 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . -113.46 105.7 1.68 Allowed Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.355 -177.08 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -124.17 48.76 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 121.228 0.537 . . . . 0.0 110.091 178.229 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.24 113.73 26.63 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.523 179.299 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . -79.24 72.2 2.53 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 121.195 -0.526 . . . . 0.0 112.691 -179.015 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 43.1 mt -116.71 4.25 13.07 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.293 0.568 . . . . 0.0 110.101 177.222 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 705' ' ' SER . . . . . 0.497 ' HA ' ' O ' ' A' ' 730' ' ' GLY . 0.0 OUTLIER -75.1 163.65 27.35 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.033 -179.388 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 93.42 -19.79 50.42 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.527 179.411 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 707' ' ' LYS . . . . . 0.669 ' NZ ' ' HA ' ' A' ' 745' ' ' ASP . 7.8 tmtm? -84.61 147.98 26.7 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 -179.89 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 708' ' ' ARG . . . . . 0.452 ' HD2' ' CZ2' ' A' ' 710' ' ' TRP . 6.4 mtm-85 -113.22 162.68 15.72 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.612 0.72 . . . . 0.0 111.678 -177.171 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 709' ' ' CYS . . . . . 0.41 ' O ' HD23 ' A' ' 711' ' ' LEU . 1.2 m -132.88 117.89 18.26 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 114.6 -1.182 . . . . 0.0 108.847 168.11 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 710' ' ' TRP . . . . . 0.452 ' CZ2' ' HD2' ' A' ' 708' ' ' ARG . 91.0 m95 -94.04 107.16 19.1 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 711' ' ' LEU . . . . . 0.82 HD21 HG13 ' A' ' 733' ' ' VAL . 0.1 OUTLIER -110.12 128.46 55.46 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.127 0.489 . . . . 0.0 111.124 -176.845 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -119.45 44.19 2.43 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.21 175.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 713' ' ' VAL . . . . . 0.905 ' HA ' ' HB2' ' A' ' 750' ' ' ASP . 43.6 t -99.42 123.52 52.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.431 -178.387 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 714' ' ' ARG . . . . . 0.727 HH12 ' HG3' ' A' ' 751' ' ' GLU . 0.0 OUTLIER -78.46 -35.98 45.94 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 177.836 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 13.7 m-80 -59.92 109.95 1.06 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.382 -0.827 . . . . 0.0 110.715 -176.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -58.91 -43.67 91.09 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.491 -176.343 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.28 -42.81 96.21 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.229 0.538 . . . . 0.0 110.73 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 718' ' ' LEU . . . . . 0.513 HD23 HD13 ' A' ' 722' ' ' LEU . 0.2 OUTLIER -72.05 -49.71 34.42 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.121 -177.858 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 719' ' ' CYS . . . . . 0.8 ' SG ' ' HB ' ' A' ' 713' ' ' VAL . 0.1 OUTLIER -62.67 -50.35 71.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.089 -178.251 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -59.09 -44.15 91.89 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.668 -177.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -61.39 -52.13 65.88 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.799 0.333 . . . . 0.0 110.993 -178.158 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 722' ' ' LEU . . . . . 0.513 HD13 HD23 ' A' ' 718' ' ' LEU . 14.7 mt -62.73 -45.1 94.27 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.653 -178.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 723' ' ' GLU . . . . . 0.461 ' HA ' HG23 ' A' ' 733' ' ' VAL . 0.8 OUTLIER -59.08 -46.47 88.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.865 -179.045 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 724' ' ' THR . . . . . . . . . . . . . 57.6 m -61.63 -41.73 97.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.892 0.377 . . . . 0.0 111.043 -178.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 14.1 m -67.22 -39.49 86.25 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.067 -0.515 . . . . 0.0 112.167 -175.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 726' ' ' LEU . . . . . 0.405 ' CD2' HD11 ' A' ' 731' ' ' ILE . 0.2 OUTLIER -82.31 -33.68 28.91 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.916 -0.313 . . . . 0.0 111.326 -178.881 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 727' ' ' GLN . . . . . 0.409 HE21 ' HB3' ' A' ' 727' ' ' GLN . 0.8 OUTLIER -72.95 -13.24 61.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.02 0.438 . . . . 0.0 110.413 177.28 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.84 -19.3 63.97 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.618 176.487 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 729' ' ' SER . . . . . 0.507 ' HB2' ' H ' ' A' ' 730' ' ' GLY . 0.0 OUTLIER -98.11 -96.26 0.22 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.339 177.748 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 730' ' ' GLY . . . . . 0.507 ' H ' ' HB2' ' A' ' 729' ' ' SER . . . -159.1 21.64 0.29 Allowed Glycine 0 N--CA 1.45 -0.416 0 N-CA-C 111.016 -0.834 . . . . 0.0 111.016 178.264 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 731' ' ' ILE . . . . . 0.523 HD12 ' HD2' ' A' ' 707' ' ' LYS . 2.5 mt -89.76 132.25 34.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 -177.283 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 732' ' ' VAL . . . . . 0.549 HG13 ' O ' ' A' ' 707' ' ' LYS . 1.5 p -87.13 108.59 18.27 Favored 'Isoleucine or valine' 0 C--O 1.238 0.488 0 CA-C-O 121.826 0.822 . . . . 0.0 111.335 -176.784 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 733' ' ' VAL . . . . . 0.82 HG13 HD21 ' A' ' 711' ' ' LEU . 2.2 t -75.41 117.33 19.59 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.0 -1.0 . . . . 0.0 109.85 176.661 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.01 126.28 41.03 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.637 -179.085 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -56.89 130.63 46.69 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.802 177.551 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -72.42 77.86 1.03 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.394 0.616 . . . . 0.0 110.443 178.192 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.41 -13.1 61.74 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.639 177.375 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 109.1 39.5 1.67 Allowed Glycine 0 N--CA 1.447 -0.574 0 N-CA-C 111.06 -0.816 . . . . 0.0 111.06 -174.531 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -85.81 -167.15 1.75 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.47 -0.365 . . . . 0.0 110.784 -177.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -67.78 122.0 81.78 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.341 -177.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 741' ' ' PRO . . . . . 0.439 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 29.4 Cg_endo -65.22 122.9 10.77 Favored 'Trans proline' 0 N--CA 1.463 -0.315 0 C-N-CA 122.371 2.047 . . . . 0.0 111.183 176.765 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 742' ' ' THR . . . . . 0.735 ' HB ' ' HB2' ' A' ' 745' ' ' ASP . 0.1 OUTLIER -104.99 124.88 35.21 Favored Pre-proline 0 C--N 1.322 -0.606 0 CA-C-O 120.948 0.404 . . . . 0.0 111.363 -174.391 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 743' ' ' PRO . . . . . 0.831 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 34.7 Cg_endo -65.47 -12.93 37.25 Favored 'Trans proline' 0 N--CA 1.473 0.267 0 C-N-CA 123.497 2.798 . . . . 0.0 113.693 -175.681 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -108.18 -0.66 20.85 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.553 0.692 . . . . 0.0 110.583 177.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 745' ' ' ASP . . . . . 0.735 ' HB2' ' HB ' ' A' ' 742' ' ' THR . 28.0 m-20 -111.89 165.87 11.7 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.758 -173.927 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 16.6 m -123.46 147.42 27.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.432 -171.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 747' ' ' LEU . . . . . 0.423 ' C ' HD23 ' A' ' 747' ' ' LEU . 0.2 OUTLIER -107.45 99.9 9.38 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.18 178.231 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 5.7 mt -90.62 106.61 17.59 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 174.403 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 749' ' ' THR . . . . . 0.412 HG22 ' HA ' ' A' ' 764' ' ' THR . 8.9 t -117.89 148.13 42.43 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.361 0.6 . . . . 0.0 111.989 -171.522 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 750' ' ' ASP . . . . . 0.905 ' HB2' ' HA ' ' A' ' 713' ' ' VAL . 54.0 t0 -95.86 109.24 21.61 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.089 -0.959 . . . . 0.0 109.033 177.287 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 751' ' ' GLU . . . . . 0.727 ' HG3' HH12 ' A' ' 714' ' ' ARG . 9.2 mt-10 67.66 -150.76 0.17 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.423 -177.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 752' ' ' VAL . . . . . . . . . . . . . 59.0 t -88.03 116.96 30.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.17 0.509 . . . . 0.0 111.815 -172.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 6.1 p -95.97 156.4 3.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.016 171.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.7 41.5 0.57 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.952 0.406 . . . . 0.0 111.887 -176.537 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.77 -170.44 2.9 Favored 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 179.044 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 756' ' ' LYS . . . . . 0.601 ' O ' ' HB2' ' A' ' 757' ' ' TRP . 0.0 OUTLIER -117.22 -77.28 0.57 Allowed 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 170.138 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 757' ' ' TRP . . . . . 0.601 ' HB2' ' O ' ' A' ' 756' ' ' LYS . 10.7 t-105 152.93 109.21 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.41 0 O-C-N 124.76 1.288 . . . . 0.0 110.359 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.81 75.89 4.24 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 171.017 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 759' ' ' GLY . . . . . 0.831 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -158.1 -143.52 3.68 Favored Glycine 0 N--CA 1.444 -0.798 0 CA-C-N 115.681 -0.69 . . . . 0.0 112.381 -175.806 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 760' ' ' ARG . . . . . 0.434 HH11 ' HD3' ' A' ' 760' ' ' ARG . 0.0 OUTLIER -77.63 -55.72 5.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.767 0.283 . . . . 0.0 111.105 -178.051 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -166.51 149.12 6.78 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.746 -179.08 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 762' ' ' VAL . . . . . 0.433 HG13 ' O ' ' A' ' 779' ' ' GLY . 2.5 p -116.64 131.03 70.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 121.006 0.431 . . . . 0.0 110.572 178.641 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 763' ' ' VAL . . . . . 0.596 HG11 HD21 ' A' ' 791' ' ' LEU . 38.9 t -110.54 111.34 35.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.956 -0.565 . . . . 0.0 109.938 179.315 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 764' ' ' THR . . . . . 0.412 ' HA ' HG22 ' A' ' 749' ' ' THR . 1.5 m -103.47 122.18 44.37 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.21 -176.518 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 765' ' ' PHE . . . . . 0.498 ' CZ ' HD22 ' A' ' 791' ' ' LEU . 36.5 m-85 -92.16 123.98 35.91 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 175.386 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 766' ' ' CYS . . . . . 0.478 ' SG ' ' HB ' ' A' ' 782' ' ' VAL . 1.3 m -96.4 132.89 41.47 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.762 0.315 . . . . 0.0 110.814 -176.158 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.83 -57.01 1.35 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.614 179.481 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 2.7 tpm_? -136.15 -43.36 0.64 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.17 0.509 . . . . 0.0 110.288 177.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 10.5 m170 -89.6 110.51 21.37 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.759 179.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 5.1 mt -116.87 83.26 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-O 121.109 0.48 . . . . 0.0 110.003 178.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -125.71 13.18 7.3 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.302 179.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 772' ' ' ILE . . . . . 0.431 ' HA ' ' HD3' ' A' ' 773' ' ' PRO . 42.6 mm -105.36 132.78 20.58 Favored Pre-proline 0 C--N 1.322 -0.6 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 177.868 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 773' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 772' ' ' ILE . 36.0 Cg_exo -61.7 150.41 85.83 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.771 2.314 . . . . 0.0 112.381 178.016 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . 0.576 ' HG ' ' H ' ' A' ' 776' ' ' LYS . 0.5 OUTLIER -97.45 -162.34 0.95 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.602 179.874 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 775' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -62.4 8.31 0.05 Allowed 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 113.307 0.855 . . . . 0.0 113.307 179.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . 0.576 ' H ' ' HG ' ' A' ' 774' ' ' LEU . 7.6 ptmt -65.07 -18.26 65.15 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 165.692 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 777' ' ' ALA . . . . . 0.661 ' HB3' ' HB2' ' A' ' 780' ' ' GLU . . . -105.83 161.17 23.63 Favored Pre-proline 0 N--CA 1.451 -0.415 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.79 176.099 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 778' ' ' PRO . . . . . 0.474 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 57.2 Cg_endo -69.77 -9.6 26.5 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.781 2.321 . . . . 0.0 114.47 -172.305 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 779' ' ' GLY . . . . . 0.433 ' O ' HG13 ' A' ' 762' ' ' VAL . . . -156.35 23.54 0.51 Allowed Glycine 0 CA--C 1.505 -0.551 0 C-N-CA 119.838 -1.173 . . . . 0.0 112.603 -175.393 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 780' ' ' GLU . . . . . 0.661 ' HB2' ' HB3' ' A' ' 777' ' ' ALA . 0.4 OUTLIER -114.88 129.2 56.66 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 -178.601 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 18.6 m95 -129.62 139.13 51.51 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 179.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . 0.478 ' HB ' ' SG ' ' A' ' 766' ' ' CYS . 14.7 m -133.45 143.89 37.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 110.17 -0.308 . . . . 0.0 110.17 173.732 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 783' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -166.62 148.03 6.29 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.536 176.319 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -102.57 102.35 12.58 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.38 178.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 785' ' ' VAL . . . . . 0.454 HG23 HD13 ' A' ' 791' ' ' LEU . 0.0 OUTLIER -154.7 162.8 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.587 -0.279 . . . . 0.0 110.252 -179.925 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -100.4 32.23 3.12 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.115 -179.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 787' ' ' ALA . . . . . 0.482 ' HB2' ' HG ' ' A' ' 718' ' ' LEU . . . 56.5 79.15 0.34 Allowed Pre-proline 0 N--CA 1.465 0.291 0 CA-C-N 116.064 -0.516 . . . . 0.0 112.006 178.081 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 788' ' ' PRO . . . . . 0.627 ' HB2' ' OE2' ' A' ' 790' ' ' GLU . 10.2 Cg_endo -88.35 -128.4 0.01 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 122.948 2.432 . . . . 0.0 111.278 175.544 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 789' ' ' HIS . . . . . 0.425 ' H ' ' HB2' ' A' ' 788' ' ' PRO . 14.2 p-80 -114.06 1.09 14.52 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.875 0.369 . . . . 0.0 111.038 -179.18 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 790' ' ' GLU . . . . . 0.627 ' OE2' ' HB2' ' A' ' 788' ' ' PRO . 1.7 pm0 -92.36 -44.51 8.67 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.334 -176.956 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 791' ' ' LEU . . . . . 0.596 HD21 HG11 ' A' ' 763' ' ' VAL . 0.2 OUTLIER -71.18 -42.48 11.91 Favored Pre-proline 0 CA--C 1.535 0.387 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -177.769 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 792' ' ' PRO . . . . . 0.543 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 10.3 Cg_endo -57.83 -29.37 85.82 Favored 'Trans proline' 0 C--N 1.353 0.8 0 C-N-CA 121.261 1.307 . . . . 0.0 111.607 172.048 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -74.34 -34.29 63.37 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.258 175.824 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 794' ' ' LEU . . . . . 0.404 ' HA ' HD22 ' A' ' 794' ' ' LEU . 2.0 tm? -60.31 -43.24 96.5 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.671 174.512 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 795' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.29 -39.77 94.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.566 177.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 796' ' ' ALA . . . . . 0.723 ' HB3' HD11 ' A' ' 801' ' ' ILE . . . -63.54 -46.31 86.58 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.788 178.653 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 797' ' ' ARG . . . . . 0.926 ' HA ' ' HB ' ' A' ' 801' ' ' ILE . 0.0 OUTLIER -65.51 -34.8 79.12 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.477 -0.328 . . . . 0.0 110.37 179.037 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 798' ' ' ILE . . . . . 0.431 ' N ' ' HG3' ' A' ' 797' ' ' ARG . 0.1 OUTLIER -65.49 -25.92 38.03 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.527 179.878 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.03 -65.36 0.69 Allowed 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.309 -0.405 . . . . 0.0 109.936 175.352 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 800' ' ' LEU . . . . . 0.502 ' HA ' HD22 ' A' ' 800' ' ' LEU . 0.4 OUTLIER -177.27 50.88 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.062 177.444 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 801' ' ' ILE . . . . . 0.926 ' HB ' ' HA ' ' A' ' 797' ' ' ARG . 55.0 mt -112.67 92.45 2.08 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.752 0 CA-C-O 122.105 0.955 . . . . 0.0 108.88 176.404 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 802' ' ' GLU . . . . . 0.408 ' H ' ' HG3' ' A' ' 802' ' ' GLU . 0.0 OUTLIER -114.5 46.5 1.37 Allowed 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 113.963 -1.471 . . . . 0.0 108.651 -175.83 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 803' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -79.84 76.08 6.53 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.905 -172.697 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 804' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -136.59 144.5 44.17 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 171.084 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -61.8 106.06 0.64 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.99 0.424 . . . . 0.0 110.929 -178.159 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -75.62 140.08 42.41 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.922 -177.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -148.39 110.52 3.68 Favored Pre-proline 0 C--N 1.326 -0.427 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.337 177.563 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 808' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -83.99 168.79 11.99 Favored 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 122.81 2.34 . . . . 0.0 112.333 179.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -90.21 133.94 34.6 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.663 -179.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -85.87 145.98 26.94 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.225 177.806 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -140.84 160.22 40.51 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.547 179.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -84.23 140.81 39.5 Favored Pre-proline 0 C--N 1.321 -0.661 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.584 179.583 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -63.73 129.7 25.65 Favored 'Trans proline' 0 C--O 1.235 0.329 0 C-N-CA 122.453 2.102 . . . . 0.0 112.148 178.092 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 2.3 m -56.43 117.21 3.62 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.907 -179.378 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -120.13 136.33 54.65 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.172 -176.674 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -123.36 97.82 5.58 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.757 177.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 5.4 mmtm -102.0 86.65 2.92 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.756 -178.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -160.05 138.99 10.71 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.166 178.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 3.0 p -76.04 92.3 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-O 121.882 0.848 . . . . 0.0 109.944 -179.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -89.29 45.53 1.3 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.052 -175.28 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -120.75 93.11 3.93 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.353 0.597 . . . . 0.0 110.781 -178.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -144.02 77.28 1.54 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.329 -0.851 . . . . 0.0 108.965 173.104 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 823' ' ' ASP . . . . . 0.45 ' HB3' ' SD ' ' A' ' 826' ' ' MET . 1.0 OUTLIER -123.41 103.04 8.24 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.884 -175.221 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -87.28 -98.2 0.08 Allowed 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 174.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 1.4 tpp -79.49 90.77 5.09 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 171.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 826' ' ' MET . . . . . 0.45 ' SD ' ' HB3' ' A' ' 823' ' ' ASP . 0.0 OUTLIER -93.3 105.74 17.78 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.142 -173.938 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 827' ' ' ILE . . . . . . . . . . . . . 6.4 mm -115.12 129.25 71.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.342 178.244 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -94.81 131.9 40.18 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 178.739 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -113.84 95.89 4.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 176.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 830' ' ' VAL . . . . . . . . . . . . . 10.7 t -97.18 88.18 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.147 -179.601 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 831' ' ' ASP . . . . . 0.661 ' OD1' ' HB2' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -104.65 154.61 19.74 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.087 -176.077 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -87.63 -22.82 24.5 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -175.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -130.74 114.17 16.61 Favored Pre-proline 0 N--CA 1.465 0.32 0 O-C-N 121.394 -0.817 . . . . 0.0 111.951 -174.433 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -42.44 -52.93 4.02 Favored 'Trans proline' 0 N--CA 1.479 0.632 0 C-N-CA 124.731 3.621 . . . . 0.0 115.315 -172.134 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 835' ' ' ILE . . . . . 0.413 ' O ' ' HB3' ' A' ' 838' ' ' ARG . 3.6 tp -58.67 -40.02 78.06 Favored 'Isoleucine or valine' 0 C--O 1.24 0.572 0 CA-C-O 121.437 0.637 . . . . 0.0 111.063 -178.149 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 836' ' ' ASN . . . . . 0.468 ' HB3' ' HZ2' ' A' ' 925' ' ' LYS . 3.7 m-20 -70.23 -40.5 74.45 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.608 -179.703 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 837' ' ' ARG . . . . . 0.661 ' HB2' ' OD1' ' A' ' 831' ' ' ASP . 0.0 OUTLIER -54.72 -44.53 73.57 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.55 174.755 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 838' ' ' ARG . . . . . 0.413 ' HB3' ' O ' ' A' ' 835' ' ' ILE . 0.0 OUTLIER -51.54 -46.54 63.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.557 178.766 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.5 -48.06 79.14 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.881 -0.6 . . . . 0.0 112.042 -176.251 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 840' ' ' LEU . . . . . 0.456 HD21 ' NZ ' ' A' ' 925' ' ' LYS . 0.0 OUTLIER -70.87 -37.84 73.08 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 122.037 -0.414 . . . . 0.0 110.928 -178.13 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -66.35 -31.69 72.63 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.241 0.543 . . . . 0.0 110.366 178.343 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -65.39 -42.47 92.6 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.83 175.35 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 843' ' ' GLN . . . . . 0.416 ' HG3' ' HA ' ' A' ' 929' ' ' LEU . 0.0 OUTLIER -64.96 -44.92 87.8 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.33 178.581 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 844' ' ' LEU . . . . . 0.417 ' HA ' HD21 ' A' ' 847' ' ' LEU . 0.0 OUTLIER -60.95 -43.55 98.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.086 178.752 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -64.71 -42.4 97.22 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.913 -0.66 . . . . 0.0 112.282 179.682 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 51.0 m -77.02 -9.58 58.8 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.904 0.383 . . . . 0.0 111.185 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 847' ' ' LEU . . . . . 0.529 HD22 ' HB2' ' A' ' 849' ' ' TYR . 0.0 OUTLIER -87.69 -28.31 21.88 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 175.333 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 106.97 18.32 10.71 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.488 174.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 849' ' ' TYR . . . . . 0.529 ' HB2' HD22 ' A' ' 847' ' ' LEU . 5.5 m-30 -106.38 165.69 11.08 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.94 -0.392 . . . . 0.0 109.94 179.326 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -95.17 117.49 30.32 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.931 0.396 . . . . 0.0 110.343 -178.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -100.59 127.17 47.05 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.276 -176.189 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.64 116.66 32.32 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 172.153 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.71 132.93 35.51 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 -171.883 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 854' ' ' ALA . . . . . . . . . . . . . . . -151.02 147.2 26.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.769 176.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 855' ' ' ASN . . . . . 0.652 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 9.1 t-20 -128.13 73.19 1.45 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.982 176.144 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 856' ' ' ASP . . . . . 0.652 ' HB2' ' O ' ' A' ' 855' ' ' ASN . 2.1 t70 162.18 159.74 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.213 175.865 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -81.66 -30.98 34.32 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.137 178.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 858' ' ' VAL . . . . . 0.435 HG21 ' OD1' ' A' ' 856' ' ' ASP . 3.3 m -73.23 -31.76 35.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.688 0.28 . . . . 0.0 111.074 -178.222 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -67.79 -42.75 81.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.236 0.541 . . . . 0.0 109.973 178.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 860' ' ' ALA . . . . . 0.433 ' O ' ' HB2' ' A' ' 864' ' ' LEU . . . -64.77 -44.69 89.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.641 177.43 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 861' ' ' LEU . . . . . 0.473 HD22 ' HA ' ' A' ' 861' ' ' LEU . 0.1 OUTLIER -61.06 -34.25 74.59 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.717 178.348 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -61.17 -54.57 42.66 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.915 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 14.4 p -71.78 -32.45 44.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.731 0.301 . . . . 0.0 110.824 -177.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 864' ' ' LEU . . . . . 0.433 ' HB2' ' O ' ' A' ' 860' ' ' ALA . 0.2 OUTLIER -63.5 -45.12 92.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.771 178.311 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 15.2 m -71.71 -21.76 61.73 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.801 -179.192 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.28 -69.18 0.37 Allowed 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 173.811 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 867' ' ' ASN . . . . . 0.612 ' O ' ' HB2' ' A' ' 868' ' ' HIS . 2.3 t-20 159.17 127.4 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.609 0 O-C-N 124.274 0.984 . . . . 0.0 110.021 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 868' ' ' HIS . . . . . 0.612 ' HB2' ' O ' ' A' ' 867' ' ' ASN . 14.3 m-70 134.92 171.7 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.005 0 O-C-N 125.202 1.564 . . . . 0.0 110.528 165.667 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 869' ' ' ILE . . . . . 0.584 ' HB ' ' O ' ' A' ' 868' ' ' HIS . 1.5 mp 86.0 129.57 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 O-C-N 124.461 1.1 . . . . 0.0 111.109 174.748 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -112.76 -16.58 12.74 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.435 -178.311 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 871' ' ' ILE . . . . . 0.468 HG22 ' N ' ' A' ' 872' ' ' VAL . 2.1 mt -145.95 137.69 19.69 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 178.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 872' ' ' VAL . . . . . 0.53 ' HB ' HG23 ' A' ' 899' ' ' VAL . 7.2 t -122.39 135.75 61.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.676 0.274 . . . . 0.0 110.962 -177.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 873' ' ' LEU . . . . . 0.448 HD21 ' HB ' ' A' ' 900' ' ' ILE . 10.0 mt -110.88 136.11 50.4 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 173.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -120.66 104.96 10.33 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.26 178.8 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 875' ' ' ASP . . . . . 0.657 ' HB2' ' HA ' ' A' ' 831' ' ' ASP . 0.8 OUTLIER -89.17 105.68 17.94 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.543 -176.825 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 876' ' ' VAL . . . . . 0.401 ' HB ' HG23 ' A' ' 903' ' ' THR . 0.2 OUTLIER -95.95 100.02 10.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.548 -177.145 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 877' ' ' ASN . . . . . 0.624 ' HA ' ' HB1' ' A' ' 904' ' ' ALA . 0.8 OUTLIER -73.11 -43.0 62.33 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.758 176.368 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.98 111.93 60.33 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.256 174.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 879' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -44.09 -56.57 2.4 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 123.884 3.056 . . . . 0.0 114.178 -171.523 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -158.89 140.92 13.75 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.498 0.189 . . . . 0.0 110.575 179.785 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 5.2 tpt -178.85 -74.65 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.385 178.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -117.86 -28.23 5.99 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.941 -177.677 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -83.63 35.62 2.85 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.854 -0.689 . . . . 0.0 112.66 -177.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 23.3 p90 -89.28 -22.4 22.71 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 -178.292 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -61.5 -31.35 71.34 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.752 174.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.92 -53.89 53.14 Favored 'General case' 0 CA--C 1.528 0.127 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.609 179.613 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.49 -36.19 80.62 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.839 -178.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 888' ' ' GLN . . . . . 0.451 ' O ' ' HB2' ' A' ' 892' ' ' GLN . 60.9 mm-40 -61.08 -50.48 73.11 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.004 179.613 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.59 -44.72 95.93 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.485 -177.534 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 890' ' ' ILE . . . . . . . . . . . . . 18.0 mt -69.15 -46.45 77.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.059 -177.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 891' ' ' ARG . . . . . 0.45 ' HD3' ' HA ' ' A' ' 888' ' ' GLN . 2.3 ptm180 -66.96 -23.97 66.01 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.893 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 892' ' ' GLN . . . . . 0.451 ' HB2' ' O ' ' A' ' 888' ' ' GLN . 1.5 tp60 -71.88 -60.34 2.28 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.71 177.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -157.2 48.24 0.43 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.594 -176.349 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 894' ' ' GLY . . . . . 0.44 ' HA3' HD21 ' A' ' 861' ' ' LEU . . . -141.86 0.06 1.57 Allowed Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.35 176.508 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 895' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -108.4 110.74 22.36 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.973 0.416 . . . . 0.0 110.763 -178.312 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -134.54 22.57 3.67 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.563 0.697 . . . . 0.0 109.717 175.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 897' ' ' LEU . . . . . 0.403 ' HB2' ' HD2' ' A' ' 898' ' ' PRO . 0.4 OUTLIER -159.51 164.46 20.44 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.748 -173.666 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 898' ' ' PRO . . . . . 0.403 ' HD2' ' HB2' ' A' ' 897' ' ' LEU . 38.0 Cg_endo -67.07 128.76 19.2 Favored 'Trans proline' 0 C--O 1.241 0.629 0 C-N-CA 122.316 2.011 . . . . 0.0 111.941 176.129 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 899' ' ' VAL . . . . . 0.775 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 69.0 t -115.61 128.31 72.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.143 178.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 900' ' ' ILE . . . . . 0.454 ' HA ' ' O ' ' A' ' 921' ' ' SER . 3.0 mt -108.52 121.91 62.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.008 179.263 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -96.32 126.95 9.0 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 120.686 -0.768 . . . . 0.0 111.907 -178.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 902' ' ' VAL . . . . . 0.506 HG11 ' HA ' ' A' ' 925' ' ' LYS . 1.1 t -104.59 97.56 5.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 177.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 903' ' ' THR . . . . . 0.64 ' HB ' ' HB1' ' A' ' 906' ' ' ALA . 0.0 OUTLIER -90.27 135.95 33.35 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.959 -172.895 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 904' ' ' ALA . . . . . 0.624 ' HB1' ' HA ' ' A' ' 877' ' ' ASN . . . -96.31 115.06 26.83 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.705 178.565 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 60.8 45.62 9.72 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 121.207 0.527 . . . . 0.0 111.238 177.267 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 906' ' ' ALA . . . . . 0.64 ' HB1' ' HB ' ' A' ' 903' ' ' THR . . . -98.27 98.86 10.07 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.046 177.41 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 11.1 tp -45.26 -45.15 11.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.521 176.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -126.39 78.96 1.82 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.019 0.438 . . . . 0.0 110.582 177.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.31 -41.37 98.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.527 -178.868 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 910' ' ' GLU . . . . . 0.511 ' H ' ' HG2' ' A' ' 910' ' ' GLU . 0.1 OUTLIER -64.02 -31.02 72.05 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.091 -179.753 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 12.6 tttt -68.87 -41.64 78.08 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.259 179.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 69.9 tp60 -63.13 -36.24 82.96 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.134 177.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 913' ' ' ARG . . . . . 0.562 ' HB2' ' SG ' ' A' ' 922' ' ' CYS . 3.7 ttp180 -58.66 -46.96 86.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.944 177.814 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 7.4 m -74.94 -26.1 59.36 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.549 -176.171 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 1.2 tp -70.02 -51.74 29.81 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.954 0.407 . . . . 0.0 111.099 179.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -78.52 -42.53 29.24 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.506 -178.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 2.3 m 51.15 47.8 24.2 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.088 0.47 . . . . 0.0 111.573 -176.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -133.06 24.43 3.79 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.013 179.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 919' ' ' MET . . . . . 0.775 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -130.14 -101.45 0.31 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.576 0.226 . . . . 0.0 110.755 -177.198 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 920' ' ' ASP . . . . . 0.405 ' HB2' ' O ' ' A' ' 919' ' ' MET . 10.4 t70 168.2 -64.83 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.993 0.917 . . . . 0.0 108.801 179.83 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 921' ' ' SER . . . . . 0.454 ' O ' ' HA ' ' A' ' 900' ' ' ILE . 70.9 m -139.23 163.11 33.32 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.653 179.018 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 922' ' ' CYS . . . . . 0.562 ' SG ' ' HB2' ' A' ' 913' ' ' ARG . 0.0 OUTLIER -137.6 158.24 44.8 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.03 0.443 . . . . 0.0 111.496 -177.506 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 923' ' ' LEU . . . . . 0.604 HD21 HG23 ' A' ' 935' ' ' THR . 0.0 OUTLIER -146.8 168.35 21.62 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.232 175.218 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 1.4 m -78.37 142.71 37.46 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.064 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 925' ' ' LYS . . . . . 0.506 ' HA ' HG11 ' A' ' 902' ' ' VAL . 0.0 OUTLIER -54.35 -39.95 78.8 Favored Pre-proline 0 CA--C 1.538 0.502 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 179.433 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -62.11 74.03 0.1 OUTLIER 'Trans proline' 0 C--N 1.36 1.162 0 C-N-CA 122.077 1.852 . . . . 0.0 112.194 171.184 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 927' ' ' VAL . . . . . 0.494 HG11 ' HB ' ' A' ' 932' ' ' ILE . 0.5 OUTLIER -98.47 140.17 18.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.968 -176.638 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.07 163.41 12.44 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.554 177.357 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 929' ' ' LEU . . . . . 0.483 HD21 ' HA ' ' A' ' 929' ' ' LEU . 0.0 OUTLIER -56.43 -46.41 80.29 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.355 -177.271 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -67.57 -34.38 76.93 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.028 0.442 . . . . 0.0 110.799 -177.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 62.4 t -69.61 -48.77 63.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.448 -178.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 932' ' ' ILE . . . . . 0.494 ' HB ' HG11 ' A' ' 927' ' ' VAL . 2.0 tp -67.28 -37.36 78.93 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 CA-C-O 120.64 0.257 . . . . 0.0 110.589 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 933' ' ' LYS . . . . . 0.464 ' N ' HG21 ' A' ' 932' ' ' ILE . 0.8 OUTLIER -61.77 -47.64 84.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.169 176.87 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 934' ' ' GLN . . . . . 0.581 ' O ' ' HB2' ' A' ' 938' ' ' LEU . 1.9 tp60 -60.52 -51.08 70.95 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.743 -179.175 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 935' ' ' THR . . . . . 0.604 HG23 HD21 ' A' ' 923' ' ' LEU . 8.6 m -61.87 -47.63 84.16 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.529 -177.874 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 936' ' ' LEU . . . . . 0.497 HD11 ' HA ' ' A' ' 936' ' ' LEU . 0.9 OUTLIER -67.73 -47.84 68.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.385 -176.014 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 67.9 m -67.87 -39.46 83.71 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 111.708 0.262 . . . . 0.0 111.708 -178.181 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 938' ' ' LEU . . . . . 0.581 ' HB2' ' O ' ' A' ' 934' ' ' GLN . 0.2 OUTLIER -62.35 -44.31 96.78 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.987 0.422 . . . . 0.0 110.45 179.101 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -72.79 -30.65 64.26 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.929 -179.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -64.2 -35.82 82.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.857 0.361 . . . . 0.0 110.612 176.2 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 941' ' ' GLU . . . . . 0.414 ' HG3' ' N ' ' A' ' 942' ' ' ARG . 0.0 OUTLIER -78.9 -31.85 45.5 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.474 178.256 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 942' ' ' ARG . . . . . 0.624 ' HG3' ' N ' ' A' ' 943' ' ' VAL . 0.0 OUTLIER -65.59 -46.88 77.69 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 178.133 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 943' ' ' VAL . . . . . 0.624 ' N ' ' HG3' ' A' ' 942' ' ' ARG . 30.7 m -69.65 -28.25 36.76 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.265 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.08 179.503 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.7 -44.23 85.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.252 174.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 5.1 mttt -64.44 -45.06 89.12 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.315 -179.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.75 -35.64 77.35 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.832 0.349 . . . . 0.0 111.456 -178.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 27.4 mtt-85 -71.76 -50.38 30.52 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.861 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -150.39 121.61 7.8 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.404 -176.035 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 24.4 m . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.202 -0.904 . . . . 0.0 109.333 173.941 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.028 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 86.06 -96.79 2.14 Favored Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.014 -178.106 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . 151.13 100.85 0.21 Allowed Glycine 0 N--CA 1.443 -0.844 0 C-N-CA 120.734 -0.746 . . . . 0.0 111.972 179.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -61.94 141.85 57.78 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 176.357 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . -122.55 -117.02 2.38 Favored Glycine 0 N--CA 1.446 -0.683 0 C-N-CA 120.497 -0.858 . . . . 0.0 112.59 -173.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -112.49 163.11 9.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 120.834 0.35 . . . . 0.0 110.779 -175.392 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -95.96 58.02 1.86 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.764 -175.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 703' ' ' GLY . . . . . 0.429 ' C ' ' H ' ' A' ' 705' ' ' SER . . . -72.28 -70.81 1.15 Allowed Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 110.929 -0.868 . . . . 0.0 110.929 175.188 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.538 ' HG ' HD11 ' A' ' 801' ' ' ILE . 2.1 mp 71.98 -25.29 0.18 Allowed 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 172.606 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 705' ' ' SER . . . . . 0.45 ' HA ' ' O ' ' A' ' 730' ' ' GLY . 0.7 OUTLIER -73.67 68.59 1.23 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.148 0.499 . . . . 0.0 111.825 -178.829 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . -170.66 25.63 0.1 OUTLIER Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 121.042 -0.599 . . . . 0.0 112.038 176.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 707' ' ' LYS . . . . . 0.522 ' HE3' ' HB3' ' A' ' 744' ' ' GLU . 26.1 mmtm -133.7 137.56 45.35 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 178.014 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 708' ' ' ARG . . . . . 0.73 ' HG2' HG22 ' A' ' 732' ' ' VAL . 6.5 mtp85 -92.11 136.24 33.34 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 121.369 0.604 . . . . 0.0 111.218 -173.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 1.7 t -104.31 109.97 22.02 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 171.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 710' ' ' TRP . . . . . 0.404 ' CZ2' ' HD3' ' A' ' 708' ' ' ARG . 89.2 m95 -90.13 96.23 10.57 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.815 0.817 . . . . 0.0 109.156 -178.526 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 711' ' ' LEU . . . . . . . . . . . . . 1.3 tp -95.64 104.65 16.58 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 114.611 -1.177 . . . . 0.0 111.305 -169.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -103.51 30.92 4.66 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.786 0.803 . . . . 0.0 109.345 174.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 713' ' ' VAL . . . . . 0.524 ' HA ' ' HB3' ' A' ' 750' ' ' ASP . 49.1 t -92.98 115.43 31.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 114.954 -1.021 . . . . 0.0 109.833 178.244 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 32.2 mtp85 -110.1 17.92 20.53 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.678 0.752 . . . . 0.0 110.069 -179.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 715' ' ' ASN . . . . . 0.437 ' H ' HG13 ' A' ' 713' ' ' VAL . 18.8 t-20 -92.05 109.78 21.14 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.026 -0.988 . . . . 0.0 108.845 173.054 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -45.41 -53.49 8.63 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 -172.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.42 -48.59 81.1 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.1 0.476 . . . . 0.0 110.747 -178.56 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 718' ' ' LEU . . . . . 0.792 ' HG ' ' HB3' ' A' ' 787' ' ' ALA . 0.2 OUTLIER -68.76 -48.35 63.94 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.684 -176.292 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 719' ' ' CYS . . . . . 0.455 ' O ' ' HB3' ' A' ' 723' ' ' GLU . 16.3 p -67.29 -46.66 72.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.06 -174.825 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -62.48 -34.56 77.09 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.647 -0.252 . . . . 0.0 110.967 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 721' ' ' PHE . . . . . 0.409 ' HE2' ' HG3' ' A' ' 792' ' ' PRO . 93.7 t80 -65.64 -56.34 12.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.871 0.367 . . . . 0.0 110.366 178.984 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 91.9 mt -61.53 -45.73 92.92 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.237 -177.35 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 723' ' ' GLU . . . . . 0.577 ' HG3' ' N ' ' A' ' 724' ' ' THR . 0.0 OUTLIER -59.78 -42.2 92.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.115 -175.891 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 724' ' ' THR . . . . . 0.577 ' N ' ' HG3' ' A' ' 723' ' ' GLU . 8.6 m -77.43 -41.41 39.95 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.657 0.265 . . . . 0.0 111.499 -177.877 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 25.9 m -65.0 -36.62 85.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.835 0.35 . . . . 0.0 111.297 -178.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 726' ' ' LEU . . . . . 0.494 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 50.9 mt -79.31 -42.72 25.1 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.562 -176.654 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 727' ' ' GLN . . . . . 0.427 ' HG3' ' O ' ' A' ' 724' ' ' THR . 3.5 pp0? -62.69 -19.61 64.05 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 120.676 0.274 . . . . 0.0 111.318 -177.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 8.5 mtp-105 -57.42 -39.87 77.11 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.082 178.401 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -96.31 6.26 49.17 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.056 -177.268 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 730' ' ' GLY . . . . . 0.45 ' O ' ' HA ' ' A' ' 705' ' ' SER . . . 94.26 7.65 60.6 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.556 -0.83 . . . . 0.0 113.09 176.422 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 731' ' ' ILE . . . . . 0.494 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 36.4 mm -67.23 116.4 6.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 176.096 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 732' ' ' VAL . . . . . 0.73 HG22 ' HG2' ' A' ' 708' ' ' ARG . 3.0 m -79.56 90.97 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 121.587 0.708 . . . . 0.0 111.097 -173.488 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 733' ' ' VAL . . . . . 0.519 HG21 ' HA ' ' A' ' 723' ' ' GLU . 21.8 t -72.4 135.71 27.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.097 178.393 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -143.89 127.4 16.94 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.15 -177.42 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.3 114.07 2.25 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.127 178.576 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 43.0 t80 -87.25 100.63 12.83 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.107 0.479 . . . . 0.0 110.601 -178.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -104.62 -11.42 16.94 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.205 177.168 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 139.92 68.56 0.04 OUTLIER Glycine 0 N--CA 1.448 -0.519 0 N-CA-C 111.211 -0.756 . . . . 0.0 111.211 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 739' ' ' GLN . . . . . 0.448 ' HB3' ' H ' ' A' ' 740' ' ' GLU . 14.7 mp0 -110.0 -138.46 0.37 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.885 0.374 . . . . 0.0 111.376 -174.672 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 740' ' ' GLU . . . . . 0.448 ' H ' ' HB3' ' A' ' 739' ' ' GLN . 2.2 tp10 -108.21 133.84 20.39 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.969 -175.032 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 741' ' ' PRO . . . . . 0.624 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 1.1 Cg_endo -83.39 123.54 3.44 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 123.241 2.627 . . . . 0.0 112.324 177.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 742' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.28 132.47 21.07 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.437 176.272 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -66.2 -5.33 12.21 Favored 'Trans proline' 0 N--CA 1.475 0.411 0 C-N-CA 123.151 2.567 . . . . 0.0 113.53 -175.286 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 744' ' ' GLU . . . . . 0.522 ' HB3' ' HE3' ' A' ' 707' ' ' LYS . 5.4 mm-40 -116.38 0.52 12.81 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.837 0.351 . . . . 0.0 110.894 177.622 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 745' ' ' ASP . . . . . 0.436 ' CG ' ' HB2' ' A' ' 708' ' ' ARG . 30.8 m-20 -103.93 165.61 10.93 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.44 -176.328 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 746' ' ' VAL . . . . . 0.478 HG22 HD11 ' A' ' 795' ' ' LEU . 2.6 p -128.35 136.04 61.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.252 0.548 . . . . 0.0 111.603 -174.54 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 747' ' ' LEU . . . . . 0.457 HD13 ' HB2' ' A' ' 757' ' ' TRP . 0.6 OUTLIER -99.72 104.91 16.67 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.866 176.895 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 748' ' ' ILE . . . . . 0.509 HD11 ' HG ' ' A' ' 795' ' ' LEU . 24.9 mt -98.96 109.54 24.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 109.157 -0.682 . . . . 0.0 109.157 174.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 14.7 t -117.43 158.51 24.36 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.205 -174.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 750' ' ' ASP . . . . . 0.524 ' HB3' ' HA ' ' A' ' 713' ' ' VAL . 0.0 OUTLIER -105.33 136.54 44.69 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.69 174.786 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 60.87 -167.45 0.19 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.882 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 752' ' ' VAL . . . . . . . . . . . . . 3.6 t -82.2 91.0 2.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.301 -175.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 4.8 p -78.7 -18.06 13.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.405 175.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 1.4 m 56.25 56.8 5.47 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.358 -179.102 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.6 152.43 50.82 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 176.031 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 756' ' ' LYS . . . . . 0.422 ' HD3' ' HA ' ' A' ' 756' ' ' LYS . 42.4 mmtt -93.93 -43.36 8.59 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.262 -177.912 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 757' ' ' TRP . . . . . 0.624 ' CH2' ' HA ' ' A' ' 741' ' ' PRO . 71.3 t-105 68.75 96.66 0.06 Allowed 'General case' 0 N--CA 1.464 0.265 0 O-C-N 124.019 0.825 . . . . 0.0 111.709 178.506 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -81.04 63.87 5.57 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.293 0.568 . . . . 0.0 110.501 175.622 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 759' ' ' GLY . . . . . . . . . . . . . . . -128.89 -149.77 6.99 Favored Glycine 0 N--CA 1.446 -0.698 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.966 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 2.0 ttt-85 -70.43 -49.36 49.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.782 0.325 . . . . 0.0 110.157 177.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -166.2 153.07 9.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.526 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 762' ' ' VAL . . . . . 0.431 ' HB ' ' HB3' ' A' ' 757' ' ' TRP . 7.7 p -119.03 132.1 69.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 176.626 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 763' ' ' VAL . . . . . 0.635 HG12 HD23 ' A' ' 791' ' ' LEU . 1.4 t -123.02 125.15 71.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 120.832 0.349 . . . . 0.0 110.649 -177.925 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 764' ' ' THR . . . . . 0.902 ' HB ' HG12 ' A' ' 782' ' ' VAL . 86.3 m -111.68 124.33 52.1 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.346 -179.282 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 765' ' ' PHE . . . . . 0.57 ' CD2' HD22 ' A' ' 718' ' ' LEU . 0.7 OUTLIER -95.41 110.32 22.37 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 172.672 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.25 133.1 38.13 Favored 'General case' 0 C--N 1.317 -0.837 0 C-N-CA 120.527 -0.469 . . . . 0.0 109.946 -178.266 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.7 -38.5 3.7 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.296 -179.407 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.67 -35.94 1.44 Allowed 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.288 -179.324 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 58.3 m80 -120.88 140.74 51.38 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.153 0.501 . . . . 0.0 111.212 -175.11 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 3.3 mt -123.97 103.25 12.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.484 179.12 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -121.41 -19.65 3.44 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.18 178.099 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 772' ' ' ILE . . . . . 0.428 ' HA ' ' HD3' ' A' ' 773' ' ' PRO . 18.8 mm -94.56 132.69 28.24 Favored Pre-proline 0 C--N 1.326 -0.416 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 773' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 772' ' ' ILE . 3.9 Cg_exo -80.31 164.86 21.5 Favored 'Trans proline' 0 N--CA 1.459 -0.552 0 C-N-CA 122.967 2.445 . . . . 0.0 112.45 179.848 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 774' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -91.95 -157.47 0.52 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.337 179.074 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 775' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -64.76 61.13 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 178.609 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.71 -12.4 17.69 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 169.026 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -136.32 150.1 69.77 Favored Pre-proline 0 N--CA 1.447 -0.585 0 CA-C-N 114.139 -1.391 . . . . 0.0 108.617 176.507 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -61.94 102.65 0.26 Allowed 'Trans proline' 0 C--O 1.233 0.254 0 C-N-CA 122.706 2.271 . . . . 0.0 113.174 -177.034 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 115.34 -4.58 21.74 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.481 -0.866 . . . . 0.0 113.548 174.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 780' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.33 122.74 39.53 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 117.217 0.508 . . . . 0.0 109.999 -179.197 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 781' ' ' TRP . . . . . 0.645 ' HZ3' HD11 ' A' ' 794' ' ' LEU . 13.0 m95 -133.78 134.9 43.47 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 -179.178 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . 0.902 HG12 ' HB ' ' A' ' 764' ' ' THR . 26.6 m -140.77 152.11 20.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 121.129 0.49 . . . . 0.0 110.735 174.557 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 783' ' ' HIS . . . . . . . . . . . . . 3.1 t-160 -155.67 119.84 4.57 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.276 174.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -89.49 100.14 13.0 Favored 'General case' 0 C--N 1.317 -0.833 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.689 -179.701 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 785' ' ' VAL . . . . . 0.547 HG21 ' HE1' ' A' ' 765' ' ' PHE . 0.0 OUTLIER -167.58 -172.46 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.527 179.365 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 786' ' ' ALA . . . . . 0.41 ' HA ' HD11 ' A' ' 718' ' ' LEU . . . -114.53 55.24 0.75 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.484 0.183 . . . . 0.0 111.468 -178.042 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 787' ' ' ALA . . . . . 0.792 ' HB3' ' HG ' ' A' ' 718' ' ' LEU . . . 51.52 61.99 11.81 Favored Pre-proline 0 N--CA 1.469 0.491 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.442 177.384 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 788' ' ' PRO . . . . . 0.428 ' HD3' ' N ' ' A' ' 787' ' ' ALA . 1.1 Cg_endo -84.0 46.24 1.96 Allowed 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 123.088 2.525 . . . . 0.0 112.837 -176.745 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 70.07 -15.73 0.32 Allowed 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 113.305 0.854 . . . . 0.0 113.305 174.167 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 790' ' ' GLU . . . . . 0.54 ' H ' ' HG3' ' A' ' 790' ' ' GLU . 0.0 OUTLIER -73.72 -51.76 15.49 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -175.39 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 791' ' ' LEU . . . . . 0.635 HD23 HG12 ' A' ' 763' ' ' VAL . 0.3 OUTLIER -58.91 -50.54 87.46 Favored Pre-proline 0 CA--C 1.534 0.354 0 N-CA-C 112.427 0.528 . . . . 0.0 112.427 -176.959 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 792' ' ' PRO . . . . . 0.507 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 10.8 Cg_endo -55.8 -33.45 88.19 Favored 'Trans proline' 0 C--N 1.357 0.987 0 C-N-CA 121.971 1.781 . . . . 0.0 112.258 177.283 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -66.4 -50.39 63.6 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 120.938 0.399 . . . . 0.0 110.723 178.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 794' ' ' LEU . . . . . 0.645 HD11 ' HZ3' ' A' ' 781' ' ' TRP . 1.0 OUTLIER -64.41 -33.8 76.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.926 179.683 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 795' ' ' LEU . . . . . 0.509 ' HG ' HD11 ' A' ' 748' ' ' ILE . 0.7 OUTLIER -67.25 -43.8 81.01 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.995 -179.092 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -60.25 -37.14 79.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.074 0.464 . . . . 0.0 110.621 178.25 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 797' ' ' ARG . . . . . 0.444 ' O ' ' HG ' ' A' ' 800' ' ' LEU . 0.0 OUTLIER -71.91 -48.78 43.12 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.225 179.124 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 798' ' ' ILE . . . . . 0.45 HG22 ' O ' ' A' ' 795' ' ' LEU . 0.6 OUTLIER -62.86 -18.02 20.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -176.979 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 799' ' ' TYR . . . . . 0.504 ' HB3' HD13 ' A' ' 801' ' ' ILE . 1.5 m-85 -63.22 -39.37 94.43 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 175.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 800' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 797' ' ' ARG . 6.1 mt 43.75 63.83 1.46 Allowed 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.232 177.739 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 801' ' ' ILE . . . . . 0.538 HD11 ' HG ' ' A' ' 704' ' ' LEU . 2.4 mt -96.11 -63.37 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.697 -179.784 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 64.51 11.91 6.99 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.884 178.464 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 803' ' ' MET . . . . . . . . . . . . . 12.5 mtt -98.24 160.18 14.46 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.134 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 804' ' ' GLU . . . . . 0.448 ' H ' ' HG3' ' A' ' 804' ' ' GLU . 0.0 OUTLIER -84.2 164.36 19.16 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.884 0.373 . . . . 0.0 110.025 177.362 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 4.0 m -144.23 129.58 18.85 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.309 178.493 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -130.18 161.61 30.73 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.782 179.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -156.86 103.7 1.94 Allowed Pre-proline 0 C--N 1.325 -0.489 0 CA-C-O 120.818 0.342 . . . . 0.0 110.723 -179.252 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 808' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -75.98 149.04 32.32 Favored 'Trans proline' 0 N--CA 1.462 -0.336 0 C-N-CA 123.017 2.478 . . . . 0.0 112.092 178.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -160.68 122.13 3.03 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.339 179.102 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 46.9 t30 -150.43 144.35 25.37 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.843 0.354 . . . . 0.0 111.076 179.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -137.4 146.96 45.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.38 178.344 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -148.27 93.58 4.37 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-O 120.913 0.387 . . . . 0.0 110.96 -179.323 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_endo -87.75 145.93 6.8 Favored 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 123.58 2.853 . . . . 0.0 112.237 178.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 14.9 m -153.63 134.61 13.91 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.731 178.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -152.17 125.01 8.48 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.203 176.895 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -137.78 150.19 47.02 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.755 0.312 . . . . 0.0 111.242 -177.935 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.77 144.14 0.62 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.758 176.127 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -160.66 120.29 2.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.608 0.242 . . . . 0.0 110.803 179.271 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 4.1 t -126.79 122.22 60.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.448 -179.475 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -144.18 82.43 1.7 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.0 0.429 . . . . 0.0 110.801 -178.298 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -130.22 149.41 51.93 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.491 -177.549 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 822' ' ' ASN . . . . . 0.454 ' HB3' ' H ' ' A' ' 823' ' ' ASP . 37.0 t30 -156.66 -110.5 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.686 176.839 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 823' ' ' ASP . . . . . 0.454 ' H ' ' HB3' ' A' ' 822' ' ' ASN . 25.9 t0 55.36 98.7 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.415 0.686 . . . . 0.0 112.232 -177.598 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -78.74 -91.88 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.491 -177.608 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 4.0 ttm -137.7 135.4 36.41 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 -178.176 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 826' ' ' MET . . . . . 0.56 ' HA ' ' HB2' ' A' ' 850' ' ' GLN . 21.2 ptp -108.43 129.09 55.27 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.663 0.744 . . . . 0.0 111.613 -177.122 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 827' ' ' ILE . . . . . 0.592 HG21 HD21 ' A' ' 873' ' ' LEU . 10.0 mm -109.82 144.17 18.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-N 114.864 -1.062 . . . . 0.0 108.836 175.405 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 828' ' ' LEU . . . . . 0.645 HD13 HG11 ' A' ' 863' ' ' VAL . 16.1 tp -103.23 122.24 44.35 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.664 0.268 . . . . 0.0 110.282 -177.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 829' ' ' VAL . . . . . 0.495 ' HA ' ' HG ' ' A' ' 873' ' ' LEU . 1.2 p -114.73 104.33 16.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.372 0.606 . . . . 0.0 110.1 -179.222 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 830' ' ' VAL . . . . . 0.546 HG22 ' HB1' ' A' ' 854' ' ' ALA . 60.6 t -119.09 119.87 62.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.172 -179.703 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 831' ' ' ASP . . . . . 1.033 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 0.9 OUTLIER -130.06 153.8 48.09 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 176.86 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 832' ' ' ASP . . . . . 0.517 ' HB3' HG12 ' A' ' 876' ' ' VAL . 0.0 OUTLIER -79.75 -13.96 59.07 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -172.365 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 7.8 m80 -131.68 95.83 22.24 Favored Pre-proline 0 C--N 1.327 -0.371 0 O-C-N 121.798 -0.564 . . . . 0.0 111.451 -178.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_exo -27.03 -46.52 0.08 OUTLIER 'Trans proline' 0 C--N 1.353 0.811 1 C-N-CA 125.835 4.357 . . . . 0.0 116.618 -171.756 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 1.2 pp -57.18 -44.0 82.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -176.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 836' ' ' ASN . . . . . 0.499 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 1.5 t30 -73.09 -46.75 49.57 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -178.322 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 837' ' ' ARG . . . . . 1.033 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 0.4 OUTLIER -51.9 -39.85 59.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.862 178.451 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.51 -47.08 80.22 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.489 177.751 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.62 -42.48 95.47 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.106 -0.497 . . . . 0.0 112.011 -173.831 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 840' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' ' 836' ' ' ASN . 0.0 OUTLIER -70.88 -26.79 63.39 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.211 177.14 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -66.81 -33.57 75.91 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.156 0.503 . . . . 0.0 109.818 175.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -64.49 -41.72 96.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.974 174.415 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 843' ' ' GLN . . . . . 0.418 ' HG2' HG22 ' A' ' 932' ' ' ILE . 0.3 OUTLIER -62.01 -41.61 98.26 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.491 176.069 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 844' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.66 -33.19 73.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.595 176.067 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -65.39 -34.19 88.64 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.94 -0.648 . . . . 0.0 111.707 175.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 9.3 m -68.91 -28.23 66.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.91 0.386 . . . . 0.0 110.606 176.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.65 -22.45 63.45 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.27 176.013 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 84.84 24.06 47.03 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 121.088 -0.577 . . . . 0.0 113.446 173.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -114.77 -177.93 3.25 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.718 0.294 . . . . 0.0 110.454 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 850' ' ' GLN . . . . . 0.56 ' HB2' ' HA ' ' A' ' 826' ' ' MET . 4.2 mm100 -85.76 141.38 29.74 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 177.011 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -132.09 116.59 17.23 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 120.797 0.332 . . . . 0.0 110.892 -177.682 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -93.74 109.6 21.26 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 176.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 853' ' ' THR . . . . . 0.461 HG21 HG11 ' A' ' 829' ' ' VAL . 0.0 OUTLIER -91.8 116.6 29.03 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.689 -174.065 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 854' ' ' ALA . . . . . 0.546 ' HB1' HG22 ' A' ' 830' ' ' VAL . . . -136.18 161.09 36.71 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.752 178.691 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -142.04 73.95 1.43 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.975 177.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 856' ' ' ASP . . . . . 0.763 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 31.7 t70 176.55 150.17 0.14 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.784 -178.474 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -77.4 -42.69 17.72 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.514 -178.103 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 858' ' ' VAL . . . . . 0.449 ' H ' HG23 ' A' ' 858' ' ' VAL . 0.5 OUTLIER -71.71 -34.67 52.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.739 0.304 . . . . 0.0 110.348 -178.698 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 859' ' ' ASP . . . . . 0.763 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 0.1 OUTLIER -57.03 -38.85 73.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.642 177.306 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -66.57 -40.79 89.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.833 179.228 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 861' ' ' LEU . . . . . 0.475 HD21 ' HA ' ' A' ' 861' ' ' LEU . 0.2 OUTLIER -66.33 -33.25 75.3 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.095 0.474 . . . . 0.0 110.439 178.358 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -67.42 -42.55 83.03 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.884 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 863' ' ' VAL . . . . . 0.645 HG11 HD13 ' A' ' 828' ' ' LEU . 1.6 p -70.72 -32.02 47.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.715 0.293 . . . . 0.0 110.462 178.334 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 864' ' ' LEU . . . . . 0.443 HD22 ' HA ' ' A' ' 864' ' ' LEU . 1.2 tm? -61.53 -39.68 91.93 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 121.15 0.5 . . . . 0.0 109.954 174.746 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 6.0 m -78.0 -16.97 57.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.935 178.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 2.8 tttp -76.26 -60.63 2.25 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.423 178.178 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -121.69 -90.17 0.58 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.147 177.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 23.7 p80 -179.1 -39.56 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 122.168 0.187 . . . . 0.0 110.869 176.291 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 869' ' ' ILE . . . . . 0.609 HG12 ' HB2' ' A' ' 828' ' ' LEU . 0.3 OUTLIER 69.38 149.58 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 O-C-N 123.392 0.432 . . . . 0.0 110.273 -175.6 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -92.41 -39.89 11.18 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.518 -0.473 . . . . 0.0 111.414 -177.073 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 871' ' ' ILE . . . . . 0.461 ' HB ' HD11 ' A' ' 827' ' ' ILE . 1.4 mt -138.64 133.9 42.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 177.901 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 872' ' ' VAL . . . . . . . . . . . . . 72.4 t -107.89 112.29 39.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.661 -179.363 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 873' ' ' LEU . . . . . 0.592 HD21 HG21 ' A' ' 827' ' ' ILE . 1.4 pp -108.72 127.92 54.41 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.115 0.484 . . . . 0.0 110.028 176.315 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -123.26 114.69 20.58 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.668 -177.707 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 875' ' ' ASP . . . . . 0.806 ' HB3' ' HB2' ' A' ' 831' ' ' ASP . 34.0 t0 -102.5 136.32 42.54 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 178.468 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 876' ' ' VAL . . . . . 0.638 HG21 HG22 ' A' ' 903' ' ' THR . 0.0 OUTLIER -141.09 129.19 22.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-O 121.296 0.569 . . . . 0.0 111.402 -177.053 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -80.21 -39.06 29.88 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 171.09 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -157.77 140.98 11.0 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 114.519 -1.219 . . . . 0.0 109.001 175.21 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 879' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_exo -68.59 78.4 0.68 Allowed 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 122.644 2.229 . . . . 0.0 111.52 177.655 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 880' ' ' ASN . . . . . 0.404 ' O ' ' HB3' ' A' ' 881' ' ' MET . 0.9 OUTLIER -80.48 120.46 24.51 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.364 -175.321 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 881' ' ' MET . . . . . 0.404 ' HB3' ' O ' ' A' ' 880' ' ' ASN . 31.7 ttp 74.59 -58.02 0.59 Allowed 'General case' 0 N--CA 1.468 0.464 0 O-C-N 124.005 0.816 . . . . 0.0 111.802 175.879 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -133.95 149.5 51.26 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.553 -176.046 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -172.63 -1.13 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.598 -0.811 . . . . 0.0 113.094 178.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -123.25 -43.25 2.21 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.101 0.477 . . . . 0.0 110.346 -178.03 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -60.92 -36.4 79.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.809 -177.788 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.26 -42.96 99.23 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.462 -179.552 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.2 -44.34 76.03 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.047 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 888' ' ' GLN . . . . . 0.438 ' OE1' ' HD3' ' A' ' 891' ' ' ARG . 3.3 tp-100 -60.49 -43.04 97.41 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.6 178.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -70.62 -33.08 70.63 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.148 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 890' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -60.81 -48.35 89.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.707 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 891' ' ' ARG . . . . . 0.438 ' HD3' ' OE1' ' A' ' 888' ' ' GLN . 0.0 OUTLIER -74.49 -23.17 58.82 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.814 0.34 . . . . 0.0 110.6 179.606 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 892' ' ' GLN . . . . . 0.427 ' HG3' HH21 ' A' ' 891' ' ' ARG . 5.3 mt-30 -70.92 -43.36 68.41 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.896 178.454 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 893' ' ' LEU . . . . . 0.47 ' HA ' HD22 ' A' ' 893' ' ' LEU . 0.2 OUTLIER -66.06 -55.04 18.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.87 -178.421 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 163.06 60.96 0.02 OUTLIER Glycine 0 N--CA 1.453 -0.208 0 C-N-CA 120.34 -0.933 . . . . 0.0 112.432 -179.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 895' ' ' LEU . . . . . 0.41 ' HB3' ' HA ' ' A' ' 891' ' ' ARG . 0.4 OUTLIER -68.15 111.15 4.33 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.971 0.415 . . . . 0.0 110.894 -179.509 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -128.42 7.84 5.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.442 174.143 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 897' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.31 138.98 32.74 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.032 -177.163 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.32 144.88 46.98 Favored 'Trans proline' 0 C--O 1.238 0.486 0 C-N-CA 122.571 2.181 . . . . 0.0 112.572 -178.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 899' ' ' VAL . . . . . 0.442 ' CG1' ' HA ' ' A' ' 919' ' ' MET . 0.2 OUTLIER -121.07 137.75 53.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 121.534 0.683 . . . . 0.0 110.331 179.443 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 900' ' ' ILE . . . . . 0.727 HG21 ' HB2' ' A' ' 921' ' ' SER . 6.3 mt -108.47 112.11 38.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.03 -179.85 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 901' ' ' GLY . . . . . 0.442 ' O ' ' HA ' ' A' ' 922' ' ' CYS . . . -97.93 110.04 3.94 Favored Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 121.053 -0.594 . . . . 0.0 112.009 -179.027 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 902' ' ' VAL . . . . . 0.556 ' HB ' ' HB2' ' A' ' 923' ' ' LEU . 0.2 OUTLIER -105.06 126.19 60.04 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 178.83 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 903' ' ' THR . . . . . 0.638 HG22 HG21 ' A' ' 876' ' ' VAL . 0.2 OUTLIER -135.2 153.77 51.83 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.056 0.455 . . . . 0.0 111.611 -174.665 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -90.78 104.02 16.65 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.722 174.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 16.4 t30 43.73 61.46 2.27 Favored 'General case' 0 N--CA 1.468 0.427 0 O-C-N 124.034 0.834 . . . . 0.0 111.553 -178.326 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -55.29 -64.82 0.72 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.843 -178.279 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 3.6 mp 56.24 35.19 25.34 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.848 178.475 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -175.7 -45.36 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.096 -175.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -20.23 63.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.327 -175.618 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 910' ' ' GLU . . . . . 0.449 ' HG2' ' H ' ' A' ' 911' ' ' LYS . 3.5 pm0 -62.29 -40.82 97.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.245 0.545 . . . . 0.0 109.682 172.911 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 911' ' ' LYS . . . . . 0.449 ' H ' ' HG2' ' A' ' 910' ' ' GLU . 0.7 OUTLIER -67.84 -35.94 79.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.99 178.286 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 912' ' ' GLN . . . . . 0.446 ' O ' ' HG3' ' A' ' 916' ' ' GLU . 0.0 OUTLIER -63.32 -44.19 95.64 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.225 176.125 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 913' ' ' ARG . . . . . 0.547 ' HD3' ' HB3' ' A' ' 919' ' ' MET . 0.0 OUTLIER -63.7 -28.07 69.64 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.912 179.562 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 63.8 m -74.42 -28.11 60.92 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.96 0.41 . . . . 0.0 110.064 176.451 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.43 -49.98 50.02 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.049 179.217 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 916' ' ' GLU . . . . . 0.531 ' H ' ' HG3' ' A' ' 916' ' ' GLU . 0.0 OUTLIER -77.26 -38.42 51.02 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.984 -178.574 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.74 36.72 18.45 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 121.286 0.565 . . . . 0.0 111.18 -175.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -125.09 -14.06 3.44 Favored Glycine 0 N--CA 1.446 -0.646 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.691 179.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 919' ' ' MET . . . . . 0.718 ' O ' ' HB2' ' A' ' 920' ' ' ASP . 2.7 ttm -63.79 -108.24 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.542 0.337 . . . . 0.0 110.575 175.617 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 920' ' ' ASP . . . . . 0.718 ' HB2' ' O ' ' A' ' 919' ' ' MET . 0.6 OUTLIER 153.0 -81.12 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.563 1.145 . . . . 0.0 110.097 174.355 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 921' ' ' SER . . . . . 0.727 ' HB2' HG21 ' A' ' 900' ' ' ILE . 0.0 OUTLIER -98.61 149.38 22.83 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.133 -174.188 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 922' ' ' CYS . . . . . 0.442 ' HA ' ' O ' ' A' ' 901' ' ' GLY . 10.2 m -130.82 119.46 22.28 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.045 0.45 . . . . 0.0 109.838 176.67 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 923' ' ' LEU . . . . . 0.556 ' HB2' ' HB ' ' A' ' 902' ' ' VAL . 68.3 mt -120.17 167.11 12.57 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.939 -174.759 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -89.29 147.06 24.32 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.143 175.875 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 925' ' ' LYS . . . . . 0.526 ' HB3' ' HD3' ' A' ' 926' ' ' PRO . 10.0 tttp -57.56 -49.05 95.99 Favored Pre-proline 0 CA--C 1.539 0.55 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 179.73 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 926' ' ' PRO . . . . . 0.526 ' HD3' ' HB3' ' A' ' 925' ' ' LYS . 11.5 Cg_exo -72.24 66.16 3.51 Favored 'Trans proline' 0 C--N 1.357 0.985 0 C-N-CA 122.245 1.963 . . . . 0.0 112.708 177.756 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 927' ' ' VAL . . . . . 0.675 HG22 HG12 ' A' ' 931' ' ' VAL . 1.1 t -99.28 136.47 30.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.262 178.314 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -94.57 171.84 8.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.307 -178.179 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 929' ' ' LEU . . . . . 0.462 ' HA ' HG23 ' A' ' 932' ' ' ILE . 0.3 OUTLIER -54.43 -45.93 73.12 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 -177.105 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.8 -48.48 81.61 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.914 0.387 . . . . 0.0 110.287 -175.652 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 931' ' ' VAL . . . . . 0.675 HG12 HG22 ' A' ' 927' ' ' VAL . 43.7 t -62.08 -52.39 60.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.42 179.009 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 932' ' ' ILE . . . . . 0.526 HG21 ' N ' ' A' ' 933' ' ' LYS . 0.0 OUTLIER -63.13 -39.09 83.89 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 CA-C-O 120.647 0.261 . . . . 0.0 111.284 -175.412 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 933' ' ' LYS . . . . . 0.526 ' N ' HG21 ' A' ' 932' ' ' ILE . 0.0 OUTLIER -67.26 -47.68 70.0 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-O 120.875 0.369 . . . . 0.0 110.305 -179.327 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 934' ' ' GLN . . . . . 0.599 ' O ' ' HB2' ' A' ' 938' ' ' LEU . 0.0 OUTLIER -65.62 -35.82 81.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.107 -178.455 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 935' ' ' THR . . . . . 0.492 ' N ' ' HG2' ' A' ' 934' ' ' GLN . 19.2 m -72.97 -43.86 61.75 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.621 0.248 . . . . 0.0 111.187 -179.486 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 936' ' ' LEU . . . . . 0.417 HD11 HG23 ' A' ' 827' ' ' ILE . 0.3 OUTLIER -64.19 -45.02 90.2 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.572 -0.285 . . . . 0.0 110.343 178.862 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 26.6 m -64.37 -40.75 96.45 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.829 178.049 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 938' ' ' LEU . . . . . 0.644 ' O ' ' HG2' ' A' ' 941' ' ' GLU . 1.4 tp -62.68 -42.38 99.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.063 179.155 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -75.86 -27.09 57.66 Favored 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.974 -179.321 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -65.53 -32.65 74.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.172 0.511 . . . . 0.0 109.953 172.605 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 941' ' ' GLU . . . . . 0.644 ' HG2' ' O ' ' A' ' 938' ' ' LEU . 2.1 pt-20 -74.6 -31.46 62.03 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.161 175.621 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 942' ' ' ARG . . . . . 0.598 ' HG2' ' O ' ' A' ' 938' ' ' LEU . 4.6 mmt85 -65.34 -47.42 76.54 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-O 120.94 0.4 . . . . 0.0 110.278 177.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 943' ' ' VAL . . . . . 0.495 HG23 ' N ' ' A' ' 944' ' ' ARG . 5.1 m -69.01 -30.58 47.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.649 179.186 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 944' ' ' ARG . . . . . 0.495 ' N ' HG23 ' A' ' 943' ' ' VAL . 0.0 OUTLIER -67.63 -41.76 83.38 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.422 177.042 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 2.0 pttt -74.36 -25.85 59.77 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.575 0.226 . . . . 0.0 110.906 -179.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 15.2 m -76.21 -34.93 59.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.225 0.536 . . . . 0.0 109.741 175.178 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -72.9 -22.92 60.67 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.315 176.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.98 -5.53 49.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.267 177.751 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 5.9 m . . . . . 0 C--O 1.25 1.116 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.225 178.835 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.259 0 CA-C-O 120.989 0.423 . . . . 0.0 110.403 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 127.97 -6.72 6.87 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.971 -0.633 . . . . 0.0 111.751 -176.018 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 707' ' ' LYS . . . . . 0.412 ' HA ' ' HD2' ' A' ' 707' ' ' LYS . 2.9 mmmt -66.7 134.78 52.94 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 175.483 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 708' ' ' ARG . . . . . . . . . . . . . 10.5 mtt180 -102.7 146.25 28.49 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 121.473 0.654 . . . . 0.0 111.953 -171.291 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 709' ' ' CYS . . . . . 0.428 ' O ' ' HA ' ' A' ' 733' ' ' VAL . 61.8 m -134.86 119.73 18.46 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.986 -1.007 . . . . 0.0 109.019 174.146 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 710' ' ' TRP . . . . . 0.498 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 81.5 m95 -92.14 134.94 34.39 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 -177.288 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 711' ' ' LEU . . . . . 0.543 HD22 HG12 ' A' ' 733' ' ' VAL . 0.1 OUTLIER -126.16 125.55 42.67 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.611 0.72 . . . . 0.0 111.11 -177.958 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -120.9 65.59 0.86 Allowed 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.181 -0.918 . . . . 0.0 108.86 176.086 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 713' ' ' VAL . . . . . 0.829 HG13 ' HB3' ' A' ' 750' ' ' ASP . 21.1 t -114.76 113.54 43.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.348 -177.514 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 41.8 mtm180 -77.13 -23.61 51.71 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.186 0.517 . . . . 0.0 109.622 179.146 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -72.83 97.42 2.24 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.481 175.045 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -61.94 -31.52 71.85 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.897 -174.436 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.32 -48.25 78.83 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.136 0.493 . . . . 0.0 110.275 179.153 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 718' ' ' LEU . . . . . 0.502 HD12 ' HA ' ' A' ' 786' ' ' ALA . 1.4 tt -72.49 -42.53 64.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.496 178.983 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 719' ' ' CYS . . . . . 0.725 ' HB2' ' HB ' ' A' ' 713' ' ' VAL . 0.0 OUTLIER -58.93 -52.18 66.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.804 -177.852 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 720' ' ' GLN . . . . . 0.651 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 22.5 tt0 -62.23 -42.36 99.24 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.979 -179.124 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -59.39 -53.06 62.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.038 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 722' ' ' LEU . . . . . 0.432 ' HA ' HD22 ' A' ' 722' ' ' LEU . 0.3 OUTLIER -64.98 -44.76 88.23 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.253 -177.936 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 723' ' ' GLU . . . . . 0.651 ' HG2' ' HA ' ' A' ' 720' ' ' GLN . 2.0 pt-20 -64.55 -40.12 94.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.644 -174.535 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 724' ' ' THR . . . . . 0.526 ' N ' ' HG3' ' A' ' 723' ' ' GLU . 9.2 m -70.04 -38.61 75.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.853 0.358 . . . . 0.0 110.96 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 20.3 m -64.39 -38.28 90.47 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.507 -178.205 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 726' ' ' LEU . . . . . . . . . . . . . 5.4 mt -74.58 -36.34 63.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.055 0.455 . . . . 0.0 110.97 -178.835 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 727' ' ' GLN . . . . . 0.578 ' HG3' HG23 ' A' ' 733' ' ' VAL . 34.0 mt-30 -75.66 6.91 4.24 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.65 -178.503 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 8.3 mtm-85 -76.7 -16.51 59.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.881 0.372 . . . . 0.0 111.077 179.491 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 14.5 m -107.72 -99.68 0.36 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.759 177.613 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 730' ' ' GLY . . . . . . . . . . . . . . . -144.88 31.88 1.73 Allowed Glycine 0 N--CA 1.448 -0.514 0 N-CA-C 110.933 -0.867 . . . . 0.0 110.933 179.137 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 731' ' ' ILE . . . . . . . . . . . . . 26.6 mm -100.24 132.64 45.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.303 -0.448 . . . . 0.0 110.045 -176.959 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 732' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -100.72 105.4 17.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.094 0.473 . . . . 0.0 110.536 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 733' ' ' VAL . . . . . 0.578 HG23 ' HG3' ' A' ' 727' ' ' GLN . 4.5 t -84.08 126.9 40.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.624 177.121 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 734' ' ' THR . . . . . 0.434 ' HB ' ' CE3' ' A' ' 710' ' ' TRP . 0.2 OUTLIER -124.36 140.14 53.23 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.921 0.391 . . . . 0.0 111.131 -175.77 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 1.4 m -65.79 115.52 6.01 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.977 178.587 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 736' ' ' TYR . . . . . 0.498 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 70.3 t80 -89.57 114.08 25.59 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.474 -179.157 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -117.98 -49.77 2.5 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.475 178.169 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -157.32 38.86 0.55 Allowed Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.965 -0.636 . . . . 0.0 111.563 -179.424 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 15.5 mp0 -86.2 175.68 8.37 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.475 -0.362 . . . . 0.0 110.775 -177.022 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 740' ' ' GLU . . . . . 0.441 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 11.5 mt-10 -95.12 147.78 33.59 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.683 -178.526 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 741' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 740' ' ' GLU . 3.1 Cg_endo -84.77 122.45 2.66 Favored 'Trans proline' 0 N--CA 1.455 -0.774 0 C-N-CA 122.803 2.335 . . . . 0.0 112.471 -179.076 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 742' ' ' THR . . . . . 0.553 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.3 OUTLIER -103.32 138.11 19.45 Favored Pre-proline 0 C--N 1.322 -0.615 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.269 177.344 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 743' ' ' PRO . . . . . 0.553 ' HD2' HG22 ' A' ' 742' ' ' THR . 36.4 Cg_endo -66.02 -0.98 4.55 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.954 2.436 . . . . 0.0 113.131 -178.706 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -108.31 -6.51 16.26 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.088 0.47 . . . . 0.0 110.261 178.057 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 87.6 m-20 -108.49 157.66 18.25 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.596 -170.679 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 746' ' ' VAL . . . . . 0.512 HG11 HD11 ' A' ' 795' ' ' LEU . 1.3 p -123.71 137.35 57.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.484 -179.254 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 747' ' ' LEU . . . . . 0.484 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 0.6 OUTLIER -106.72 111.55 24.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.513 -179.43 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 2.9 mt -100.78 110.72 28.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 176.867 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 749' ' ' THR . . . . . 0.512 HG21 ' HB ' ' A' ' 753' ' ' VAL . 4.9 t -118.76 166.61 12.57 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.709 0.29 . . . . 0.0 111.012 -176.626 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 750' ' ' ASP . . . . . 0.829 ' HB3' HG13 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -111.74 136.89 50.39 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.589 177.663 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 751' ' ' GLU . . . . . 0.668 ' HG3' ' H ' ' A' ' 752' ' ' VAL . 3.0 tp10 66.51 174.74 0.24 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.917 -1.038 . . . . 0.0 111.433 -178.943 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 752' ' ' VAL . . . . . 0.668 ' H ' ' HG3' ' A' ' 751' ' ' GLU . 2.9 p -56.96 120.89 3.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 121.477 0.656 . . . . 0.0 111.233 -179.63 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 753' ' ' VAL . . . . . 0.512 ' HB ' HG21 ' A' ' 749' ' ' THR . 2.7 p -99.34 158.74 3.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.336 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -113.17 25.96 10.89 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.141 0.496 . . . . 0.0 110.5 -178.516 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 755' ' ' LYS . . . . . 0.403 ' H ' HG13 ' A' ' 753' ' ' VAL . 0.0 OUTLIER -120.67 169.29 10.52 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.1 -179.448 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -108.84 -39.69 5.26 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.723 -178.278 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 757' ' ' TRP . . . . . 0.484 ' CD2' ' HB2' ' A' ' 747' ' ' LEU . 76.6 t-105 61.9 85.09 0.13 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.51 0.672 . . . . 0.0 111.233 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 25.7 mm100 -78.01 67.4 3.85 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.1 176.89 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 759' ' ' GLY . . . . . 0.478 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -129.46 -147.12 6.23 Favored Glycine 0 N--CA 1.444 -0.801 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.291 -177.926 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.38 -47.22 20.4 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.717 0.294 . . . . 0.0 110.802 -179.352 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 761' ' ' ALA . . . . . 0.45 ' O ' ' HA ' ' A' ' 746' ' ' VAL . . . -166.75 158.56 13.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.689 -179.064 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 762' ' ' VAL . . . . . 0.817 HG13 ' HG2' ' A' ' 780' ' ' GLU . 1.5 p -131.69 137.37 55.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.53 175.258 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 77.7 t -115.96 121.82 68.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.04 -179.217 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 764' ' ' THR . . . . . 0.664 ' HB ' HG12 ' A' ' 782' ' ' VAL . 5.7 m -110.92 98.78 7.81 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.242 0.544 . . . . 0.0 111.468 -178.175 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 765' ' ' PHE . . . . . 0.417 ' CD1' HD11 ' A' ' 718' ' ' LEU . 20.6 m-85 -76.83 119.73 21.0 Favored 'General case' 0 C--O 1.221 -0.398 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 174.004 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -94.13 133.82 37.21 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 120.355 -0.538 . . . . 0.0 110.879 -174.103 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 767' ' ' ARG . . . . . 0.577 ' NE ' ' HA ' ' A' ' 767' ' ' ARG . 0.1 OUTLIER -110.08 -36.43 5.85 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.711 -179.374 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.37 -58.13 0.26 Allowed 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.76 0.281 . . . . 0.0 111.76 177.957 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 34.1 m170 -114.1 146.32 40.43 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 121.752 0.787 . . . . 0.0 112.514 -172.888 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 770' ' ' ILE . . . . . 0.69 HG22 ' H ' ' A' ' 771' ' ' GLY . 0.6 OUTLIER -110.37 -179.47 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.688 0 CA-C-N 114.448 -1.251 . . . . 0.0 109.644 -179.123 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 771' ' ' GLY . . . . . 0.69 ' H ' HG22 ' A' ' 770' ' ' ILE . . . 170.29 -33.56 0.16 Allowed Glycine 0 N--CA 1.451 -0.346 0 N-CA-C 110.668 -0.973 . . . . 0.0 110.668 -178.252 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 772' ' ' ILE . . . . . 1.051 HG13 ' HD2' ' A' ' 773' ' ' PRO . 1.2 tp -80.64 148.4 65.56 Favored Pre-proline 0 C--N 1.32 -0.685 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 171.503 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 773' ' ' PRO . . . . . 1.051 ' HD2' HG13 ' A' ' 772' ' ' ILE . 33.4 Cg_endo -65.45 -108.33 0.0 OUTLIER 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 122.652 2.235 . . . . 0.0 113.829 -179.433 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 774' ' ' LEU . . . . . 0.537 ' HG ' ' H ' ' A' ' 776' ' ' LYS . 1.0 OUTLIER 174.36 -154.75 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 -177.365 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 775' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -60.3 -0.01 0.21 Allowed 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 776' ' ' LYS . . . . . 0.537 ' H ' ' HG ' ' A' ' 774' ' ' LEU . 0.0 OUTLIER -75.01 -11.51 60.12 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 121.334 0.588 . . . . 0.0 109.829 171.487 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 777' ' ' ALA . . . . . 0.452 ' HB1' ' HD2' ' A' ' 778' ' ' PRO . . . -102.91 158.76 31.13 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.597 176.876 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 778' ' ' PRO . . . . . 0.452 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 54.7 Cg_endo -70.35 63.09 2.13 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.974 2.449 . . . . 0.0 113.445 -177.631 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 116.09 49.24 0.46 Allowed Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.807 176.522 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 780' ' ' GLU . . . . . 0.817 ' HG2' HG13 ' A' ' 762' ' ' VAL . 0.7 OUTLIER -130.78 140.06 50.26 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 177.165 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 45.5 m95 -141.47 112.64 7.41 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 110.487 -0.19 . . . . 0.0 110.487 -178.303 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 782' ' ' VAL . . . . . 0.664 HG12 ' HB ' ' A' ' 764' ' ' THR . 31.2 m -106.67 143.84 16.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-O 121.151 0.501 . . . . 0.0 111.063 179.138 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 783' ' ' HIS . . . . . . . . . . . . . 7.5 t-160 -165.47 121.38 1.36 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.189 174.336 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.45 100.74 9.46 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.106 176.735 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 785' ' ' VAL . . . . . 0.424 ' HB ' ' HD3' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -154.94 176.54 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.0 -0.545 . . . . 0.0 109.69 179.941 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 786' ' ' ALA . . . . . 0.502 ' HA ' HD12 ' A' ' 718' ' ' LEU . . . -115.87 39.92 2.92 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.515 178.518 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 787' ' ' ALA . . . . . 0.414 ' HB2' ' HG ' ' A' ' 718' ' ' LEU . . . 62.91 69.99 0.8 Allowed Pre-proline 0 CA--C 1.529 0.156 0 CA-C-N 115.795 -0.638 . . . . 0.0 111.595 178.841 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 788' ' ' PRO . . . . . 0.678 ' HD2' ' OE1' ' A' ' 790' ' ' GLU . 12.1 Cg_exo -70.18 -66.54 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.772 2.315 . . . . 0.0 111.529 175.608 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 789' ' ' HIS . . . . . 0.425 ' HB3' ' O ' ' A' ' 788' ' ' PRO . 1.8 p80 177.08 -3.96 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.214 178.653 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 790' ' ' GLU . . . . . 0.678 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -84.38 -48.68 9.42 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.803 0.297 . . . . 0.0 111.803 -172.065 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 791' ' ' LEU . . . . . 0.568 ' N ' ' HD2' ' A' ' 792' ' ' PRO . 1.1 mt -70.43 -42.84 16.02 Favored Pre-proline 0 C--N 1.326 -0.438 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -177.187 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 792' ' ' PRO . . . . . 0.568 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 8.8 Cg_endo -54.23 -36.85 87.38 Favored 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 121.653 1.569 . . . . 0.0 111.713 170.83 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -69.84 -37.21 76.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.612 177.507 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -61.59 -39.02 89.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.104 176.758 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 795' ' ' LEU . . . . . 0.512 HD11 HG11 ' A' ' 746' ' ' VAL . 0.2 OUTLIER -63.23 -43.76 97.15 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.995 0.426 . . . . 0.0 110.658 178.531 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -66.63 -30.96 71.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.628 178.343 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.3 -44.24 65.55 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.753 178.384 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -65.55 -31.11 52.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.968 -179.078 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 799' ' ' TYR . . . . . 0.414 ' HD1' ' HA ' ' A' ' 799' ' ' TYR . 0.2 OUTLIER -83.7 -27.6 28.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.418 177.189 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.462 0.157 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.169 179.454 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 31.7 t0 . . . . . 0 C--O 1.234 0.282 0 CA-C-O 121.263 0.554 . . . . 0.0 110.721 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 825' ' ' MET . . . . . 0.411 ' HG2' HD11 ' A' ' 827' ' ' ILE . 3.2 ttm -96.23 108.14 20.57 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.594 175.504 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 826' ' ' MET . . . . . 0.598 ' HG2' HG13 ' A' ' 869' ' ' ILE . 2.3 tpp -100.16 118.27 36.15 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.794 -178.509 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 827' ' ' ILE . . . . . 0.579 HG23 ' HB ' ' A' ' 871' ' ' ILE . 4.8 mm -108.58 128.79 63.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.657 178.129 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 828' ' ' LEU . . . . . 0.572 ' HB2' HG12 ' A' ' 869' ' ' ILE . 0.5 OUTLIER -105.41 128.76 53.69 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.424 -177.892 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 829' ' ' VAL . . . . . 0.63 ' HB ' HD12 ' A' ' 873' ' ' LEU . 1.2 p -114.77 114.87 47.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 121.084 0.469 . . . . 0.0 110.532 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 830' ' ' VAL . . . . . 0.482 HG22 ' HB3' ' A' ' 854' ' ' ALA . 80.3 t -109.23 105.45 18.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.918 177.957 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 831' ' ' ASP . . . . . 0.886 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 33.3 t0 -117.55 137.41 52.59 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.739 -177.968 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.05 -21.95 60.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.666 178.653 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 1.2 m170 -111.48 106.82 57.02 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.581 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -49.29 -44.57 33.46 Favored 'Trans proline' 0 CA--C 1.533 0.463 0 C-N-CA 123.965 3.11 . . . . 0.0 114.672 -174.047 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 835' ' ' ILE . . . . . 0.406 ' O ' ' HG3' ' A' ' 838' ' ' ARG . 0.4 OUTLIER -65.39 -36.21 77.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.862 0.363 . . . . 0.0 111.081 -178.253 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 836' ' ' ASN . . . . . 0.534 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 5.0 m120 -75.33 -35.47 61.21 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 178.186 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 837' ' ' ARG . . . . . 0.886 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 1.3 ttp180 -53.36 -45.91 69.35 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.427 175.864 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 838' ' ' ARG . . . . . 0.406 ' HG3' ' O ' ' A' ' 835' ' ' ILE . 1.2 ppt_? -72.03 -28.75 63.57 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.982 178.947 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.99 -53.21 27.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.53 -0.304 . . . . 0.0 111.807 -177.093 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 840' ' ' LEU . . . . . 0.538 HD12 HG21 ' A' ' 829' ' ' VAL . 0.0 OUTLIER -72.24 -27.69 62.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.944 0.402 . . . . 0.0 109.963 -179.997 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -64.63 -35.53 81.31 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.079 174.854 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -64.8 -43.94 91.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.211 176.397 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 843' ' ' GLN . . . . . 0.476 ' O ' HD22 ' A' ' 847' ' ' LEU . 0.9 OUTLIER -58.11 -46.45 85.54 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.128 176.526 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 844' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.5 -42.62 96.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.071 178.177 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -68.04 -22.36 74.12 Favored Glycine 0 N--CA 1.45 -0.369 0 CA-C-N 116.05 -0.523 . . . . 0.0 112.282 178.462 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 35.8 m -75.32 -30.34 60.29 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.515 -0.18 . . . . 0.0 110.515 177.632 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 847' ' ' LEU . . . . . 0.476 HD22 ' O ' ' A' ' 843' ' ' GLN . 0.1 OUTLIER -68.52 -44.51 74.45 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 120.911 0.386 . . . . 0.0 110.168 173.41 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 105.19 59.56 0.65 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.79 -0.719 . . . . 0.0 113.35 174.705 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -143.45 -178.59 5.95 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 122.781 -0.246 . . . . 0.0 110.348 177.51 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -74.86 122.26 23.11 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 -177.618 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -122.47 120.55 34.24 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.516 -177.056 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 852' ' ' LYS . . . . . 0.458 ' HB3' HD12 ' A' ' 828' ' ' LEU . 0.0 OUTLIER -110.85 115.26 29.23 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.405 178.84 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.78 114.84 26.61 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.026 -177.344 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 854' ' ' ALA . . . . . 0.482 ' HB3' HG22 ' A' ' 830' ' ' VAL . . . -132.42 171.81 13.27 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.112 0.482 . . . . 0.0 111.629 -179.391 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 855' ' ' ASN . . . . . 0.478 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 6.3 t-20 -160.8 97.53 1.18 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.305 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 856' ' ' ASP . . . . . 0.478 ' HB2' ' O ' ' A' ' 855' ' ' ASN . 48.8 t0 170.06 156.28 0.06 Allowed 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.293 179.354 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -88.61 -49.36 3.66 Favored Glycine 0 N--CA 1.447 -0.606 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.071 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -74.27 -34.83 38.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 O-C-N 122.773 -0.251 . . . . 0.0 111.138 -178.144 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 859' ' ' ASP . . . . . 0.453 ' HB2' ' OD2' ' A' ' 856' ' ' ASP . 3.7 t0 -69.05 -19.12 64.09 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 111.925 0.343 . . . . 0.0 111.925 -178.163 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -64.78 -53.02 53.58 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.5 0.666 . . . . 0.0 109.582 173.76 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 861' ' ' LEU . . . . . 0.849 HD13 ' HA ' ' A' ' 890' ' ' ILE . 9.6 tp -61.15 -41.54 96.94 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.481 -0.782 . . . . 0.0 109.731 175.183 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 862' ' ' ASN . . . . . 0.425 ' HB3' ' HA ' ' A' ' 859' ' ' ASP . 48.2 t30 -60.03 -29.23 68.36 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.742 -1.117 . . . . 0.0 110.834 178.856 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 863' ' ' VAL . . . . . 0.629 HG13 HD13 ' A' ' 869' ' ' ILE . 0.5 OUTLIER -72.92 -34.62 46.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.621 -179.211 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 864' ' ' LEU . . . . . 0.471 HD22 HD21 ' A' ' 897' ' ' LEU . 6.3 mt -64.71 -33.33 75.71 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.224 0.535 . . . . 0.0 109.774 175.305 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -78.14 -24.88 47.2 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.875 178.199 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 9.0 mtmt -77.93 -48.55 16.07 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.93 -178.569 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 2.1 p30 -156.72 176.55 12.59 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.21 -177.565 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 79.2 t60 -91.31 97.3 11.02 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.109 0.481 . . . . 0.0 112.01 -174.734 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 869' ' ' ILE . . . . . 0.629 HD13 HG13 ' A' ' 863' ' ' VAL . 0.7 OUTLIER -94.31 133.65 34.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 166.806 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 870' ' ' ASP . . . . . 0.408 ' O ' ' HB2' ' A' ' 897' ' ' LEU . 1.8 m-20 -86.37 -43.99 12.41 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.71 0.29 . . . . 0.0 111.143 -174.366 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 871' ' ' ILE . . . . . 0.579 ' HB ' HG23 ' A' ' 827' ' ' ILE . 43.2 mm -122.59 126.31 73.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.217 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 872' ' ' VAL . . . . . 0.437 HG21 HD21 ' A' ' 864' ' ' LEU . 3.6 t -106.46 122.48 60.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 120.683 0.278 . . . . 0.0 110.334 178.343 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 873' ' ' LEU . . . . . 0.63 HD12 ' HB ' ' A' ' 829' ' ' VAL . 0.1 OUTLIER -104.86 121.55 43.91 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.114 177.113 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -109.45 106.34 16.05 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 177.769 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 875' ' ' ASP . . . . . 0.468 ' OD1' ' HG2' ' A' ' 925' ' ' LYS . 7.0 t0 -106.13 119.92 40.46 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.491 -175.896 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 10.5 t -126.26 119.87 55.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.213 -176.773 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 877' ' ' ASN . . . . . 0.722 ' HB2' ' HE2' ' A' ' 925' ' ' LYS . 0.1 OUTLIER -109.78 -36.35 5.94 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.156 175.186 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 1.5 mmm . . . . . 0 C--N 1.323 -0.58 0 CA-C-O 121.017 0.437 . . . . 0.0 111.308 -178.384 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.444 0 N-CA-C 113.711 0.244 . . . . 0.0 113.711 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -70.88 -43.04 69.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.442 0.639 . . . . 0.0 109.479 -177.609 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 885' ' ' ARG . . . . . 0.464 ' HG2' ' HG3' ' A' ' 889' ' ' ARG . 0.0 OUTLIER -58.21 -32.97 68.78 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.325 177.1 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.75 -56.22 19.51 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.909 -176.735 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 887' ' ' THR . . . . . 0.405 ' O ' HG22 ' A' ' 890' ' ' ILE . 0.1 OUTLIER -65.83 -44.32 85.89 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.434 -176.741 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 6.3 tp60 -61.24 -50.36 73.38 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.184 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 889' ' ' ARG . . . . . 0.464 ' HG3' ' HG2' ' A' ' 885' ' ' ARG . 2.9 mtt180 -66.51 -41.45 88.82 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.436 -176.196 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 890' ' ' ILE . . . . . 0.849 ' HA ' HD13 ' A' ' 861' ' ' LEU . 10.5 tt -64.53 -41.71 93.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 C-N-CA 121.159 -0.216 . . . . 0.0 111.398 -176.305 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 891' ' ' ARG . . . . . 0.973 ' HA ' ' HB2' ' A' ' 895' ' ' LEU . 10.5 ptt85 -76.35 -32.32 58.57 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.671 179.001 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -70.02 -45.58 66.91 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.319 -176.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 893' ' ' LEU . . . . . 0.781 HD12 HD21 ' A' ' 861' ' ' LEU . 3.9 mt -75.06 -26.91 59.72 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.865 0.321 . . . . 0.0 111.865 -175.587 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 146.48 71.88 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.027 -1.082 . . . . 0.0 113.47 175.78 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 895' ' ' LEU . . . . . 0.973 ' HB2' ' HA ' ' A' ' 891' ' ' ARG . 0.5 OUTLIER -85.22 127.87 34.46 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 173.977 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -129.38 -9.29 4.67 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.126 0.489 . . . . 0.0 111.367 -177.727 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 897' ' ' LEU . . . . . 0.471 HD21 HD22 ' A' ' 864' ' ' LEU . 0.4 OUTLIER -122.89 157.98 58.57 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.832 -172.368 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -71.33 140.14 36.34 Favored 'Trans proline' 0 C--O 1.241 0.643 0 C-N-CA 123.069 2.513 . . . . 0.0 112.718 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 899' ' ' VAL . . . . . 0.926 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 43.3 t -114.53 132.98 62.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.733 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 900' ' ' ILE . . . . . 0.446 HG12 ' HB2' ' A' ' 921' ' ' SER . 89.6 mt -103.5 114.33 42.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.955 175.912 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 901' ' ' GLY . . . . . 0.53 ' O ' ' HA ' ' A' ' 922' ' ' CYS . . . -94.17 109.75 3.87 Favored Glycine 0 N--CA 1.443 -0.866 0 C-N-CA 120.738 -0.744 . . . . 0.0 111.518 177.941 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 902' ' ' VAL . . . . . 0.812 ' HB ' HD12 ' A' ' 923' ' ' LEU . 0.1 OUTLIER -108.6 118.76 56.88 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 177.707 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.95 154.06 48.53 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.859 -171.258 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -83.0 105.76 14.26 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.018 174.723 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 69.07 104.08 0.06 Allowed 'General case' 0 N--CA 1.467 0.409 0 O-C-N 123.803 0.689 . . . . 0.0 110.944 179.707 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -81.13 53.25 1.96 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.747 -175.142 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 1.3 mt -80.79 -58.91 2.88 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.006 0.431 . . . . 0.0 110.368 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -94.0 -19.49 20.84 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.374 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.56 -54.03 50.62 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.158 -178.172 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 910' ' ' GLU . . . . . 0.465 ' HA ' ' NH1' ' A' ' 913' ' ' ARG . 9.8 tp10 -50.85 -46.44 60.15 Favored 'General case' 0 N--CA 1.463 0.189 0 O-C-N 123.581 0.551 . . . . 0.0 111.453 -176.172 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 10.1 tmtt? -64.77 -52.49 56.64 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.399 -176.434 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -69.61 -43.94 71.73 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 111.699 0.259 . . . . 0.0 111.699 -174.742 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 913' ' ' ARG . . . . . 0.465 ' NH1' ' HA ' ' A' ' 910' ' ' GLU . 0.1 OUTLIER -65.98 -27.26 68.0 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 121.184 -0.206 . . . . 0.0 111.135 -176.9 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 78.3 m -74.63 -39.8 61.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.77 0.319 . . . . 0.0 110.377 175.374 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.61 -42.92 95.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.612 179.698 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -72.72 -42.71 63.86 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.804 179.173 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 50.7 50.0 19.81 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.807 -176.339 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -123.56 16.45 7.94 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.218 -178.03 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 919' ' ' MET . . . . . 0.926 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -113.77 -113.18 0.34 Allowed 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 179.221 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 920' ' ' ASP . . . . . 0.608 ' HB2' ' O ' ' A' ' 919' ' ' MET . 5.3 t70 164.52 -58.48 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.482 0 O-C-N 124.199 0.937 . . . . 0.0 109.89 174.697 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 921' ' ' SER . . . . . 0.446 ' HB2' HG12 ' A' ' 900' ' ' ILE . 57.9 m -113.87 164.59 13.56 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.035 177.805 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 922' ' ' CYS . . . . . 0.53 ' HA ' ' O ' ' A' ' 901' ' ' GLY . 0.1 OUTLIER -148.78 140.13 23.3 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.513 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 923' ' ' LEU . . . . . 0.812 HD12 ' HB ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -147.68 177.86 8.95 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.773 0.321 . . . . 0.0 110.439 178.184 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.87 146.18 24.61 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.991 -178.674 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 925' ' ' LYS . . . . . 0.722 ' HE2' ' HB2' ' A' ' 877' ' ' ASN . 3.7 tmtm? -45.73 -51.62 28.45 Favored Pre-proline 0 N--CA 1.47 0.572 0 O-C-N 123.67 0.606 . . . . 0.0 112.308 177.375 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -72.1 64.61 3.41 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 121.742 1.628 . . . . 0.0 112.169 175.254 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 2.1 p -71.65 148.94 9.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.043 0.449 . . . . 0.0 110.633 179.199 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.82 160.25 14.76 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.552 179.298 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 929' ' ' LEU . . . . . 0.431 HD23 ' HA ' ' A' ' 929' ' ' LEU . 0.0 OUTLIER -56.67 -45.36 81.74 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.107 -179.14 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -65.99 -44.61 84.34 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.824 0.345 . . . . 0.0 110.692 -176.871 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 931' ' ' VAL . . . . . 0.458 ' O ' ' HG3' ' A' ' 934' ' ' GLN . 74.4 t -63.65 -42.94 97.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.785 -178.968 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 932' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -66.7 -33.9 66.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.444 178.43 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.84 -48.67 58.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.002 -178.763 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 934' ' ' GLN . . . . . 0.458 ' HG3' ' O ' ' A' ' 931' ' ' VAL . 0.6 OUTLIER -65.7 -40.97 92.82 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 121.132 -0.227 . . . . 0.0 111.161 -177.573 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 12.4 m -64.41 -43.77 93.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.731 0.301 . . . . 0.0 111.087 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 936' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.78 -41.94 91.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.856 178.887 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 39.6 m -65.43 -44.46 87.29 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.229 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.15 -40.34 89.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.081 0.467 . . . . 0.0 110.503 178.868 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 939' ' ' TYR . . . . . 0.488 ' HD1' ' HA ' ' A' ' 939' ' ' TYR . 0.5 OUTLIER -72.85 -36.3 67.4 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.879 -178.902 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -62.15 -39.07 91.4 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.068 0.461 . . . . 0.0 110.905 177.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 941' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.31 -24.11 43.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.349 178.319 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 942' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.6 -47.75 68.8 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.418 178.512 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 943' ' ' VAL . . . . . 0.432 HG22 ' O ' ' A' ' 939' ' ' TYR . 5.8 m -69.51 -28.76 39.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.042 176.582 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -58.57 -33.52 70.05 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.195 173.763 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 3.3 mmtp -69.1 -48.77 61.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.842 177.89 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.1 -42.39 72.76 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.835 -0.62 . . . . 0.0 112.658 -175.174 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 11.1 mtm-85 -89.18 -33.74 16.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.755 0.312 . . . . 0.0 111.202 -175.842 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 1.2 t0 . . . . . 0 C--O 1.234 0.239 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.369 -177.625 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.452 -0.333 0 CA-C-O 120.547 0.213 . . . . 0.0 111.034 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 80.99 45.84 7.41 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.848 -0.691 . . . . 0.0 113.473 173.564 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 4.4 tptt -145.59 153.74 41.39 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 176.452 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 708' ' ' ARG . . . . . 0.703 ' HG2' HG13 ' A' ' 732' ' ' VAL . 0.0 OUTLIER -118.59 156.39 29.26 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.216 0.532 . . . . 0.0 111.849 -172.716 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 709' ' ' CYS . . . . . 0.459 ' SG ' HD13 ' A' ' 726' ' ' LEU . 0.5 OUTLIER -142.19 145.25 33.95 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.794 173.741 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 710' ' ' TRP . . . . . . . . . . . . . 66.4 m95 -114.26 131.99 56.3 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 177.862 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 711' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -122.86 131.31 53.69 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.476 0.655 . . . . 0.0 111.658 -175.898 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -126.81 65.56 1.27 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.816 -1.084 . . . . 0.0 109.128 174.864 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 713' ' ' VAL . . . . . 0.865 ' HA ' ' HB2' ' A' ' 750' ' ' ASP . 13.4 t -113.1 134.3 56.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.681 -175.085 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -100.97 -27.6 13.2 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.68 -174.949 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 -74.57 124.97 27.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.942 173.507 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -70.37 -40.26 74.12 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.173 -173.536 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.66 -41.49 95.14 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.164 0.507 . . . . 0.0 110.479 178.63 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 718' ' ' LEU . . . . . 0.673 HD11 ' HD2' ' A' ' 765' ' ' PHE . 0.4 OUTLIER -71.87 -49.37 38.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.704 -179.41 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 719' ' ' CYS . . . . . 0.673 ' HB2' ' HB ' ' A' ' 713' ' ' VAL . 0.0 OUTLIER -60.25 -52.21 66.24 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.824 -177.752 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 720' ' ' GLN . . . . . 0.694 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 0.1 OUTLIER -63.49 -40.29 96.7 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -175.957 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -64.11 -43.48 95.22 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.808 0.337 . . . . 0.0 110.58 -179.241 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.4 -48.41 64.75 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.789 -179.261 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 723' ' ' GLU . . . . . 0.694 ' HG2' ' HA ' ' A' ' 720' ' ' GLN . 1.5 pt-20 -63.05 -42.49 99.74 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.379 -176.493 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 724' ' ' THR . . . . . 0.582 ' N ' ' HG3' ' A' ' 723' ' ' GLU . 20.1 m -70.84 -34.18 71.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.445 0.164 . . . . 0.0 111.359 -178.059 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 72.6 m -68.87 -37.76 79.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.775 0.321 . . . . 0.0 110.927 179.329 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 726' ' ' LEU . . . . . 0.524 HD21 HD12 ' A' ' 795' ' ' LEU . 14.1 mt -73.41 -42.49 62.02 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.081 0.467 . . . . 0.0 110.493 179.333 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -75.77 10.08 1.99 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.532 178.129 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.81 -35.14 64.85 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.809 0.338 . . . . 0.0 110.183 179.069 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 13.1 m -100.25 -94.22 0.27 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.677 177.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 730' ' ' GLY . . . . . . . . . . . . . . . -152.28 38.21 0.78 Allowed Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 111.336 -0.705 . . . . 0.0 111.336 -179.125 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 731' ' ' ILE . . . . . . . . . . . . . 42.9 mm -101.42 128.31 53.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 178.857 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 732' ' ' VAL . . . . . 0.703 HG13 ' HG2' ' A' ' 708' ' ' ARG . 0.9 OUTLIER -98.02 114.73 36.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.368 0.604 . . . . 0.0 110.84 -176.403 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 733' ' ' VAL . . . . . . . . . . . . . 5.2 p -98.22 147.79 6.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.023 177.557 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 22.3 m -141.67 137.3 31.67 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.849 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -54.9 125.34 19.83 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.727 174.669 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 736' ' ' TYR . . . . . 0.414 ' CE2' ' HD3' ' A' ' 755' ' ' LYS . 21.8 t80 -74.74 83.76 2.12 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.172 0.51 . . . . 0.0 111.059 -179.294 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -70.24 -60.46 2.27 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.133 175.071 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 179.99 49.02 0.08 OUTLIER Glycine 0 N--CA 1.445 -0.734 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.513 179.495 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.89 147.07 23.97 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.86 0.362 . . . . 0.0 110.278 -178.703 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 34.7 mp0 -68.63 143.93 95.63 Favored Pre-proline 0 C--N 1.32 -0.71 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.765 -178.829 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 741' ' ' PRO . . . . . 0.483 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 40.4 Cg_endo -66.14 135.0 38.7 Favored 'Trans proline' 0 C--O 1.234 0.305 0 C-N-CA 122.931 2.421 . . . . 0.0 113.417 -176.429 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 742' ' ' THR . . . . . 0.547 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.0 OUTLIER -117.92 139.59 26.69 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.416 177.491 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 743' ' ' PRO . . . . . 0.578 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 33.5 Cg_endo -64.15 -17.12 58.55 Favored 'Trans proline' 0 N--CA 1.476 0.481 0 C-N-CA 123.042 2.495 . . . . 0.0 113.633 -176.076 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 744' ' ' GLU . . . . . 0.407 ' HG2' ' CG ' ' A' ' 834' ' ' PRO . 0.9 OUTLIER -97.97 -2.89 39.44 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.915 0.388 . . . . 0.0 110.645 179.492 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -109.56 155.28 21.59 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.232 -170.59 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 746' ' ' VAL . . . . . 0.883 HG21 HD11 ' A' ' 795' ' ' LEU . 17.3 m -120.09 148.16 23.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.518 -0.764 . . . . 0.0 110.878 -178.266 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 747' ' ' LEU . . . . . 0.501 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 0.2 OUTLIER -117.73 106.03 12.62 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.142 178.296 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 10.4 mt -95.28 108.84 21.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 177.532 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -114.31 147.38 39.18 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.168 0.509 . . . . 0.0 111.625 -171.433 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 750' ' ' ASP . . . . . 0.865 ' HB2' ' HA ' ' A' ' 713' ' ' VAL . 31.0 t0 -98.1 121.75 40.4 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.427 179.573 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 751' ' ' GLU . . . . . 0.408 ' HA ' ' HB3' ' A' ' 766' ' ' CYS . 1.0 OUTLIER 57.1 -150.54 0.44 Allowed 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.063 -176.677 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 752' ' ' VAL . . . . . 0.641 HG13 HG13 ' A' ' 772' ' ' ILE . 6.6 t -97.61 106.21 18.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 O-C-N 122.015 -0.428 . . . . 0.0 112.13 -173.571 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 2.1 t -103.42 -8.12 9.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.433 169.829 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 3.9 m 52.59 45.48 28.54 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.82 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 755' ' ' LYS . . . . . 0.414 ' HD3' ' CE2' ' A' ' 736' ' ' TYR . 0.0 OUTLIER -96.13 116.83 29.58 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.254 177.547 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 756' ' ' LYS . . . . . 0.458 ' HD3' ' HA ' ' A' ' 756' ' ' LYS . 1.8 mmpt? -81.98 81.78 7.83 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.445 0.641 . . . . 0.0 109.801 176.213 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 757' ' ' TRP . . . . . 0.623 ' HB3' ' HB ' ' A' ' 762' ' ' VAL . 74.2 t-105 -72.03 103.46 3.26 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.222 -177.469 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.62 87.94 7.53 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 175.514 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 759' ' ' GLY . . . . . 0.578 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -161.91 -139.18 2.58 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.159 -179.017 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 14.8 ttt85 -70.04 -59.49 2.88 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.809 0.338 . . . . 0.0 110.455 -179.308 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -163.86 144.43 8.57 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.264 -178.651 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 762' ' ' VAL . . . . . 0.623 ' HB ' ' HB3' ' A' ' 757' ' ' TRP . 2.0 p -118.66 119.53 61.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.519 174.671 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 763' ' ' VAL . . . . . 0.643 HG11 HD21 ' A' ' 791' ' ' LEU . 45.6 t -107.88 108.34 25.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.642 -178.475 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 764' ' ' THR . . . . . 0.825 ' HB ' HG12 ' A' ' 782' ' ' VAL . 84.9 m -96.89 116.35 29.03 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.511 179.113 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 765' ' ' PHE . . . . . 0.673 ' HD2' HD11 ' A' ' 718' ' ' LEU . 1.6 m-30 -99.74 93.7 5.95 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 177.343 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 766' ' ' CYS . . . . . 0.408 ' HB3' ' HA ' ' A' ' 751' ' ' GLU . 1.3 p -118.67 132.51 56.17 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.679 -177.271 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 767' ' ' ARG . . . . . 0.823 ' HA ' ' HB3' ' A' ' 784' ' ' SER . 0.4 OUTLIER -109.46 -58.94 1.97 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.753 0.311 . . . . 0.0 110.945 -173.278 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -102.33 -25.87 13.5 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.195 -178.494 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -109.59 92.77 4.18 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.034 0.445 . . . . 0.0 110.079 179.607 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 3.1 mp -101.09 109.08 24.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.607 -179.065 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -133.44 -9.92 1.98 Allowed Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.927 -179.841 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 772' ' ' ILE . . . . . 0.641 HG13 HG13 ' A' ' 752' ' ' VAL . 14.2 mt -104.84 138.39 19.49 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.741 0.27 . . . . 0.0 110.379 -178.936 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 773' ' ' PRO . . . . . 0.486 ' HD3' ' HA ' ' A' ' 772' ' ' ILE . 14.6 Cg_exo -69.14 162.81 40.23 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 123.315 2.677 . . . . 0.0 112.725 -179.854 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 774' ' ' LEU . . . . . 0.504 ' CB ' HG22 ' A' ' 782' ' ' VAL . 0.7 OUTLIER -98.89 -156.29 0.54 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.97 -178.399 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 775' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 1.4 mp0 -61.42 72.43 0.01 OUTLIER 'General case' 0 C--O 1.234 0.251 0 CA-C-O 122.161 0.981 . . . . 0.0 112.343 176.262 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 5.2 ptmt -131.4 -25.12 2.21 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 114.067 -1.424 . . . . 0.0 108.541 170.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 777' ' ' ALA . . . . . 0.686 ' HB3' ' HB2' ' A' ' 780' ' ' GLU . . . -95.81 163.98 19.88 Favored Pre-proline 0 C--O 1.235 0.34 0 CA-C-N 114.812 -1.086 . . . . 0.0 109.511 175.644 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 778' ' ' PRO . . . . . 0.579 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 43.2 Cg_endo -68.04 70.82 0.85 Allowed 'Trans proline' 0 CA--C 1.533 0.463 0 C-N-CA 122.726 2.284 . . . . 0.0 113.237 -178.289 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 117.44 18.08 5.46 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.672 -0.775 . . . . 0.0 113.162 175.704 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 780' ' ' GLU . . . . . 0.686 ' HB2' ' HB3' ' A' ' 777' ' ' ALA . 2.2 tt0 -94.28 125.83 39.15 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 179.608 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 22.4 m95 -133.38 136.77 45.51 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 782' ' ' VAL . . . . . 0.825 HG12 ' HB ' ' A' ' 764' ' ' THR . 27.9 m -134.35 161.71 40.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.824 174.523 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 783' ' ' HIS . . . . . . . . . . . . . 4.6 t-160 -172.98 146.34 1.5 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.582 174.344 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 784' ' ' SER . . . . . 0.823 ' HB3' ' HA ' ' A' ' 767' ' ' ARG . 0.9 OUTLIER -100.22 100.36 11.18 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 173.52 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 785' ' ' VAL . . . . . 0.411 HG11 ' HG3' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -162.65 177.43 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.53 -179.716 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -121.03 63.43 0.87 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.483 177.551 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 54.75 68.44 2.62 Favored Pre-proline 0 N--CA 1.468 0.427 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.75 178.382 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 788' ' ' PRO . . . . . 0.843 ' HG2' ' HG2' ' A' ' 790' ' ' GLU . 76.5 Cg_endo -89.08 41.24 0.54 Allowed 'Trans proline' 0 N--CA 1.46 -0.443 0 C-N-CA 122.936 2.424 . . . . 0.0 112.978 -177.601 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 73.78 -28.17 0.19 Allowed 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 175.966 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 790' ' ' GLU . . . . . 0.843 ' HG2' ' HG2' ' A' ' 788' ' ' PRO . 1.2 pt-20 -65.68 -37.88 87.7 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.084 0.402 . . . . 0.0 112.084 -176.295 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 791' ' ' LEU . . . . . 0.643 HD21 HG11 ' A' ' 763' ' ' VAL . 0.2 OUTLIER -67.04 -55.0 17.31 Favored Pre-proline 0 C--N 1.327 -0.375 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -177.491 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 792' ' ' PRO . . . . . 0.43 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 9.7 Cg_endo -55.35 -34.1 87.61 Favored 'Trans proline' 0 C--N 1.354 0.856 0 C-N-CA 121.854 1.703 . . . . 0.0 112.238 176.837 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -67.86 -44.45 77.06 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 120.96 0.41 . . . . 0.0 110.725 177.553 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 794' ' ' LEU . . . . . 0.405 ' O ' ' HB ' ' A' ' 798' ' ' ILE . 0.1 OUTLIER -63.36 -39.63 95.06 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.364 178.505 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 795' ' ' LEU . . . . . 0.883 HD11 HG21 ' A' ' 746' ' ' VAL . 0.0 OUTLIER -62.06 -34.68 76.71 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.812 179.646 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -62.85 -53.42 54.4 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.297 179.052 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 797' ' ' ARG . . . . . 0.613 ' HA ' HD13 ' A' ' 800' ' ' LEU . 0.0 OUTLIER -72.04 -21.56 61.52 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.944 0.402 . . . . 0.0 111.2 -179.449 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 798' ' ' ILE . . . . . 0.405 ' HB ' ' O ' ' A' ' 794' ' ' LEU . 0.1 OUTLIER -69.25 -28.42 38.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 121.186 0.517 . . . . 0.0 109.893 175.758 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -80.85 -61.14 2.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.663 173.667 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 800' ' ' LEU . . . . . 0.613 HD13 ' HA ' ' A' ' 797' ' ' ARG . 2.5 tp . . . . . 0 N--CA 1.468 0.432 0 O-C-N 124.233 0.958 . . . . 0.0 111.819 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 30.7 t0 . . . . . 0 C--O 1.232 0.145 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 9.3 ttt -88.04 111.77 21.9 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.591 178.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 826' ' ' MET . . . . . 0.57 ' HG2' ' O ' ' A' ' 868' ' ' HIS . 0.9 OUTLIER -94.82 122.76 37.77 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.516 0.674 . . . . 0.0 111.367 -172.192 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 827' ' ' ILE . . . . . 0.524 HG23 ' HB ' ' A' ' 871' ' ' ILE . 1.5 mm -115.11 125.39 72.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.529 176.018 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 828' ' ' LEU . . . . . 0.511 HD22 HG22 ' A' ' 830' ' ' VAL . 0.8 OUTLIER -93.42 115.95 28.49 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.625 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 829' ' ' VAL . . . . . 0.686 HG13 HD12 ' A' ' 873' ' ' LEU . 0.0 OUTLIER -103.02 97.51 5.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.93 179.944 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 830' ' ' VAL . . . . . 0.511 HG22 HD22 ' A' ' 828' ' ' LEU . 0.0 OUTLIER -113.54 112.65 41.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.17 -179.476 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 831' ' ' ASP . . . . . 0.688 ' HB2' ' HB3' ' A' ' 875' ' ' ASP . 0.0 OUTLIER -127.22 161.98 27.27 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.942 -175.534 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 832' ' ' ASP . . . . . 0.475 ' CG ' ' H ' ' A' ' 877' ' ' ASN . 1.6 p-10 -96.24 -13.64 23.27 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -175.904 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 833' ' ' HIS . . . . . 0.431 ' H ' ' CG ' ' A' ' 831' ' ' ASP . 0.0 OUTLIER -122.25 102.49 39.95 Favored Pre-proline 0 C--N 1.322 -0.601 0 O-C-N 122.343 -0.223 . . . . 0.0 110.778 -175.456 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 834' ' ' PRO . . . . . 0.491 ' HB2' ' HB2' ' A' ' 743' ' ' PRO . 92.7 Cg_exo -42.82 -37.31 5.83 Favored 'Trans proline' 0 CA--C 1.533 0.47 0 C-N-CA 124.054 3.169 . . . . 0.0 114.776 -172.3 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -65.18 -36.54 78.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-O 121.096 0.474 . . . . 0.0 110.904 179.265 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 836' ' ' ASN . . . . . 0.63 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 0.7 OUTLIER -74.86 -40.72 60.83 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 179.039 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 837' ' ' ARG . . . . . 0.61 ' HB2' ' OD1' ' A' ' 831' ' ' ASP . 3.9 ttt-85 -52.36 -41.25 62.92 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.431 177.363 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 1.3 tmm_? -67.4 -41.76 84.38 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.448 177.004 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 839' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 839' ' ' LEU . 2.7 mt -63.8 -50.82 67.46 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.351 -176.412 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 840' ' ' LEU . . . . . 0.63 ' HG ' ' O ' ' A' ' 836' ' ' ASN . 0.0 OUTLIER -69.15 -32.21 71.41 Favored 'General case' 0 CA--C 1.517 -0.302 0 O-C-N 121.997 -0.439 . . . . 0.0 110.623 -178.621 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 841' ' ' ALA . . . . . 0.822 ' HB2' HG21 ' A' ' 853' ' ' THR . . . -65.08 -45.99 83.0 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 120.957 0.408 . . . . 0.0 110.49 177.976 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -62.75 -42.43 99.67 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.403 178.138 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 843' ' ' GLN . . . . . 0.42 ' HG2' HD23 ' A' ' 929' ' ' LEU . 8.6 mt-30 -62.68 -40.97 98.76 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.886 178.994 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 844' ' ' LEU . . . . . 0.461 ' HA ' HD13 ' A' ' 844' ' ' LEU . 0.0 OUTLIER -65.52 -32.55 74.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.155 0.503 . . . . 0.0 109.762 176.667 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -66.9 -36.56 91.25 Favored Glycine 0 N--CA 1.446 -0.638 0 CA-C-N 115.489 -0.778 . . . . 0.0 112.027 174.734 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.24 -29.34 70.45 Favored 'General case' 0 N--CA 1.456 -0.138 0 CA-C-O 120.952 0.406 . . . . 0.0 110.494 176.748 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 5.8 mt -74.62 -52.01 12.9 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.214 -0.448 . . . . 0.0 109.938 174.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 103.6 42.82 1.93 Allowed Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.641 176.728 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 1.7 m-30 -113.32 165.94 11.95 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -73.74 129.75 38.56 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 176.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.61 147.86 41.68 Favored 'General case' 0 C--N 1.321 -0.665 0 C-N-CA 120.584 -0.446 . . . . 0.0 111.35 -176.59 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 852' ' ' LYS . . . . . 0.439 ' O ' HD23 ' A' ' 828' ' ' LEU . 0.1 OUTLIER -127.84 109.59 11.77 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 173.54 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 853' ' ' THR . . . . . 0.822 HG21 ' HB2' ' A' ' 841' ' ' ALA . 0.2 OUTLIER -102.42 114.73 29.17 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -173.053 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 854' ' ' ALA . . . . . . . . . . . . . . . -134.24 178.83 6.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.156 179.344 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 20.1 p-10 -139.52 75.26 1.5 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.804 0.812 . . . . 0.0 111.239 179.377 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 856' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -172.17 159.13 4.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.577 176.146 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -94.14 -44.66 3.49 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.421 -0.895 . . . . 0.0 113.098 -177.841 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 2.0 p -75.22 -34.03 30.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 117.173 0.487 . . . . 0.0 111.947 -173.75 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.51 -20.34 62.85 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 120.94 -0.304 . . . . 0.0 110.687 179.266 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -63.66 -38.65 91.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.02 0.438 . . . . 0.0 109.971 174.682 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 861' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' A' ' 861' ' ' LEU . 0.0 OUTLIER -69.13 -38.41 78.83 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.975 176.373 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 14.1 t30 -59.07 -52.88 63.82 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.028 177.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -65.73 -31.59 54.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.855 179.022 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 864' ' ' LEU . . . . . 0.753 HD23 HD12 ' A' ' 869' ' ' ILE . 0.8 OUTLIER -58.42 -34.32 70.65 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.176 0.512 . . . . 0.0 110.763 177.017 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 1.3 m -92.15 -17.06 25.44 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.604 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 1.1 mmmm -101.88 -2.76 29.2 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -174.751 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -162.04 161.04 28.22 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 -178.833 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 868' ' ' HIS . . . . . 0.57 ' O ' ' HG2' ' A' ' 826' ' ' MET . 0.0 OUTLIER -78.96 137.8 37.77 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 110.344 -0.243 . . . . 0.0 110.344 -178.306 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 869' ' ' ILE . . . . . 0.753 HD12 HD23 ' A' ' 864' ' ' LEU . 6.7 mt -135.27 142.47 39.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.525 178.572 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -99.6 -62.95 1.17 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.829 177.779 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 871' ' ' ILE . . . . . 0.524 ' HB ' HG23 ' A' ' 827' ' ' ILE . 18.0 mm -121.61 140.74 44.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.215 178.234 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 872' ' ' VAL . . . . . . . . . . . . . 55.5 t -119.13 122.04 68.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 175.628 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 873' ' ' LEU . . . . . 0.686 HD12 HG13 ' A' ' 829' ' ' VAL . 0.0 OUTLIER -112.15 122.49 47.89 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 178.982 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -109.83 104.19 13.1 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.05 179.729 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 875' ' ' ASP . . . . . 0.688 ' HB3' ' HB2' ' A' ' 831' ' ' ASP . 37.5 t0 -97.46 112.09 24.08 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.061 -176.901 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 876' ' ' VAL . . . . . 0.409 ' O ' ' HA ' ' A' ' 903' ' ' THR . 1.1 t -128.38 124.89 62.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.48 0.657 . . . . 0.0 112.223 -172.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 877' ' ' ASN . . . . . 0.475 ' H ' ' CG ' ' A' ' 832' ' ' ASP . 1.3 t30 -98.94 -38.87 8.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.098 -0.955 . . . . 0.0 109.24 171.631 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.323 -0.571 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.642 177.31 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.65 0 CA-C-O 120.12 -0.267 . . . . 0.0 113.173 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 23.2 p90 -126.51 -33.2 2.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 117.289 0.544 . . . . 0.0 111.077 -177.547 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 885' ' ' ARG . . . . . 0.695 ' O ' ' HB2' ' A' ' 889' ' ' ARG . 0.0 OUTLIER -60.22 -32.67 71.34 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.12 -178.777 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.32 -46.95 75.13 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.675 0.274 . . . . 0.0 110.694 -177.79 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.22 -37.48 61.08 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.063 0.459 . . . . 0.0 111.236 -176.701 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 -70.95 -47.24 60.1 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.823 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 889' ' ' ARG . . . . . 0.695 ' HB2' ' O ' ' A' ' 885' ' ' ARG . 0.0 OUTLIER -62.88 -39.12 93.49 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.394 -178.708 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 890' ' ' ILE . . . . . . . . . . . . . 4.3 tt -67.63 -40.38 83.99 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 C-N-CA 120.769 -0.373 . . . . 0.0 111.116 -178.837 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 891' ' ' ARG . . . . . 0.501 ' HA ' ' CB ' ' A' ' 895' ' ' LEU . 2.5 ptm180 -75.82 -23.87 55.81 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 120.74 0.305 . . . . 0.0 110.807 178.715 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -74.44 -44.3 52.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.868 -179.771 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 893' ' ' LEU . . . . . 0.435 HD23 ' HA ' ' A' ' 893' ' ' LEU . 1.2 mt -67.85 -44.52 76.94 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.953 -178.198 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 155.76 67.41 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.399 178.862 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 895' ' ' LEU . . . . . 0.501 ' CB ' ' HA ' ' A' ' 891' ' ' ARG . 3.6 tp -76.12 111.27 11.35 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.794 0.331 . . . . 0.0 110.556 179.296 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -134.62 25.01 3.73 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.244 0.545 . . . . 0.0 110.339 177.295 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 897' ' ' LEU . . . . . 0.41 ' HA ' ' HD3' ' A' ' 898' ' ' PRO . 0.4 OUTLIER -135.76 150.13 70.91 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.863 -177.857 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 898' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 897' ' ' LEU . 14.4 Cg_exo -69.47 118.4 5.66 Favored 'Trans proline' 0 C--O 1.236 0.396 0 C-N-CA 122.812 2.341 . . . . 0.0 112.742 -178.641 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 899' ' ' VAL . . . . . 0.803 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 94.6 t -104.15 117.8 50.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 121.087 0.47 . . . . 0.0 109.905 175.567 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 900' ' ' ILE . . . . . 0.684 HG23 ' HB2' ' A' ' 921' ' ' SER . 5.9 mt -90.69 107.58 18.69 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.241 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 901' ' ' GLY . . . . . 0.566 ' O ' ' HA ' ' A' ' 922' ' ' CYS . . . -91.19 113.95 4.4 Favored Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.835 -0.698 . . . . 0.0 111.828 179.38 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 902' ' ' VAL . . . . . 0.673 ' HB ' HD12 ' A' ' 923' ' ' LEU . 0.3 OUTLIER -113.47 130.63 67.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 -179.9 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 903' ' ' THR . . . . . 0.523 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.3 OUTLIER -131.08 160.97 33.11 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.7 -177.422 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 904' ' ' ALA . . . . . 0.727 ' HB2' ' HB2' ' A' ' 925' ' ' LYS . . . -121.58 105.28 10.3 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.68 0.276 . . . . 0.0 111.582 -178.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 8.3 t30 61.14 51.33 4.45 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.559 172.642 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 906' ' ' ALA . . . . . 0.494 ' HB3' ' HG3' ' A' ' 909' ' ' GLU . . . -90.46 -27.09 19.48 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 175.308 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER 65.57 20.48 11.64 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.883 174.26 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -161.63 30.76 0.13 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.246 -0.888 . . . . 0.0 108.785 178.229 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 909' ' ' GLU . . . . . 0.494 ' HG3' ' HB3' ' A' ' 906' ' ' ALA . 0.7 OUTLIER -64.31 -34.36 77.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.884 -1.053 . . . . 0.0 111.182 -173.279 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 910' ' ' GLU . . . . . 0.586 ' HG2' ' N ' ' A' ' 911' ' ' LYS . 1.6 pm0 -67.6 -45.0 76.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.978 0.418 . . . . 0.0 110.52 -179.434 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 911' ' ' LYS . . . . . 0.586 ' N ' ' HG2' ' A' ' 910' ' ' GLU . 0.1 OUTLIER -72.29 -31.85 66.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.914 -177.926 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.02 -43.23 79.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.106 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 913' ' ' ARG . . . . . 0.489 ' HG3' ' N ' ' A' ' 914' ' ' CYS . 0.0 OUTLIER -66.64 -35.3 79.84 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 121.144 -0.222 . . . . 0.0 110.747 -179.663 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 914' ' ' CYS . . . . . 0.489 ' N ' ' HG3' ' A' ' 913' ' ' ARG . 91.3 m -72.4 -35.93 68.54 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.868 0.366 . . . . 0.0 110.648 178.343 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 1.1 tp -65.87 -41.42 91.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.102 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -75.2 -40.1 59.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.019 -179.38 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 50.45 45.16 26.7 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.909 177.758 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -145.09 25.59 1.9 Allowed Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.422 -178.427 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 919' ' ' MET . . . . . 0.803 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -119.4 -111.46 0.34 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.559 0.179 . . . . 0.0 110.814 -177.832 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 920' ' ' ASP . . . . . 0.512 ' HB2' ' O ' ' A' ' 919' ' ' MET . 13.8 t70 167.0 -53.95 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.971 0.908 . . . . 0.0 109.673 176.653 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 921' ' ' SER . . . . . 0.684 ' HB2' HG23 ' A' ' 900' ' ' ILE . 0.0 OUTLIER -118.32 172.13 7.66 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.052 -177.717 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 922' ' ' CYS . . . . . 0.566 ' HA ' ' O ' ' A' ' 901' ' ' GLY . 0.5 OUTLIER -154.18 139.1 17.2 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.019 -179.513 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 923' ' ' LEU . . . . . 0.673 HD12 ' HB ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -156.92 -175.47 5.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.772 175.178 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 924' ' ' SER . . . . . 0.523 ' HA ' ' O ' ' A' ' 903' ' ' THR . 0.5 OUTLIER -105.05 160.27 15.18 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.608 -179.059 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 925' ' ' LYS . . . . . 0.727 ' HB2' ' HB2' ' A' ' 904' ' ' ALA . 2.1 tttp -53.59 -48.36 93.34 Favored Pre-proline 0 CA--C 1.544 0.715 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 926' ' ' PRO . . . . . 0.532 ' HD3' ' HB3' ' A' ' 925' ' ' LYS . 31.8 Cg_exo -60.6 98.5 0.13 Allowed 'Trans proline' 0 C--N 1.357 0.981 0 C-N-CA 122.101 1.867 . . . . 0.0 112.53 175.774 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 927' ' ' VAL . . . . . 0.59 HG13 ' HB ' ' A' ' 931' ' ' VAL . 19.8 t -134.74 125.7 46.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.825 179.224 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -88.7 173.84 8.36 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.696 -0.229 . . . . 0.0 110.751 177.619 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 929' ' ' LEU . . . . . 0.42 HD23 ' HG2' ' A' ' 843' ' ' GLN . 0.5 OUTLIER -61.13 -32.67 72.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.621 0.248 . . . . 0.0 110.76 -179.129 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -70.9 -39.03 73.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.883 0.373 . . . . 0.0 110.38 -178.752 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 931' ' ' VAL . . . . . 0.59 ' HB ' HG13 ' A' ' 927' ' ' VAL . 46.8 t -70.59 -41.24 77.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.306 178.173 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 932' ' ' ILE . . . . . 0.494 HG12 HG11 ' A' ' 927' ' ' VAL . 0.3 OUTLIER -61.77 -41.46 90.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 109.97 -0.382 . . . . 0.0 109.97 177.308 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.87 -48.9 67.37 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.213 -177.776 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 934' ' ' GLN . . . . . 0.531 ' O ' ' HB2' ' A' ' 938' ' ' LEU . 0.0 OUTLIER -64.02 -31.71 73.0 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 121.22 -0.192 . . . . 0.0 111.225 -176.751 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 15.8 m -74.52 -46.41 39.36 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 120.687 0.279 . . . . 0.0 111.008 178.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 936' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' A' ' 936' ' ' LEU . 0.0 OUTLIER -63.5 -43.18 97.99 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.496 -179.943 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 37.6 m -66.61 -41.09 88.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.544 179.057 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 938' ' ' LEU . . . . . 0.531 ' HB2' ' O ' ' A' ' 934' ' ' GLN . 0.3 OUTLIER -59.53 -46.11 89.83 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.333 0.587 . . . . 0.0 110.607 179.251 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -77.76 -25.36 49.06 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.245 -177.835 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -62.86 -39.72 95.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.903 0.382 . . . . 0.0 110.386 174.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 941' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.26 -34.85 71.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.137 177.965 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 942' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.06 -47.89 75.72 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.772 179.133 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 35.4 m -71.25 -28.49 32.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.651 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.74 -50.54 71.92 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.827 177.359 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.31 -22.67 51.6 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.789 0.328 . . . . 0.0 111.392 -178.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 49.3 m -73.6 -29.86 62.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.921 0.391 . . . . 0.0 110.724 177.796 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -95.83 -61.51 1.44 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.675 -178.749 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 1.7 t70 . . . . . 0 C--N 1.325 -0.475 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.785 -178.548 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 705' ' ' SER . . . . . 0.439 ' HA ' ' HA3' ' A' ' 730' ' ' GLY . 0.5 OUTLIER . . . . . 0 N--CA 1.453 -0.304 0 CA-C-O 120.719 0.295 . . . . 0.0 110.665 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 116.1 -25.94 9.07 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.148 177.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 707' ' ' LYS . . . . . 0.516 ' HA ' ' HD2' ' A' ' 707' ' ' LYS . 10.2 mmmt -69.78 132.75 46.56 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 176.51 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 708' ' ' ARG . . . . . 0.511 ' HA ' HG23 ' A' ' 732' ' ' VAL . 24.9 mtt85 -100.61 161.56 13.51 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.478 0.656 . . . . 0.0 111.33 -173.542 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 1.1 m -136.78 113.85 10.59 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.253 -0.885 . . . . 0.0 108.722 173.038 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 710' ' ' TRP . . . . . 0.463 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 87.8 m95 -90.5 112.57 24.28 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.401 0.619 . . . . 0.0 110.153 -173.899 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 711' ' ' LEU . . . . . 0.482 HD21 ' HB2' ' A' ' 719' ' ' CYS . 0.4 OUTLIER -111.83 119.84 39.93 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.109 -0.95 . . . . 0.0 111.061 -170.194 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -126.66 63.84 1.28 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.825 177.086 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 713' ' ' VAL . . . . . 0.78 HG13 ' HB3' ' A' ' 750' ' ' ASP . 90.4 t -117.27 121.42 67.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.273 -179.239 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 13.8 mtt85 -71.81 -34.0 68.98 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.589 -179.748 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -69.7 108.01 3.71 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.525 178.899 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 716' ' ' ALA . . . . . 0.6 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -65.15 -32.31 73.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.829 -174.983 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.11 -44.97 78.58 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.304 0.573 . . . . 0.0 110.344 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 718' ' ' LEU . . . . . 0.41 ' HB3' HG11 ' A' ' 713' ' ' VAL . 0.3 OUTLIER -67.93 -49.04 64.17 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.774 177.854 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 719' ' ' CYS . . . . . 0.6 ' SG ' ' HA ' ' A' ' 716' ' ' ALA . 3.0 p -63.73 -42.46 97.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.999 -175.744 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 720' ' ' GLN . . . . . 0.586 ' HB2' ' O ' ' A' ' 716' ' ' ALA . 0.1 OUTLIER -65.47 -36.73 84.76 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 111.568 0.21 . . . . 0.0 111.568 -179.26 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -55.44 -59.27 5.05 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.925 0.393 . . . . 0.0 110.508 178.641 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 722' ' ' LEU . . . . . 0.524 HD13 HG21 ' A' ' 748' ' ' ILE . 6.9 mt -65.38 -47.26 77.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.28 -178.443 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 723' ' ' GLU . . . . . 0.594 ' HA ' HG21 ' A' ' 733' ' ' VAL . 0.1 OUTLIER -60.11 -48.47 81.57 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.337 -174.411 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 724' ' ' THR . . . . . . . . . . . . . 45.7 m -67.36 -36.4 81.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.186 -177.109 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 42.9 m -68.27 -37.34 80.62 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.787 0.327 . . . . 0.0 111.297 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 726' ' ' LEU . . . . . . . . . . . . . 14.2 mt -76.51 -38.13 55.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.443 -175.937 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 2.5 pp0? -74.77 0.44 15.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.621 0.248 . . . . 0.0 111.531 -178.048 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 2.2 mtm180 -64.27 -35.18 80.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.824 0.345 . . . . 0.0 110.204 178.032 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 729' ' ' SER . . . . . 0.49 ' HB2' ' H ' ' A' ' 730' ' ' GLY . 0.0 OUTLIER -93.32 -100.24 0.14 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.26 177.418 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 730' ' ' GLY . . . . . 0.49 ' H ' ' HB2' ' A' ' 729' ' ' SER . . . -143.46 20.97 2.23 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.802 -0.713 . . . . 0.0 111.717 178.721 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 731' ' ' ILE . . . . . . . . . . . . . 20.6 mm -83.32 116.21 27.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.925 0.393 . . . . 0.0 110.226 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 732' ' ' VAL . . . . . 0.511 HG23 ' HA ' ' A' ' 708' ' ' ARG . 0.0 OUTLIER -87.19 97.29 6.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.118 0.485 . . . . 0.0 110.966 -176.64 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 733' ' ' VAL . . . . . 0.594 HG21 ' HA ' ' A' ' 723' ' ' GLU . 6.1 t -77.34 135.85 25.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.556 176.134 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -143.98 135.33 25.77 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.823 0.344 . . . . 0.0 111.219 -173.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.17 112.61 1.59 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.937 176.536 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 736' ' ' TYR . . . . . 0.463 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 66.7 t80 -90.24 99.33 12.37 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.984 -176.889 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.23 -51.21 3.29 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 173.167 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -160.41 75.57 0.19 Allowed Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.907 -0.663 . . . . 0.0 111.91 175.33 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 739' ' ' GLN . . . . . 0.44 ' HG2' ' CZ3' ' A' ' 710' ' ' TRP . 1.2 mp0 -111.93 -161.39 0.75 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.475 0.178 . . . . 0.0 110.74 -178.24 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -104.48 136.54 19.16 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.364 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 741' ' ' PRO . . . . . 0.433 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 64.8 Cg_endo -84.04 123.35 3.12 Favored 'Trans proline' 0 N--CA 1.454 -0.845 0 C-N-CA 122.473 2.115 . . . . 0.0 111.894 176.421 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 742' ' ' THR . . . . . 0.624 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.1 OUTLIER -96.77 140.64 22.24 Favored Pre-proline 0 C--N 1.316 -0.889 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.863 176.886 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 743' ' ' PRO . . . . . 0.624 ' HD2' HG22 ' A' ' 742' ' ' THR . 28.3 Cg_endo -61.87 -13.67 32.19 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 123.171 2.581 . . . . 0.0 113.306 -173.818 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 744' ' ' GLU . . . . . 0.426 ' C ' ' HZ1' ' A' ' 707' ' ' LYS . 0.0 OUTLIER -116.36 5.87 13.6 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.031 178.888 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -102.09 153.78 19.6 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 120.979 0.419 . . . . 0.0 110.458 -177.564 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 746' ' ' VAL . . . . . 0.882 HG21 HD11 ' A' ' 795' ' ' LEU . 26.9 m -117.49 147.98 20.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 121.323 0.583 . . . . 0.0 111.927 -175.085 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 747' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -106.53 125.5 51.08 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.861 175.833 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 748' ' ' ILE . . . . . 0.524 HG21 HD13 ' A' ' 722' ' ' LEU . 2.5 mm -113.97 107.11 22.08 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 175.456 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 1.8 t -118.1 153.26 34.07 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.73 -0.214 . . . . 0.0 110.747 -176.787 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 750' ' ' ASP . . . . . 0.78 ' HB3' HG13 ' A' ' 713' ' ' VAL . 1.6 p-10 -100.9 146.76 26.94 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.587 -0.279 . . . . 0.0 110.475 175.146 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 61.88 -170.88 0.16 Allowed 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.768 178.263 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 752' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 769' ' ' HIS . 9.7 t -82.44 126.65 40.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.161 177.081 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 5.4 m -132.36 157.53 43.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.059 -179.599 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.57 76.09 10.21 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.911 0.386 . . . . 0.0 110.168 176.952 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.5 149.58 36.17 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.005 -177.696 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 11.6 tptt -121.55 -36.13 3.11 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.595 175.076 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 757' ' ' TRP . . . . . 0.433 ' CH2' ' HA ' ' A' ' 741' ' ' PRO . 68.0 t-105 69.27 95.89 0.07 Allowed 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.342 176.661 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -83.96 51.12 1.97 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.255 0.55 . . . . 0.0 110.402 177.681 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 759' ' ' GLY . . . . . . . . . . . . . . . -121.26 -135.07 4.72 Favored Glycine 0 N--CA 1.444 -0.778 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.667 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 3.3 ttt-85 -81.58 -60.94 2.08 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.94 0.4 . . . . 0.0 111.24 178.006 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -158.31 148.34 19.93 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.947 -176.889 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 4.5 p -117.9 127.47 75.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-O 121.41 0.624 . . . . 0.0 110.234 176.431 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 763' ' ' VAL . . . . . 0.562 HG11 HD21 ' A' ' 791' ' ' LEU . 46.2 t -111.27 122.23 65.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.761 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.722 177.443 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 764' ' ' THR . . . . . . . . . . . . . 3.9 m -107.7 116.54 32.13 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.436 -176.189 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 765' ' ' PHE . . . . . 0.653 ' HE1' HG23 ' A' ' 785' ' ' VAL . 12.3 m-85 -90.24 83.86 6.02 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.609 174.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -96.38 131.34 43.03 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 -177.431 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.25 -30.24 5.66 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.886 0.374 . . . . 0.0 110.787 -175.576 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 13.2 mmm180 -102.09 -59.02 1.77 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.928 -179.078 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 769' ' ' HIS . . . . . 0.411 ' O ' HG23 ' A' ' 752' ' ' VAL . 0.6 OUTLIER -116.56 133.35 56.12 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.87 -176.818 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 3.2 mp -117.71 91.27 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 121.203 0.525 . . . . 0.0 109.739 176.646 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -135.02 11.56 4.47 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.03 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 772' ' ' ILE . . . . . 0.653 HG12 ' HD2' ' A' ' 773' ' ' PRO . 0.1 OUTLIER -96.49 152.56 38.72 Favored Pre-proline 0 C--N 1.324 -0.521 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 -178.536 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 773' ' ' PRO . . . . . 0.653 ' HD2' HG12 ' A' ' 772' ' ' ILE . 84.7 Cg_exo -49.63 118.62 3.89 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 123.105 2.537 . . . . 0.0 113.005 178.521 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 774' ' ' LEU . . . . . 0.544 ' HB2' HG22 ' A' ' 782' ' ' VAL . 0.6 OUTLIER -98.19 -168.22 1.62 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.534 178.98 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 775' ' ' GLU . . . . . 0.569 ' HG3' ' HA ' ' A' ' 781' ' ' TRP . 1.3 mp0 -63.96 72.99 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 121.793 0.806 . . . . 0.0 112.874 178.339 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -129.62 6.09 5.16 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 114.751 -1.113 . . . . 0.0 108.532 169.199 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 777' ' ' ALA . . . . . 0.477 ' HB1' ' HD2' ' A' ' 778' ' ' PRO . . . -139.96 162.99 47.43 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 114.296 -1.32 . . . . 0.0 108.751 179.338 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 778' ' ' PRO . . . . . 0.477 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 88.0 Cg_endo -80.13 36.11 0.6 Allowed 'Trans proline' 0 CA--C 1.53 0.323 0 C-N-CA 122.414 2.076 . . . . 0.0 113.255 -175.117 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 177.32 31.53 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.246 -0.978 . . . . 0.0 112.72 -179.359 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 780' ' ' GLU . . . . . 0.49 ' HG2' ' HB2' ' A' ' 773' ' ' PRO . 0.9 OUTLIER -137.68 123.37 19.86 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 179.798 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 781' ' ' TRP . . . . . 0.569 ' HA ' ' HG3' ' A' ' 775' ' ' GLU . 25.2 m95 -137.55 143.86 41.79 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 123.188 0.305 . . . . 0.0 110.243 -177.336 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 782' ' ' VAL . . . . . 0.544 HG22 ' HB2' ' A' ' 774' ' ' LEU . 35.7 m -126.34 146.96 31.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 120.872 0.367 . . . . 0.0 110.516 171.802 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 783' ' ' HIS . . . . . 0.462 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 2.1 t-160 -160.64 138.73 9.79 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.828 0.347 . . . . 0.0 110.71 175.95 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 1.7 m -105.33 100.64 10.22 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.579 174.822 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 785' ' ' VAL . . . . . 0.653 HG23 ' HE1' ' A' ' 765' ' ' PHE . 0.0 OUTLIER -165.93 -176.76 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 178.323 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -111.66 31.65 6.01 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.867 0.365 . . . . 0.0 110.212 176.178 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 55.01 67.93 2.89 Favored Pre-proline 0 N--CA 1.467 0.383 0 CA-C-N 115.084 -0.962 . . . . 0.0 112.441 178.085 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 788' ' ' PRO . . . . . 0.564 ' HD2' ' OE1' ' A' ' 790' ' ' GLU . 16.9 Cg_exo -67.29 -66.21 0.04 OUTLIER 'Trans proline' 0 CA--C 1.529 0.255 0 C-N-CA 122.461 2.108 . . . . 0.0 111.955 179.096 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -170.39 24.32 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.937 0.399 . . . . 0.0 111.403 179.721 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 790' ' ' GLU . . . . . 0.564 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -104.45 -48.38 3.84 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.952 0.406 . . . . 0.0 110.212 -178.983 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 791' ' ' LEU . . . . . 0.562 HD21 HG11 ' A' ' 763' ' ' VAL . 0.4 OUTLIER -67.34 -47.54 48.6 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.622 179.794 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 792' ' ' PRO . . . . . 0.52 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 9.6 Cg_endo -57.98 -27.3 78.63 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 121.698 1.599 . . . . 0.0 111.952 175.192 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -76.19 -44.05 39.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.792 0.329 . . . . 0.0 110.599 177.718 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -60.54 -42.69 97.02 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 121.166 0.507 . . . . 0.0 110.136 176.053 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 795' ' ' LEU . . . . . 0.882 HD11 HG21 ' A' ' 746' ' ' VAL . 0.2 OUTLIER -63.87 -39.06 93.32 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.602 179.343 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -61.41 -47.3 86.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.362 175.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 797' ' ' ARG . . . . . 0.419 ' CZ ' ' HB2' ' A' ' 797' ' ' ARG . 0.0 OUTLIER -59.43 -41.92 90.68 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.058 179.375 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -75.56 -17.72 15.75 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.709 -177.361 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 2.3 m-30 -103.6 9.8 37.23 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.677 0.275 . . . . 0.0 110.66 178.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 95.4 mt . . . . . 0 N--CA 1.468 0.468 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.452 179.919 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 22.3 t70 . . . . . 0 CA--C 1.518 -0.264 0 CA-C-O 121.072 0.463 . . . . 0.0 110.357 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 825' ' ' MET . . . . . 0.438 ' HA ' ' OD2' ' A' ' 870' ' ' ASP . 0.0 OUTLIER -105.26 139.73 39.47 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.516 -179.852 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 826' ' ' MET . . . . . 0.68 ' HB2' ' HA ' ' A' ' 869' ' ' ILE . 0.0 OUTLIER -123.31 135.51 54.24 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.904 0.383 . . . . 0.0 110.75 177.574 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 827' ' ' ILE . . . . . 0.885 ' HB ' HD21 ' A' ' 844' ' ' LEU . 2.3 mm -120.02 120.34 62.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 176.781 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 828' ' ' LEU . . . . . 0.487 ' HB2' HG21 ' A' ' 869' ' ' ILE . 0.9 OUTLIER -105.2 123.48 47.91 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.78 0.324 . . . . 0.0 110.705 -178.759 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 829' ' ' VAL . . . . . 0.603 HG21 HD12 ' A' ' 840' ' ' LEU . 1.0 OUTLIER -102.29 118.81 49.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.092 0.472 . . . . 0.0 110.441 177.332 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 830' ' ' VAL . . . . . 0.485 HG11 ' HB2' ' A' ' 860' ' ' ALA . 0.2 OUTLIER -109.22 86.98 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.75 177.594 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 831' ' ' ASP . . . . . 0.696 ' HA ' ' O ' ' A' ' 875' ' ' ASP . 0.1 OUTLIER -106.7 147.47 29.55 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.873 0.368 . . . . 0.0 110.883 -176.101 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -89.24 -25.64 21.62 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -175.743 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 833' ' ' HIS . . . . . 0.447 ' HA ' ' HD2' ' A' ' 834' ' ' PRO . 0.6 OUTLIER -114.71 106.21 52.39 Favored Pre-proline 0 N--CA 1.464 0.275 0 O-C-N 121.941 -0.475 . . . . 0.0 111.681 -174.167 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 834' ' ' PRO . . . . . 0.447 ' HD2' ' HA ' ' A' ' 833' ' ' HIS . 1.7 Cg_endo -40.75 -47.07 4.75 Favored 'Trans proline' 0 C--N 1.349 0.555 1 C-N-CA 125.319 4.013 . . . . 0.0 115.604 -169.59 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 1.1 pp -59.32 -38.78 76.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 CA-C-O 121.243 0.544 . . . . 0.0 111.164 -176.335 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 836' ' ' ASN . . . . . 0.575 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 3.2 m-80 -68.63 -46.46 69.18 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.669 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 837' ' ' ARG . . . . . 0.557 ' HB2' ' OD2' ' A' ' 831' ' ' ASP . 0.0 OUTLIER -52.49 -45.73 66.31 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.495 178.262 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -59.06 -41.81 88.83 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.166 -179.563 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.02 -53.55 25.02 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -176.484 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 840' ' ' LEU . . . . . 0.603 HD12 HG21 ' A' ' 829' ' ' VAL . 0.0 OUTLIER -73.78 -27.95 61.41 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.583 -175.824 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -69.45 -29.9 67.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.963 0.411 . . . . 0.0 110.091 177.076 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -69.49 -41.16 76.49 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.961 175.241 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 843' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -62.84 -39.15 93.47 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.849 176.129 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 844' ' ' LEU . . . . . 0.885 HD21 ' HB ' ' A' ' 827' ' ' ILE . 0.0 OUTLIER -63.61 -31.31 72.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.636 174.957 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -69.78 -27.35 73.33 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.154 176.424 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.06 -45.64 17.94 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.653 0.263 . . . . 0.0 110.683 177.876 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -152.77 84.5 1.23 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.122 0.487 . . . . 0.0 110.345 176.732 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . -155.03 23.57 0.6 Allowed Glycine 0 N--CA 1.443 -0.835 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.029 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 11.2 m-85 55.52 -128.06 2.12 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.67 108.42 18.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.801 0.334 . . . . 0.0 110.225 176.58 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -80.97 125.97 30.8 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.597 -177.526 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 852' ' ' LYS . . . . . 0.432 ' HB3' HD12 ' A' ' 828' ' ' LEU . 0.0 OUTLIER -122.42 146.75 47.07 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 174.827 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -131.51 142.81 50.03 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -173.687 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 854' ' ' ALA . . . . . 0.464 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -156.46 165.48 36.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.011 175.612 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 855' ' ' ASN . . . . . 0.434 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 0.9 OUTLIER -148.76 74.04 1.25 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.887 0.375 . . . . 0.0 111.23 176.598 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 856' ' ' ASP . . . . . 0.478 ' OD1' HG23 ' A' ' 858' ' ' VAL . 7.1 t70 172.73 145.27 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.916 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -66.0 -39.5 94.84 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.034 177.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 858' ' ' VAL . . . . . 0.478 HG23 ' OD1' ' A' ' 856' ' ' ASP . 1.5 t -73.53 -32.28 35.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 O-C-N 122.713 -0.287 . . . . 0.0 110.87 -178.737 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -70.52 -34.02 71.82 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.005 0.431 . . . . 0.0 110.271 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 860' ' ' ALA . . . . . 0.485 ' HB2' HG11 ' A' ' 830' ' ' VAL . . . -64.72 -37.42 87.52 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.192 176.117 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 861' ' ' LEU . . . . . . . . . . . . . 1.4 mt -71.18 -35.31 71.54 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.42 176.607 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 40.8 t30 -65.8 -49.81 66.93 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.105 -179.474 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 10.7 p -64.93 -32.26 57.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.361 178.664 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 864' ' ' LEU . . . . . 0.515 HD21 HD22 ' A' ' 897' ' ' LEU . 0.5 OUTLIER -64.59 -42.75 95.39 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.624 175.642 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 16.5 m -69.08 -22.19 64.02 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.859 -179.26 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -79.16 -27.77 42.72 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.924 175.419 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 19.4 t30 62.61 94.66 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.133 -0.94 . . . . 0.0 112.644 175.79 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -171.18 53.08 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.251 170.771 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 869' ' ' ILE . . . . . 0.68 ' HA ' ' HB2' ' A' ' 826' ' ' MET . 0.1 OUTLIER -152.11 154.66 7.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.525 179.316 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 870' ' ' ASP . . . . . 0.438 ' OD2' ' HA ' ' A' ' 825' ' ' MET . 13.7 m-20 -112.11 -49.46 2.97 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.568 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 871' ' ' ILE . . . . . . . . . . . . . 41.8 mm -118.62 133.86 64.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.023 177.789 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 872' ' ' VAL . . . . . 0.696 HG23 HD11 ' A' ' 897' ' ' LEU . 13.5 t -116.72 128.48 74.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.954 -0.388 . . . . 0.0 109.954 177.034 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 873' ' ' LEU . . . . . 0.413 HD12 ' HB ' ' A' ' 829' ' ' VAL . 0.2 OUTLIER -109.74 113.24 25.84 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.875 0.369 . . . . 0.0 110.686 179.835 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.81 96.32 9.71 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 175.408 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 875' ' ' ASP . . . . . 0.726 ' CG ' ' HZ3' ' A' ' 925' ' ' LYS . 48.0 t0 -105.83 117.9 35.21 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.005 -173.376 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 2.4 t -141.58 133.31 27.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.114 0.483 . . . . 0.0 111.517 -175.019 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 877' ' ' ASN . . . . . 0.459 ' HB2' ' CE ' ' A' ' 925' ' ' LYS . 40.4 t-20 -127.47 54.77 1.65 Allowed 'General case' 0 C--O 1.234 0.273 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 171.92 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.322 -0.607 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.915 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.614 0 N-CA-C 110.264 -1.134 . . . . 0.0 110.264 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -177.66 -24.05 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -173.212 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 885' ' ' ARG . . . . . 0.422 ' C ' ' HD2' ' A' ' 885' ' ' ARG . 2.1 tmm_? -55.2 -49.6 71.53 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.989 -178.602 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 886' ' ' LEU . . . . . 0.515 ' HG ' ' N ' ' A' ' 887' ' ' THR . 0.2 OUTLIER -65.51 -34.22 77.75 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.359 -177.652 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 887' ' ' THR . . . . . 0.833 HG21 ' HG2' ' A' ' 919' ' ' MET . 0.0 OUTLIER -75.81 -33.33 60.1 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-O 120.742 0.306 . . . . 0.0 111.502 -178.413 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -57.26 -41.81 80.35 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 173.636 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.07 -33.53 72.04 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.2 177.344 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 890' ' ' ILE . . . . . 0.578 HG22 ' O ' ' A' ' 887' ' ' THR . 1.5 tp -68.09 -36.97 77.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 N-CA-C 111.798 0.295 . . . . 0.0 111.798 -177.654 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 891' ' ' ARG . . . . . 0.602 ' HA ' HD23 ' A' ' 895' ' ' LEU . 1.9 ptm180 -75.39 -28.58 59.52 Favored 'General case' 0 N--CA 1.46 0.067 0 C-N-CA 120.289 -0.564 . . . . 0.0 110.459 177.605 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -69.99 -34.61 73.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.061 0.458 . . . . 0.0 110.797 175.0 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 893' ' ' LEU . . . . . 0.488 HD23 ' HA ' ' A' ' 893' ' ' LEU . 2.7 mt -74.64 -45.72 42.91 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.808 179.423 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 122.61 70.23 0.25 Allowed Glycine 0 N--CA 1.448 -0.513 0 N-CA-C 111.386 -0.685 . . . . 0.0 111.386 -178.735 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 895' ' ' LEU . . . . . 0.602 HD23 ' HA ' ' A' ' 891' ' ' ARG . 0.6 OUTLIER -64.45 117.36 7.19 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.393 0.616 . . . . 0.0 110.843 -176.883 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.57 0.5 24.58 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.26 -178.257 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 897' ' ' LEU . . . . . 0.696 HD11 HG23 ' A' ' 872' ' ' VAL . 1.0 OUTLIER -126.81 154.02 75.98 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.788 -175.595 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -73.09 127.79 12.41 Favored 'Trans proline' 0 C--O 1.239 0.533 0 C-N-CA 123.084 2.522 . . . . 0.0 112.326 179.175 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 899' ' ' VAL . . . . . 0.812 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 3.2 t -108.42 116.07 50.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.365 178.903 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 900' ' ' ILE . . . . . 0.421 ' CG2' ' HG ' ' A' ' 923' ' ' LEU . 42.0 mt -95.09 106.67 18.48 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.887 178.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -86.94 93.32 1.87 Allowed Glycine 0 N--CA 1.445 -0.762 0 C-N-CA 120.867 -0.682 . . . . 0.0 112.341 -177.705 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 902' ' ' VAL . . . . . 0.617 ' O ' ' HA ' ' A' ' 875' ' ' ASP . 0.2 OUTLIER -91.0 108.76 20.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-O 121.663 0.744 . . . . 0.0 109.603 178.007 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -126.33 152.86 45.66 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.919 -179.014 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -71.23 105.39 3.42 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 168.742 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -48.31 110.76 0.37 Allowed 'General case' 0 CA--C 1.515 -0.376 0 O-C-N 124.073 0.858 . . . . 0.0 110.96 -171.606 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -85.52 -56.96 3.26 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.199 -175.325 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -166.84 -50.04 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 178.054 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -134.48 42.65 2.84 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.012 0.434 . . . . 0.0 111.335 -174.023 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.03 -31.72 72.44 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.394 -178.483 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 910' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -39.65 94.96 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.163 176.375 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.47 -36.61 79.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.109 178.293 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -60.39 -47.9 84.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.169 176.609 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.85 -43.77 90.86 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.147 179.761 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 75.6 m -63.99 -32.5 74.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.807 0.337 . . . . 0.0 110.794 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 2.5 tp -70.59 -51.57 27.42 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.454 -179.128 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.54 -44.08 45.38 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.708 -175.392 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 51.19 42.48 28.86 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.208 0.528 . . . . 0.0 111.143 -176.226 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -119.59 -25.75 2.55 Favored Glycine 0 N--CA 1.447 -0.629 0 CA-C-N 115.716 -0.674 . . . . 0.0 112.225 -177.423 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 919' ' ' MET . . . . . 0.833 ' HG2' HG21 ' A' ' 887' ' ' THR . 2.1 mtt -78.41 -102.83 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.774 0.321 . . . . 0.0 110.158 177.12 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 920' ' ' ASP . . . . . 0.498 ' HB2' ' O ' ' A' ' 919' ' ' MET . 19.6 t70 170.3 -65.31 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 123.699 0.8 . . . . 0.0 109.772 175.196 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -113.26 158.32 20.66 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.802 -177.943 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 922' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -116.72 118.99 34.08 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 175.553 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 923' ' ' LEU . . . . . 0.421 ' HG ' ' CG2' ' A' ' 900' ' ' ILE . 0.3 OUTLIER -116.02 161.23 19.17 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.119 -178.858 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 2.6 m -102.15 137.62 40.17 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.313 178.215 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 925' ' ' LYS . . . . . 0.726 ' HZ3' ' CG ' ' A' ' 875' ' ' ASP . 0.0 OUTLIER -52.0 -41.46 79.86 Favored Pre-proline 0 CA--C 1.541 0.597 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 177.726 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -67.78 65.94 0.88 Allowed 'Trans proline' 0 C--N 1.357 1.004 0 C-N-CA 121.975 1.783 . . . . 0.0 112.417 171.643 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 5.3 p -99.19 145.65 9.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.139 179.053 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 34.0 p -102.91 174.06 6.04 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.586 0.231 . . . . 0.0 110.441 179.227 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 929' ' ' LEU . . . . . 0.429 HD23 ' HA ' ' A' ' 929' ' ' LEU . 0.0 OUTLIER -60.85 -34.74 75.06 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 175.141 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -74.45 -45.62 45.17 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.209 -177.69 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 79.0 t -67.4 -38.99 81.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 120.905 0.383 . . . . 0.0 110.735 -179.153 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 932' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -63.47 -37.59 79.96 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 175.583 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 20.2 ttmt -63.66 -48.38 77.43 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.579 177.917 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -55.04 -54.97 36.2 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.346 178.975 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 1.5 m -62.11 -46.29 89.69 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.725 -176.65 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 936' ' ' LEU . . . . . 0.4 ' HA ' HD12 ' A' ' 936' ' ' LEU . 0.9 OUTLIER -62.7 -44.51 96.06 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.61 -0.268 . . . . 0.0 110.797 -179.507 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 56.1 m -64.33 -48.24 76.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.307 -179.651 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 3.1 tp -63.1 -37.38 86.97 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.433 -176.883 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -79.43 -34.2 41.87 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.779 -0.368 . . . . 0.0 111.034 -179.186 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 940' ' ' ALA . . . . . 0.454 ' O ' ' HB2' ' A' ' 944' ' ' ARG . . . -66.43 -38.85 88.35 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.841 178.085 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 941' ' ' GLU . . . . . 0.532 ' HG3' ' N ' ' A' ' 942' ' ' ARG . 0.0 OUTLIER -70.3 -33.82 72.0 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 177.001 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 942' ' ' ARG . . . . . 0.532 ' N ' ' HG3' ' A' ' 941' ' ' GLU . 1.6 tpm_? -64.84 -48.17 75.31 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.85 179.565 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 31.4 m -69.2 -29.57 43.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 178.118 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 944' ' ' ARG . . . . . 0.454 ' HB2' ' O ' ' A' ' 940' ' ' ALA . 0.0 OUTLIER -64.58 -35.13 79.98 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.78 176.814 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 945' ' ' LYS . . . . . 0.402 ' HG2' ' O ' ' A' ' 941' ' ' GLU . 1.1 mmtp -65.08 -42.34 94.22 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.296 0.57 . . . . 0.0 110.362 176.565 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 5.0 m -72.18 -17.68 61.92 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.297 179.069 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.4 -61.15 1.76 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.863 0.364 . . . . 0.0 110.972 -179.497 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 . . . . . 0 C--N 1.326 -0.444 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.055 -177.469 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.421 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 122.85 -11.23 8.84 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.482 -179.713 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 4.1 mmtt -74.41 147.0 42.46 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 178.085 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 708' ' ' ARG . . . . . 0.471 ' HA ' HG23 ' A' ' 732' ' ' VAL . 2.7 mtm180 -102.81 156.47 17.63 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.078 0.466 . . . . 0.0 111.754 -172.128 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 709' ' ' CYS . . . . . 0.431 ' SG ' ' HE2' ' A' ' 799' ' ' TYR . 1.0 OUTLIER -142.37 115.04 8.58 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.973 174.794 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 710' ' ' TRP . . . . . 0.491 ' CZ3' ' HB ' ' A' ' 734' ' ' THR . 91.1 m95 -91.41 118.12 30.27 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 -178.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 711' ' ' LEU . . . . . 0.573 HD22 HG12 ' A' ' 733' ' ' VAL . 1.9 pt? -118.72 127.61 53.72 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.496 0.665 . . . . 0.0 111.605 -177.423 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -127.05 58.73 1.43 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.541 175.833 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 713' ' ' VAL . . . . . 0.801 HG13 ' HB2' ' A' ' 750' ' ' ASP . 21.2 t -96.93 121.42 47.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.628 -179.547 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 714' ' ' ARG . . . . . 0.603 ' H ' ' HB3' ' A' ' 750' ' ' ASP . 38.0 mtp85 -66.96 -46.86 73.39 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.193 -175.972 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 715' ' ' ASN . . . . . 0.487 ' O ' ' HB2' ' A' ' 719' ' ' CYS . 7.6 p30 -78.96 133.39 36.88 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.236 179.131 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -77.69 -17.39 57.7 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.529 -175.093 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.43 -56.58 19.64 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.098 0.475 . . . . 0.0 110.182 178.382 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 718' ' ' LEU . . . . . 0.557 ' HB3' HG11 ' A' ' 713' ' ' VAL . 0.6 OUTLIER -72.58 -39.47 67.37 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.552 178.579 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 719' ' ' CYS . . . . . 0.734 ' SG ' ' HB ' ' A' ' 713' ' ' VAL . 0.1 OUTLIER -55.48 -52.64 62.97 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.12 -178.905 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 720' ' ' GLN . . . . . 0.525 ' O ' ' HG2' ' A' ' 723' ' ' GLU . 0.6 OUTLIER -67.85 -42.85 80.75 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.392 -177.705 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 721' ' ' PHE . . . . . 0.462 ' HE2' ' HG3' ' A' ' 792' ' ' PRO . 57.2 t80 -58.18 -54.76 43.31 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.734 0.302 . . . . 0.0 110.738 -179.476 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 722' ' ' LEU . . . . . 0.443 HD21 HD12 ' A' ' 791' ' ' LEU . 0.7 OUTLIER -60.09 -44.36 94.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.892 -177.72 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 723' ' ' GLU . . . . . 0.525 ' HG2' ' O ' ' A' ' 720' ' ' GLN . 6.3 pt-20 -62.64 -36.3 82.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.881 -178.233 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 724' ' ' THR . . . . . . . . . . . . . 87.8 m -65.12 -44.56 88.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.178 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.98 -37.66 85.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.987 0.422 . . . . 0.0 111.173 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 726' ' ' LEU . . . . . 0.5 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 23.7 mt -74.49 -48.09 29.34 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.988 -177.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.71 -5.74 44.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.733 -177.984 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.13 -27.65 59.87 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 175.424 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 729' ' ' SER . . . . . 0.445 ' HB2' ' H ' ' A' ' 730' ' ' GLY . 0.3 OUTLIER -90.03 -104.15 0.09 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.897 175.796 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 730' ' ' GLY . . . . . 0.445 ' H ' ' HB2' ' A' ' 729' ' ' SER . . . -148.26 31.24 1.3 Allowed Glycine 0 N--CA 1.446 -0.691 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 175.216 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 731' ' ' ILE . . . . . 0.5 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 15.3 mm -95.77 126.0 48.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.736 0.303 . . . . 0.0 110.369 -177.307 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 732' ' ' VAL . . . . . 0.471 HG23 ' HA ' ' A' ' 708' ' ' ARG . 0.0 OUTLIER -85.86 98.53 6.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 121.275 0.559 . . . . 0.0 110.553 179.629 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 733' ' ' VAL . . . . . 0.573 HG12 HD22 ' A' ' 711' ' ' LEU . 0.1 OUTLIER -71.59 113.33 8.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.159 177.867 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 734' ' ' THR . . . . . 0.491 ' HB ' ' CZ3' ' A' ' 710' ' ' TRP . 0.2 OUTLIER -118.46 127.03 53.26 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.19 0.519 . . . . 0.0 110.824 -178.408 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -55.66 124.61 17.97 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.972 174.889 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 736' ' ' TYR . . . . . 0.663 ' HE2' ' HD3' ' A' ' 755' ' ' LYS . 9.4 t80 -81.19 70.07 7.95 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.622 0.725 . . . . 0.0 109.846 177.063 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 737' ' ' GLU . . . . . 0.482 ' HG3' ' H ' ' A' ' 737' ' ' GLU . 3.5 mt-10 -75.51 -25.04 56.91 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.788 -177.667 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 154.3 60.9 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.344 0 N-CA-C 111.431 -0.668 . . . . 0.0 111.431 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 26.7 mp0 -112.55 -178.84 3.5 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.77 0.319 . . . . 0.0 110.89 -175.646 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 740' ' ' GLU . . . . . 0.432 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 0.0 OUTLIER -81.6 143.99 51.96 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.941 -177.497 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 741' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 740' ' ' GLU . 1.3 Cg_endo -82.32 123.17 3.84 Favored 'Trans proline' 0 N--CA 1.452 -0.925 0 C-N-CA 122.644 2.229 . . . . 0.0 111.701 175.837 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 742' ' ' THR . . . . . 0.419 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.1 OUTLIER -110.73 136.18 20.71 Favored Pre-proline 0 C--N 1.32 -0.703 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.755 178.966 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 743' ' ' PRO . . . . . 0.419 ' HD2' HG22 ' A' ' 742' ' ' THR . 37.8 Cg_endo -66.5 -1.91 6.46 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 123.053 2.502 . . . . 0.0 112.883 -179.279 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.27 -9.63 18.44 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.498 178.279 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -109.27 152.18 25.56 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.415 -0.812 . . . . 0.0 111.204 -170.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 16.2 m -116.68 147.85 19.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.429 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 747' ' ' LEU . . . . . 0.665 HD22 HG23 ' A' ' 749' ' ' THR . 0.4 OUTLIER -108.14 135.22 49.85 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.001 177.813 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 1.7 mt -117.77 118.09 57.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 173.531 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 749' ' ' THR . . . . . 0.665 HG23 HD22 ' A' ' 747' ' ' LEU . 2.5 p -125.18 150.19 47.19 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -167.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 750' ' ' ASP . . . . . 0.801 ' HB2' HG13 ' A' ' 713' ' ' VAL . 34.8 t0 -113.54 116.59 29.78 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.773 175.005 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 751' ' ' GLU . . . . . 0.678 ' HG3' ' H ' ' A' ' 752' ' ' VAL . 1.8 tp10 68.17 -177.85 0.21 Allowed 'General case' 0 CA--C 1.536 0.432 0 O-C-N 123.868 0.73 . . . . 0.0 111.063 -177.173 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 752' ' ' VAL . . . . . 0.678 ' H ' ' HG3' ' A' ' 751' ' ' GLU . 15.2 t -75.19 100.2 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.298 -176.984 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 753' ' ' VAL . . . . . 0.422 HG21 HG21 ' A' ' 749' ' ' THR . 19.5 m -90.33 -0.29 8.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.483 176.38 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 58.31 41.35 23.38 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.351 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 755' ' ' LYS . . . . . 0.663 ' HD3' ' HE2' ' A' ' 736' ' ' TYR . 0.1 OUTLIER -120.03 126.97 52.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.318 180.0 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 2.1 tmtm? -81.43 -42.27 20.63 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.06 -179.57 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 76.0 t-105 62.46 90.44 0.07 Allowed 'General case' 0 CA--C 1.53 0.21 0 O-C-N 123.71 0.631 . . . . 0.0 111.657 179.388 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -83.23 58.82 4.66 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.148 0.499 . . . . 0.0 109.822 175.878 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 759' ' ' GLY . . . . . . . . . . . . . . . -117.62 -144.28 7.68 Favored Glycine 0 N--CA 1.444 -0.791 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.901 -178.056 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 760' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 760' ' ' ARG . 0.7 OUTLIER -75.81 -53.27 8.74 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.96 0.41 . . . . 0.0 110.242 179.217 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -161.49 156.56 23.7 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.386 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 762' ' ' VAL . . . . . 0.597 HG23 ' HB3' ' A' ' 747' ' ' LEU . 3.0 p -140.75 126.87 20.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-O 121.126 0.489 . . . . 0.0 109.852 179.004 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 18.6 t -111.65 105.29 18.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.05 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 764' ' ' THR . . . . . 0.482 ' HA ' ' OG1' ' A' ' 749' ' ' THR . 33.4 m -97.66 119.68 36.66 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.219 0.533 . . . . 0.0 110.607 178.749 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 765' ' ' PHE . . . . . 0.757 ' HZ ' ' HG ' ' A' ' 791' ' ' LEU . 33.0 m-85 -76.98 123.88 26.97 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.633 175.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 766' ' ' CYS . . . . . 0.494 ' SG ' ' HB ' ' A' ' 782' ' ' VAL . 0.0 OUTLIER -95.58 131.64 41.57 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 176.925 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.72 -69.34 0.74 Allowed 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.902 0.382 . . . . 0.0 110.672 -177.034 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 768' ' ' ARG . . . . . 0.439 ' HA ' ' HD2' ' A' ' 768' ' ' ARG . 0.0 OUTLIER -118.69 -30.09 5.21 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.261 -177.988 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -114.77 134.06 55.41 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.312 0.577 . . . . 0.0 110.965 -178.568 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 2.7 mp -97.51 156.28 3.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 173.131 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . 175.45 -43.37 0.12 Allowed Glycine 0 CA--C 1.505 -0.571 0 N-CA-C 110.612 -0.995 . . . . 0.0 110.612 -177.474 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 772' ' ' ILE . . . . . 0.456 ' HA ' ' HD3' ' A' ' 773' ' ' PRO . 17.5 mm -87.03 123.4 70.3 Favored Pre-proline 0 C--N 1.321 -0.643 0 N-CA-C 108.374 -0.972 . . . . 0.0 108.374 169.358 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 773' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' A' ' 772' ' ' ILE . 23.7 Cg_exo -62.63 -85.62 0.01 OUTLIER 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.982 2.455 . . . . 0.0 112.673 -175.371 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 774' ' ' LEU . . . . . 0.603 ' O ' ' HB3' ' A' ' 780' ' ' GLU . 0.9 OUTLIER 171.53 -155.41 0.01 OUTLIER 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 -179.901 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 775' ' ' GLU . . . . . 0.575 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 2.6 mp0 -60.3 75.13 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 122.082 0.944 . . . . 0.0 112.269 174.242 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 12.5 mmmt -119.19 -45.71 2.54 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 114.17 -1.377 . . . . 0.0 109.008 171.851 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 777' ' ' ALA . . . . . 0.689 ' HB1' ' HD2' ' A' ' 778' ' ' PRO . . . -91.57 165.88 19.66 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 115.333 -0.848 . . . . 0.0 110.233 179.771 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 778' ' ' PRO . . . . . 0.689 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 24.0 Cg_endo -60.91 91.81 0.1 OUTLIER 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.829 2.352 . . . . 0.0 113.18 -178.325 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 99.05 15.06 34.37 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.797 176.406 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 780' ' ' GLU . . . . . 0.603 ' HB3' ' O ' ' A' ' 774' ' ' LEU . 2.2 tt0 -84.23 122.01 28.29 Favored 'General case' 0 C--O 1.218 -0.589 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 -179.138 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 17.6 m95 -133.49 143.54 48.85 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.626 0.25 . . . . 0.0 110.344 178.874 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 782' ' ' VAL . . . . . 0.578 HG13 ' HA ' ' A' ' 774' ' ' LEU . 17.1 m -134.66 156.57 40.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 172.782 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 783' ' ' HIS . . . . . 0.466 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.1 OUTLIER -176.22 144.34 0.56 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.725 0.298 . . . . 0.0 110.896 178.228 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 4.9 m -105.74 102.77 12.19 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.354 175.923 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 785' ' ' VAL . . . . . 0.517 HG23 ' HE2' ' A' ' 765' ' ' PHE . 0.1 OUTLIER -150.57 155.28 7.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.67 0.271 . . . . 0.0 110.543 178.191 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -86.73 7.41 26.86 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.428 174.229 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 787' ' ' ALA . . . . . 0.469 ' H ' ' HB ' ' A' ' 785' ' ' VAL . . . 57.8 63.6 4.51 Favored Pre-proline 0 N--CA 1.464 0.251 0 CA-C-N 115.22 -0.9 . . . . 0.0 112.2 179.109 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 788' ' ' PRO . . . . . 0.42 ' HD3' ' N ' ' A' ' 787' ' ' ALA . 21.2 Cg_exo -66.58 -54.84 0.41 Allowed 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.135 1.89 . . . . 0.0 111.725 176.83 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 7.3 p-80 -161.05 -22.12 0.05 Allowed 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 176.418 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 790' ' ' GLU . . . . . 0.428 ' CD ' ' H ' ' A' ' 790' ' ' GLU . 2.0 pm0 -72.83 -38.6 67.08 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -175.454 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 791' ' ' LEU . . . . . 0.757 ' HG ' ' HZ ' ' A' ' 765' ' ' PHE . 1.2 tm? -62.21 -54.62 47.96 Favored Pre-proline 0 CA--C 1.536 0.438 0 N-CA-C 111.65 0.241 . . . . 0.0 111.65 -178.067 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 792' ' ' PRO . . . . . 0.462 ' HG3' ' HE2' ' A' ' 721' ' ' PHE . 11.2 Cg_endo -58.37 -26.6 78.17 Favored 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 121.523 1.482 . . . . 0.0 112.201 176.594 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -71.79 -40.56 69.15 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.789 176.929 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 794' ' ' LEU . . . . . 0.435 HD22 ' HD2' ' A' ' 797' ' ' ARG . 1.9 tm? -59.62 -47.17 86.66 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.107 0.48 . . . . 0.0 109.784 176.818 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 795' ' ' LEU . . . . . 0.496 ' HA ' ' HB ' ' A' ' 798' ' ' ILE . 0.2 OUTLIER -70.89 -29.7 65.85 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.13 -178.755 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -62.67 -46.51 87.84 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 174.581 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 797' ' ' ARG . . . . . 0.435 ' HD2' HD22 ' A' ' 794' ' ' LEU . 0.1 OUTLIER -64.3 -33.51 76.0 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.06 177.054 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 798' ' ' ILE . . . . . 0.496 ' HB ' ' HA ' ' A' ' 795' ' ' LEU . 0.3 OUTLIER -62.01 -32.28 53.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.879 178.771 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 799' ' ' TYR . . . . . 0.435 ' HD1' ' HA ' ' A' ' 799' ' ' TYR . 0.6 OUTLIER -103.91 15.54 28.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.155 179.6 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 9.7 mt . . . . . 0 C--O 1.233 0.192 0 CA-C-N 115.878 -0.601 . . . . 0.0 112.127 176.34 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 824' ' ' ASP . . . . . 0.436 ' HB3' ' H ' ' A' ' 825' ' ' MET . 0.9 OUTLIER . . . . . 0 N--CA 1.445 -0.686 0 CA-C-O 121.14 0.495 . . . . 0.0 111.13 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 825' ' ' MET . . . . . 0.436 ' H ' ' HB3' ' A' ' 824' ' ' ASP . 2.7 ttm -151.53 140.86 21.44 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.004 -175.336 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 826' ' ' MET . . . . . 0.736 ' HG3' ' HA ' ' A' ' 869' ' ' ILE . 1.6 ptp -135.05 123.34 23.09 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.155 0.502 . . . . 0.0 110.841 178.93 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 827' ' ' ILE . . . . . 0.534 HG23 ' HB ' ' A' ' 871' ' ' ILE . 5.5 mm -108.25 140.72 25.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.816 -179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 828' ' ' LEU . . . . . 0.422 HD23 HG22 ' A' ' 872' ' ' VAL . 16.2 tp -106.55 118.33 36.39 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.139 0.495 . . . . 0.0 110.615 -178.179 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 829' ' ' VAL . . . . . 0.673 HG12 HD11 ' A' ' 873' ' ' LEU . 0.0 OUTLIER -106.27 109.88 29.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.257 -179.803 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 830' ' ' VAL . . . . . 0.487 HG22 ' HB3' ' A' ' 854' ' ' ALA . 13.4 t -109.54 100.39 10.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.232 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 831' ' ' ASP . . . . . 0.497 ' HA ' ' O ' ' A' ' 875' ' ' ASP . 7.2 t0 -112.34 149.2 32.79 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 -177.75 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -91.02 -22.13 20.93 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.841 179.76 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 833' ' ' HIS . . . . . 0.417 ' HA ' ' HD2' ' A' ' 834' ' ' PRO . 1.7 m80 -111.93 113.68 52.19 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.553 -176.053 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 834' ' ' PRO . . . . . 0.417 ' HD2' ' HA ' ' A' ' 833' ' ' HIS . 5.4 Cg_endo -48.22 -46.46 22.65 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 124.106 3.204 . . . . 0.0 114.173 -174.385 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -56.35 -46.6 81.86 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 120.961 0.41 . . . . 0.0 111.395 -178.868 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 836' ' ' ASN . . . . . 0.615 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 3.0 m120 -75.75 -35.13 60.28 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 -178.476 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 837' ' ' ARG . . . . . 0.464 HH11 ' HB ' ' A' ' 853' ' ' THR . 0.8 OUTLIER -53.09 -46.26 68.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.44 176.996 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 1.7 tmm_? -65.66 -39.95 91.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.448 177.789 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.71 -53.57 55.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.112 -176.655 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 840' ' ' LEU . . . . . 0.615 ' HG ' ' O ' ' A' ' 836' ' ' ASN . 0.0 OUTLIER -73.64 -33.31 64.46 Favored 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 120.603 -0.439 . . . . 0.0 111.144 -177.281 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -63.75 -45.43 89.89 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.967 0.413 . . . . 0.0 110.866 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -65.99 -38.99 89.91 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.52 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 843' ' ' GLN . . . . . 0.443 ' HG3' ' CD2' ' A' ' 929' ' ' LEU . 0.0 OUTLIER -70.67 -32.41 69.66 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.985 -178.514 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 844' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.2 -37.12 81.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.037 0.446 . . . . 0.0 109.842 173.631 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -64.57 -37.33 94.28 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.303 176.041 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -67.07 -26.69 66.86 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.953 0.406 . . . . 0.0 111.044 178.944 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.25 -13.17 61.09 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.572 177.864 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 84.68 30.04 27.86 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.877 -0.677 . . . . 0.0 112.849 176.818 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -124.61 144.45 50.16 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 20.6 mm-40 -65.92 134.75 53.65 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.903 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.06 133.63 55.73 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.131 -172.744 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.05 126.17 51.76 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 174.17 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 853' ' ' THR . . . . . 0.464 ' HB ' HH11 ' A' ' 837' ' ' ARG . 0.0 OUTLIER -106.66 138.62 42.5 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.926 0.393 . . . . 0.0 111.747 -174.593 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 854' ' ' ALA . . . . . 0.487 ' HB3' HG22 ' A' ' 830' ' ' VAL . . . -140.4 145.22 36.79 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.277 175.558 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 855' ' ' ASN . . . . . 0.467 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 0.6 OUTLIER -121.89 72.63 1.04 Allowed 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 176.146 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 856' ' ' ASP . . . . . 0.517 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 35.0 t70 164.25 141.06 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.007 0.923 . . . . 0.0 109.544 178.195 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 857' ' ' GLY . . . . . 0.514 ' HA3' ' HB2' ' A' ' 886' ' ' LEU . . . -67.18 -49.61 51.72 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.972 -0.632 . . . . 0.0 113.228 -177.516 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -73.73 -31.31 31.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.135 0.493 . . . . 0.0 110.728 -177.021 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 859' ' ' ASP . . . . . 0.517 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 18.9 t0 -58.91 -31.16 68.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.824 177.425 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 860' ' ' ALA . . . . . 0.408 ' O ' HG12 ' A' ' 863' ' ' VAL . . . -62.85 -33.79 75.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.79 177.329 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 861' ' ' LEU . . . . . 0.677 HD21 ' HA ' ' A' ' 890' ' ' ILE . 0.3 OUTLIER -69.01 -40.77 78.5 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.022 0.439 . . . . 0.0 110.261 178.794 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -59.35 -49.67 76.91 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.634 177.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 863' ' ' VAL . . . . . 0.408 HG12 ' O ' ' A' ' 860' ' ' ALA . 0.8 OUTLIER -66.42 -31.66 54.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.778 179.789 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 864' ' ' LEU . . . . . 0.476 ' HA ' HD22 ' A' ' 864' ' ' LEU . 0.6 OUTLIER -63.38 -41.93 98.81 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.012 0.434 . . . . 0.0 110.52 177.13 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 3.5 m -76.02 -22.68 55.51 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.578 -176.453 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.46 -44.61 9.51 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.388 -178.595 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -96.11 -133.03 0.2 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.405 -177.774 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 3.5 m170 -136.69 -76.9 0.42 Allowed 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 178.758 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 869' ' ' ILE . . . . . 0.736 ' HA ' ' HG3' ' A' ' 826' ' ' MET . 3.0 mt 69.35 134.6 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 O-C-N 123.792 0.682 . . . . 0.0 111.405 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -98.28 -47.95 5.25 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.485 -178.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 871' ' ' ILE . . . . . 0.611 HD12 ' HD2' ' A' ' 939' ' ' TYR . 36.3 mm -121.62 131.51 72.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.298 -179.607 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 872' ' ' VAL . . . . . 0.752 HG23 HD11 ' A' ' 897' ' ' LEU . 17.0 t -111.82 135.38 51.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 110.125 -0.324 . . . . 0.0 110.125 177.47 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 873' ' ' LEU . . . . . 0.673 HD11 HG12 ' A' ' 829' ' ' VAL . 1.2 pp -139.99 141.72 36.35 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.937 0.399 . . . . 0.0 110.382 174.991 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -119.72 102.06 8.34 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.639 -179.024 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 875' ' ' ASP . . . . . 0.595 ' OD1' ' HG2' ' A' ' 925' ' ' LYS . 0.4 OUTLIER -89.1 106.28 18.33 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.896 -179.583 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -119.16 125.7 74.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-O 121.165 0.507 . . . . 0.0 111.654 -173.939 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 877' ' ' ASN . . . . . 0.425 ' CB ' ' HD2' ' A' ' 925' ' ' LYS . 0.1 OUTLIER -96.47 -35.61 11.08 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 172.418 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.319 -0.749 0 CA-C-N 114.882 -1.054 . . . . 0.0 108.741 172.427 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.275 0 N-CA-C 112.859 -0.096 . . . . 0.0 112.859 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -131.15 -28.07 1.96 Allowed 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 177.773 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.51 -39.82 67.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.704 -178.538 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 886' ' ' LEU . . . . . 0.604 ' HG ' ' N ' ' A' ' 887' ' ' THR . 0.0 OUTLIER -70.8 -44.19 67.11 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 121.123 -0.231 . . . . 0.0 110.949 -176.852 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 887' ' ' THR . . . . . 0.604 ' N ' ' HG ' ' A' ' 886' ' ' LEU . 0.0 OUTLIER -67.14 -41.78 85.49 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.972 0.415 . . . . 0.0 110.46 -178.964 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 888' ' ' GLN . . . . . 0.47 ' O ' ' HB2' ' A' ' 892' ' ' GLN . 8.6 tp60 -58.18 -41.01 82.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.15 176.846 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 11.0 mmt-85 -70.99 -35.03 71.93 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.941 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 890' ' ' ILE . . . . . 0.677 ' HA ' HD21 ' A' ' 861' ' ' LEU . 0.0 OUTLIER -66.75 -41.5 88.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 C-N-CA 121.175 -0.21 . . . . 0.0 110.914 -179.018 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 891' ' ' ARG . . . . . 0.492 ' HD2' ' HA3' ' A' ' 918' ' ' GLY . 0.0 OUTLIER -75.32 -24.11 57.37 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 120.711 -0.396 . . . . 0.0 110.502 175.843 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 892' ' ' GLN . . . . . 0.47 ' HB2' ' O ' ' A' ' 888' ' ' GLN . 0.0 OUTLIER -65.45 -38.87 91.12 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.796 178.274 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -83.81 -11.47 57.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.664 -179.581 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 87.04 85.92 1.11 Allowed Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.798 -0.715 . . . . 0.0 111.778 -178.58 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 895' ' ' LEU . . . . . 0.595 ' O ' ' HG ' ' A' ' 895' ' ' LEU . 0.5 OUTLIER -71.83 111.59 7.22 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.46 0.648 . . . . 0.0 110.827 -177.388 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -88.15 -12.61 43.5 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.011 179.74 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 897' ' ' LEU . . . . . 0.752 HD11 HG23 ' A' ' 872' ' ' VAL . 1.8 pt? -124.34 147.83 56.25 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.121 -177.634 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 898' ' ' PRO . . . . . 0.78 ' HB2' ' HE2' ' A' ' 939' ' ' TYR . 57.2 Cg_endo -71.28 141.19 38.65 Favored 'Trans proline' 0 C--O 1.242 0.701 0 C-N-CA 122.648 2.232 . . . . 0.0 112.748 -178.105 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 899' ' ' VAL . . . . . 0.877 HG13 ' HA ' ' A' ' 919' ' ' MET . 0.2 OUTLIER -127.28 144.74 36.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.409 0.623 . . . . 0.0 110.548 179.783 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 900' ' ' ILE . . . . . . . . . . . . . 2.5 mt -108.61 119.05 57.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.155 177.406 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -94.74 98.78 2.34 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.858 -0.686 . . . . 0.0 111.542 179.028 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 902' ' ' VAL . . . . . 0.843 ' HB ' HD12 ' A' ' 923' ' ' LEU . 0.1 OUTLIER -99.56 101.46 12.12 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 CA-C-O 121.717 0.77 . . . . 0.0 109.203 178.769 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 903' ' ' THR . . . . . 0.493 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.1 OUTLIER -105.12 173.73 6.18 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.812 -174.269 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -79.76 103.84 9.94 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.807 -0.357 . . . . 0.0 110.713 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 45.7 t30 18.82 91.78 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.76 0 O-C-N 125.219 1.574 . . . . 0.0 114.787 177.031 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -95.29 8.46 43.05 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.246 -0.434 . . . . 0.0 109.884 172.645 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 3.1 tp 69.25 -67.89 0.21 Allowed 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.596 -176.447 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -99.22 67.89 1.61 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.128 0.49 . . . . 0.0 109.814 176.406 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.42 -27.88 67.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.676 -178.44 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 910' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.84 -40.87 94.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.638 176.359 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 3.9 tttt -70.53 -32.83 70.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.269 -179.153 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.5 -44.29 94.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.715 174.641 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 913' ' ' ARG . . . . . 0.839 ' HA ' ' HE1' ' A' ' 919' ' ' MET . 1.0 OUTLIER -59.93 -42.54 94.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.905 177.211 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 66.6 m -68.38 -34.73 76.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.282 -179.03 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.47 -44.69 74.27 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.817 -178.78 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 916' ' ' GLU . . . . . 0.573 ' OE1' ' HB ' ' A' ' 887' ' ' THR . 0.3 OUTLIER -77.14 -50.93 11.9 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.505 -177.701 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 2.1 m 50.24 47.88 23.04 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.568 -174.014 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 918' ' ' GLY . . . . . 0.492 ' HA3' ' HD2' ' A' ' 891' ' ' ARG . . . -132.67 7.37 5.24 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.166 -1.016 . . . . 0.0 112.965 -179.165 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 919' ' ' MET . . . . . 0.877 ' HA ' HG13 ' A' ' 899' ' ' VAL . 0.0 OUTLIER -121.89 -89.32 0.6 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.734 0.302 . . . . 0.0 110.296 -178.143 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 920' ' ' ASP . . . . . 0.527 ' HB2' ' O ' ' A' ' 919' ' ' MET . 25.5 t70 165.74 -54.79 0.0 OUTLIER 'General case' 0 CA--C 1.516 -0.347 0 O-C-N 124.404 1.065 . . . . 0.0 108.562 176.639 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 921' ' ' SER . . . . . 0.519 ' HA ' ' NH1' ' A' ' 913' ' ' ARG . 20.7 m -129.68 166.61 19.45 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.348 177.949 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 922' ' ' CYS . . . . . 0.405 ' HB2' ' HB2' ' A' ' 913' ' ' ARG . 0.8 OUTLIER -144.74 147.63 33.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.829 -178.898 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 923' ' ' LEU . . . . . 0.843 HD12 ' HB ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -150.2 -176.82 5.61 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 175.176 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 924' ' ' SER . . . . . 0.493 ' HA ' ' O ' ' A' ' 903' ' ' THR . 1.5 m -108.67 147.49 31.83 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 121.255 -0.178 . . . . 0.0 110.553 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 925' ' ' LYS . . . . . 0.595 ' HG2' ' OD1' ' A' ' 875' ' ' ASP . 0.0 OUTLIER -51.56 -40.79 72.67 Favored Pre-proline 0 CA--C 1.54 0.558 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 -175.577 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 926' ' ' PRO . . . . . 0.554 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 10.9 Cg_endo -57.18 84.86 0.04 OUTLIER 'Trans proline' 0 C--N 1.358 1.035 0 C-N-CA 121.915 1.744 . . . . 0.0 112.1 171.843 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 927' ' ' VAL . . . . . 0.621 HG13 ' HB ' ' A' ' 931' ' ' VAL . 2.3 t -122.55 129.2 75.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.341 -177.09 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.86 172.12 10.32 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.97 178.379 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 929' ' ' LEU . . . . . 0.443 ' CD2' ' HG3' ' A' ' 843' ' ' GLN . 1.0 OUTLIER -60.93 -41.9 97.11 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.416 -175.837 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.67 -29.07 68.26 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.989 0.424 . . . . 0.0 110.584 -179.105 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 931' ' ' VAL . . . . . 0.621 ' HB ' HG13 ' A' ' 927' ' ' VAL . 60.2 t -70.55 -51.11 40.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.956 -178.507 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 932' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -63.45 -37.52 79.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-O 120.842 0.353 . . . . 0.0 110.107 179.075 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.36 -45.76 92.35 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.32 175.78 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 934' ' ' GLN . . . . . 0.514 ' O ' ' HB2' ' A' ' 938' ' ' LEU . 47.5 mt-30 -67.54 -32.88 73.97 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.086 -178.812 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 8.6 m -64.67 -48.03 76.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.801 0.334 . . . . 0.0 110.438 178.076 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 936' ' ' LEU . . . . . . . . . . . . . 1.4 mp -62.93 -48.23 79.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.569 178.217 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 28.3 m -60.56 -44.83 95.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.548 -178.828 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 938' ' ' LEU . . . . . 0.514 ' HB2' ' O ' ' A' ' 934' ' ' GLN . 0.1 OUTLIER -58.5 -43.17 88.98 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.253 -177.989 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 939' ' ' TYR . . . . . 0.78 ' HE2' ' HB2' ' A' ' 898' ' ' PRO . 4.5 m-85 -79.17 -35.95 41.12 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.097 -177.37 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -62.3 -44.32 96.79 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.864 0.364 . . . . 0.0 110.717 178.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 941' ' ' GLU . . . . . 0.486 ' O ' ' HE2' ' A' ' 945' ' ' LYS . 4.1 pt-20 -70.41 -33.36 71.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.448 178.515 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 942' ' ' ARG . . . . . 0.428 ' N ' ' HG3' ' A' ' 941' ' ' GLU . 0.3 OUTLIER -64.34 -48.19 76.51 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.822 -179.336 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 28.6 m -71.15 -29.71 37.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.828 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.85 -47.15 86.36 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.237 178.679 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 945' ' ' LYS . . . . . 0.486 ' HE2' ' O ' ' A' ' 941' ' ' GLU . 0.1 OUTLIER -77.23 -22.47 52.22 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.901 -0.32 . . . . 0.0 111.124 -177.685 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 69.5 m -76.71 -32.84 58.11 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.809 0.338 . . . . 0.0 110.621 175.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.4 -42.59 18.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.079 -178.733 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 4.7 t70 . . . . . 0 C--N 1.325 -0.475 0 CA-C-O 121.235 0.541 . . . . 0.0 110.312 178.756 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.464 0.253 0 CA-C-O 120.98 0.419 . . . . 0.0 111.976 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 145.24 -11.9 1.82 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.199 -1.001 . . . . 0.0 112.644 -178.244 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 11.3 mmtt -67.27 140.03 57.34 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 175.313 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 708' ' ' ARG . . . . . 0.448 ' HG2' HG23 ' A' ' 732' ' ' VAL . 0.8 OUTLIER -105.31 141.89 36.04 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.037 0.446 . . . . 0.0 111.464 -174.759 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 1.5 m -121.94 110.24 15.61 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.275 174.642 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 710' ' ' TRP . . . . . 0.583 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 70.0 m95 -91.85 134.21 34.97 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 -178.467 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 711' ' ' LEU . . . . . 0.483 HD22 HG23 ' A' ' 733' ' ' VAL . 2.2 pt? -131.79 137.94 48.35 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 121.355 0.598 . . . . 0.0 111.264 -177.465 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -126.05 37.38 4.35 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.902 -1.044 . . . . 0.0 109.161 175.274 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 713' ' ' VAL . . . . . 0.832 ' HB ' ' HB3' ' A' ' 719' ' ' CYS . 2.1 t -87.75 116.34 29.69 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.833 177.751 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 714' ' ' ARG . . . . . 0.427 ' NH2' ' HB2' ' A' ' 751' ' ' GLU . 15.4 mtm180 -84.41 -16.2 43.57 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.439 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 54.9 t-20 -70.57 105.71 3.21 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.214 172.905 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 716' ' ' ALA . . . . . 0.644 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -60.92 -41.92 97.08 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.677 -174.759 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.69 -41.3 94.87 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.31 0.576 . . . . 0.0 110.376 179.21 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 718' ' ' LEU . . . . . 0.416 ' HB3' HG11 ' A' ' 713' ' ' VAL . 0.3 OUTLIER -73.74 -49.19 26.79 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.347 -177.891 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 719' ' ' CYS . . . . . 0.832 ' HB3' ' HB ' ' A' ' 713' ' ' VAL . 31.8 p -68.42 -40.68 81.11 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.013 -175.487 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 720' ' ' GLN . . . . . 0.587 ' O ' ' HG3' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -66.44 -39.75 89.09 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.46 -178.947 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -63.17 -46.58 86.43 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 121.165 0.507 . . . . 0.0 110.586 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.72 -47.42 78.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.921 -179.408 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 723' ' ' GLU . . . . . 0.587 ' HG3' ' O ' ' A' ' 720' ' ' GLN . 0.3 OUTLIER -60.12 -42.17 94.2 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.151 -176.75 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 724' ' ' THR . . . . . 0.61 ' O ' ' HG3' ' A' ' 728' ' ' ARG . 91.8 m -64.12 -36.87 85.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.881 0.372 . . . . 0.0 110.784 -179.553 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 725' ' ' SER . . . . . 0.441 ' HA ' ' HE ' ' A' ' 728' ' ' ARG . 19.5 m -70.47 -48.02 57.79 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.665 -179.674 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 726' ' ' LEU . . . . . 0.444 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 16.3 mt -66.35 -38.92 88.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.905 0.383 . . . . 0.0 111.548 -176.888 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 727' ' ' GLN . . . . . 0.438 ' HG2' ' O ' ' A' ' 723' ' ' GLU . 6.8 pt20 -72.58 -7.39 49.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.545 -177.629 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 728' ' ' ARG . . . . . 0.61 ' HG3' ' O ' ' A' ' 724' ' ' THR . 33.4 mtm180 -79.16 -34.63 42.98 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.112 0.482 . . . . 0.0 110.467 178.681 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -86.25 -24.52 25.98 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.658 -176.57 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 730' ' ' GLY . . . . . . . . . . . . . . . 120.36 14.9 5.22 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.525 -0.845 . . . . 0.0 111.855 -177.761 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 731' ' ' ILE . . . . . 0.444 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 9.6 mm -91.49 114.11 28.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 175.603 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 732' ' ' VAL . . . . . 0.448 HG23 ' HG2' ' A' ' 708' ' ' ARG . 0.0 OUTLIER -77.93 100.52 3.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 121.309 0.575 . . . . 0.0 110.963 -176.492 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 733' ' ' VAL . . . . . 0.483 HG23 HD22 ' A' ' 711' ' ' LEU . 1.3 p -74.31 133.12 32.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.056 176.86 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 734' ' ' THR . . . . . 0.414 ' O ' ' HA ' ' A' ' 710' ' ' TRP . 7.7 m -141.96 132.16 24.84 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.936 0.398 . . . . 0.0 110.399 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.22 124.89 20.96 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.754 176.721 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 736' ' ' TYR . . . . . 0.583 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 31.7 t80 -85.39 81.53 8.71 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.058 0.456 . . . . 0.0 110.536 -179.252 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -58.05 -45.76 86.49 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.503 174.596 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 149.33 41.83 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.547 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.944 178.089 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.19 -87.52 0.06 Allowed 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 120.396 0.141 . . . . 0.0 111.263 -176.897 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 740' ' ' GLU . . . . . 0.483 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 1.1 mt-10 -149.59 141.38 14.95 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-O 120.546 0.212 . . . . 0.0 111.23 -175.904 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 741' ' ' PRO . . . . . 0.587 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 5.3 Cg_endo -88.25 123.32 1.61 Allowed 'Trans proline' 0 N--CA 1.455 -0.744 0 C-N-CA 123.424 2.749 . . . . 0.0 112.239 175.713 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 742' ' ' THR . . . . . 0.493 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.2 OUTLIER -104.27 138.65 19.58 Favored Pre-proline 0 C--N 1.322 -0.622 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.929 179.073 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 743' ' ' PRO . . . . . 0.493 ' HD2' HG22 ' A' ' 742' ' ' THR . 37.0 Cg_endo -67.43 -7.13 18.24 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.882 2.388 . . . . 0.0 112.764 179.595 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -102.87 -8.72 20.5 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.114 0.483 . . . . 0.0 110.455 177.052 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -111.8 158.97 18.75 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.774 -171.608 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 746' ' ' VAL . . . . . 0.655 HG21 HD11 ' A' ' 795' ' ' LEU . 27.3 m -120.76 148.55 23.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.173 -176.879 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 747' ' ' LEU . . . . . 0.568 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 1.0 OUTLIER -117.64 112.24 20.24 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.036 177.766 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 748' ' ' ILE . . . . . 0.825 HG23 ' HB ' ' A' ' 763' ' ' VAL . 0.2 OUTLIER -99.37 107.15 20.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.906 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 176.151 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 12.6 t -107.39 158.33 17.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.289 0.566 . . . . 0.0 112.079 -173.77 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 750' ' ' ASP . . . . . 0.455 ' HB2' HG13 ' A' ' 713' ' ' VAL . 3.5 t70 -106.22 129.05 54.34 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.027 175.934 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 751' ' ' GLU . . . . . 0.427 ' HB2' ' NH2' ' A' ' 714' ' ' ARG . 3.8 mm-40 66.94 -175.75 0.19 Allowed 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.514 0.726 . . . . 0.0 111.988 178.337 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 752' ' ' VAL . . . . . 0.561 HG23 ' HB2' ' A' ' 769' ' ' HIS . 55.9 t -69.88 130.43 34.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.743 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -123.01 158.47 27.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.68 -178.543 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.89 -36.34 25.43 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.208 0.527 . . . . 0.0 110.185 178.533 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 755' ' ' LYS . . . . . 0.471 ' HE2' ' HE2' ' A' ' 736' ' ' TYR . 0.0 OUTLIER -113.24 110.38 20.29 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 176.937 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 756' ' ' LYS . . . . . 0.496 ' O ' ' HB2' ' A' ' 757' ' ' TRP . 0.0 OUTLIER -73.2 -57.59 3.91 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.432 -178.815 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 757' ' ' TRP . . . . . 0.667 ' HB2' ' HB ' ' A' ' 762' ' ' VAL . 2.3 t-105 164.31 162.58 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.459 -169.351 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -147.1 53.27 1.08 Allowed 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 174.057 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 759' ' ' GLY . . . . . 0.414 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -146.53 -133.98 2.54 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.884 -175.621 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.22 -57.69 5.02 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.722 0.296 . . . . 0.0 111.316 -176.531 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -162.61 145.89 11.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.032 0.444 . . . . 0.0 111.298 -178.752 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 762' ' ' VAL . . . . . 0.667 ' HB ' ' HB2' ' A' ' 757' ' ' TRP . 2.0 p -118.58 123.23 71.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.838 175.472 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 763' ' ' VAL . . . . . 0.825 ' HB ' HG23 ' A' ' 748' ' ' ILE . 48.0 t -103.74 108.99 25.82 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-O 121.058 0.456 . . . . 0.0 109.812 178.457 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 764' ' ' THR . . . . . . . . . . . . . 5.5 m -93.14 112.53 24.51 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.156 -178.554 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 765' ' ' PHE . . . . . 0.489 ' CZ ' ' HG ' ' A' ' 791' ' ' LEU . 34.0 m-85 -83.97 125.99 32.59 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 175.071 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 766' ' ' CYS . . . . . 0.412 ' HB3' HG12 ' A' ' 770' ' ' ILE . 0.0 OUTLIER -95.28 133.85 38.71 Favored 'General case' 0 C--N 1.314 -0.944 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.106 -179.453 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.76 -74.3 0.64 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.37 -0.377 . . . . 0.0 109.986 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 1.7 mmt85 -106.86 -35.38 6.96 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 175.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 769' ' ' HIS . . . . . 0.561 ' HB2' HG23 ' A' ' 752' ' ' VAL . 5.7 m80 -117.77 155.38 30.14 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.382 175.661 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 770' ' ' ILE . . . . . 0.449 ' O ' HG22 ' A' ' 752' ' ' VAL . 52.1 mt -107.8 -55.01 5.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 176.026 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . 70.7 -74.28 0.6 Allowed Glycine 0 C--N 1.33 0.231 0 CA-C-N 115.749 -0.659 . . . . 0.0 112.373 177.846 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 772' ' ' ILE . . . . . 0.417 ' HA ' ' HD3' ' A' ' 773' ' ' PRO . 14.6 mm -65.24 122.78 81.78 Favored Pre-proline 0 C--N 1.324 -0.53 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 177.419 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 773' ' ' PRO . . . . . 0.508 ' HB2' ' HG3' ' A' ' 776' ' ' LYS . 41.6 Cg_exo -56.91 -72.06 0.03 OUTLIER 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.679 2.252 . . . . 0.0 112.672 -176.107 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 774' ' ' LEU . . . . . 0.604 ' O ' ' HB3' ' A' ' 780' ' ' GLU . 1.1 pt? 169.83 -153.12 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.277 0 N-CA-C 108.65 -0.871 . . . . 0.0 108.65 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 775' ' ' GLU . . . . . 0.566 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 1.5 mp0 -59.47 69.14 0.01 OUTLIER 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.306 0.574 . . . . 0.0 111.869 170.47 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 776' ' ' LYS . . . . . 0.508 ' HG3' ' HB2' ' A' ' 773' ' ' PRO . 0.0 OUTLIER -106.28 -38.38 6.25 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.1 174.863 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -103.0 153.21 38.45 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.398 171.825 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -61.3 98.4 0.15 Allowed 'Trans proline' 0 CA--C 1.529 0.252 0 C-N-CA 122.494 2.129 . . . . 0.0 112.258 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 116.63 -1.24 20.19 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.265 179.266 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 780' ' ' GLU . . . . . 0.604 ' HB3' ' O ' ' A' ' 774' ' ' LEU . 0.9 OUTLIER -87.69 122.77 31.78 Favored 'General case' 0 C--O 1.219 -0.519 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 -179.546 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 28.2 m95 -132.82 146.78 52.12 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 177.295 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 782' ' ' VAL . . . . . 0.558 HG13 ' HA ' ' A' ' 774' ' ' LEU . 33.6 m -136.34 158.26 37.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 176.375 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 783' ' ' HIS . . . . . 0.46 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.0 OUTLIER -172.86 120.27 0.37 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.746 175.044 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.63 101.52 14.2 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 172.982 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 785' ' ' VAL . . . . . 0.675 HG13 ' H ' ' A' ' 787' ' ' ALA . 4.9 p -175.42 158.01 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.191 -176.55 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -86.85 9.66 18.48 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.038 178.748 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 787' ' ' ALA . . . . . 0.675 ' H ' HG13 ' A' ' 785' ' ' VAL . . . 58.33 71.87 0.95 Allowed Pre-proline 0 N--CA 1.468 0.427 0 CA-C-N 115.647 -0.706 . . . . 0.0 112.262 177.943 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 788' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -66.27 -61.8 0.08 OUTLIER 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.35 2.033 . . . . 0.0 111.589 178.062 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -141.25 -31.68 0.57 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.937 0.399 . . . . 0.0 111.153 176.105 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 790' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -61.8 -44.49 96.77 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.802 -0.636 . . . . 0.0 112.659 -170.322 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 791' ' ' LEU . . . . . 0.489 ' HG ' ' CZ ' ' A' ' 765' ' ' PHE . 0.6 OUTLIER -68.93 -53.47 14.47 Favored Pre-proline 0 C--N 1.326 -0.437 0 C-N-CA 120.601 -0.44 . . . . 0.0 111.67 -176.87 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 792' ' ' PRO . . . . . 0.43 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 9.6 Cg_endo -57.03 -32.47 93.23 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 121.554 1.503 . . . . 0.0 112.048 175.736 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -69.58 -40.99 76.4 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.784 0.326 . . . . 0.0 110.85 177.072 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -59.63 -44.76 93.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.152 0.501 . . . . 0.0 109.751 177.042 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 795' ' ' LEU . . . . . 0.655 HD11 HG21 ' A' ' 746' ' ' VAL . 0.7 OUTLIER -63.32 -48.56 77.53 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.904 -179.768 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -61.99 -41.61 98.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.352 -179.638 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.17 -33.92 76.52 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.88 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -69.31 -32.97 55.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.695 179.57 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -96.29 3.16 53.22 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.4 -179.053 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 1.2 mp . . . . . 0 N--CA 1.471 0.579 0 C-N-CA 123.611 0.764 . . . . 0.0 112.482 175.36 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 8.3 t70 . . . . . 0 CA--C 1.521 -0.171 0 CA-C-O 120.928 0.394 . . . . 0.0 110.806 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 825' ' ' MET . . . . . 0.517 ' HE1' HG12 ' A' ' 871' ' ' ILE . 0.0 OUTLIER -100.19 109.1 21.35 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.747 178.198 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 826' ' ' MET . . . . . 0.567 ' HG3' ' HA ' ' A' ' 869' ' ' ILE . 0.0 OUTLIER -115.37 129.17 56.51 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.113 0.482 . . . . 0.0 110.952 -176.071 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 827' ' ' ILE . . . . . . . . . . . . . 2.9 mm -118.02 127.29 75.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.58 -0.737 . . . . 0.0 109.52 179.371 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 828' ' ' LEU . . . . . 0.507 ' HB2' HG12 ' A' ' 869' ' ' ILE . 7.7 tp -104.53 130.19 52.5 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.523 0.202 . . . . 0.0 110.748 -177.672 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 829' ' ' VAL . . . . . 0.58 HG21 HD11 ' A' ' 840' ' ' LEU . 0.3 OUTLIER -112.92 121.78 65.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.98 177.452 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 830' ' ' VAL . . . . . 0.56 HG11 ' HB2' ' A' ' 860' ' ' ALA . 0.2 OUTLIER -115.74 86.85 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.112 178.552 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 831' ' ' ASP . . . . . 0.887 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 55.0 t0 -108.94 134.02 52.16 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.434 -176.598 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -73.99 -13.72 60.91 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.866 178.547 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 1.1 m80 -109.24 92.65 11.66 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.179 177.546 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 834' ' ' PRO . . . . . 0.577 ' HA ' ' HD3' ' A' ' 837' ' ' ARG . 2.5 Cg_endo -46.33 -37.66 19.36 Favored 'Trans proline' 0 CA--C 1.534 0.521 0 C-N-CA 123.733 2.955 . . . . 0.0 114.167 -175.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 1.1 pp -65.3 -42.7 94.44 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 CA-C-O 120.921 0.391 . . . . 0.0 111.74 -178.168 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 836' ' ' ASN . . . . . 0.614 ' HB3' ' OD2' ' A' ' 831' ' ' ASP . 26.9 t-20 -69.62 -43.87 71.81 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.506 -0.554 . . . . 0.0 109.506 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 837' ' ' ARG . . . . . 0.887 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 1.1 ttt-85 -55.64 -40.6 72.41 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.872 -1.058 . . . . 0.0 111.032 177.077 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 838' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 838' ' ' ARG . 0.0 OUTLIER -64.75 -39.85 94.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.586 178.768 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.48 -49.16 67.53 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.211 -177.924 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 840' ' ' LEU . . . . . 0.58 HD11 HG21 ' A' ' 829' ' ' VAL . 2.3 pp -73.95 -27.68 61.13 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.933 -0.307 . . . . 0.0 111.173 -177.138 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -66.15 -32.69 74.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.987 0.422 . . . . 0.0 110.061 174.871 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -63.62 -45.73 88.95 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.928 176.119 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 843' ' ' GLN . . . . . 0.63 ' HG2' HD23 ' A' ' 929' ' ' LEU . 3.1 mt-30 -60.25 -42.21 94.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.283 175.564 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 844' ' ' LEU . . . . . . . . . . . . . 1.2 mp -58.88 -44.61 91.18 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.004 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -63.72 -41.43 98.97 Favored Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.905 -0.588 . . . . 0.0 112.326 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 68.8 m -73.19 -13.74 61.22 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.687 0.279 . . . . 0.0 111.331 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 847' ' ' LEU . . . . . 0.565 HD21 ' HA ' ' A' ' 933' ' ' LYS . 0.1 OUTLIER -83.62 -4.93 59.0 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.872 0.368 . . . . 0.0 110.691 176.828 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 87.86 17.06 58.72 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.943 -0.646 . . . . 0.0 112.884 177.091 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 849' ' ' TYR . . . . . 0.415 ' CD2' HD23 ' A' ' 936' ' ' LEU . 30.1 m-85 -112.11 144.06 42.11 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.726 0.298 . . . . 0.0 110.475 -178.873 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -75.69 108.25 8.4 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.108 0.48 . . . . 0.0 109.726 -179.723 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -87.61 122.03 30.8 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.55 -174.942 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 852' ' ' LYS . . . . . 0.4 ' O ' HD12 ' A' ' 828' ' ' LEU . 7.0 mptt -107.73 120.58 42.63 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 174.543 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -99.77 137.79 37.76 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 120.904 0.383 . . . . 0.0 111.852 -173.42 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 854' ' ' ALA . . . . . 0.411 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -150.41 157.97 43.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.056 176.294 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -149.19 75.56 1.29 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.708 179.701 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 856' ' ' ASP . . . . . . . . . . . . . 24.4 t70 175.16 136.95 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.828 179.338 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 857' ' ' GLY . . . . . 0.45 ' HA2' HD13 ' A' ' 886' ' ' LEU . . . -65.1 -44.4 94.23 Favored Glycine 0 CA--C 1.519 0.309 0 C-N-CA 120.985 -0.626 . . . . 0.0 113.307 -179.001 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 37.7 t -73.91 -44.98 50.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.029 0.442 . . . . 0.0 110.597 -177.847 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -66.36 -19.72 65.88 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.154 -176.893 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 860' ' ' ALA . . . . . 0.56 ' HB2' HG11 ' A' ' 830' ' ' VAL . . . -61.72 -39.56 91.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.905 0.383 . . . . 0.0 110.403 174.324 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 861' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.52 -34.07 65.07 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.226 178.006 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 19.9 t30 -63.28 -41.99 99.06 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.247 176.316 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -70.92 -31.48 45.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.374 177.6 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 864' ' ' LEU . . . . . 0.691 HD21 HD11 ' A' ' 897' ' ' LEU . 0.9 OUTLIER -58.89 -36.0 73.93 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.776 176.151 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -83.58 -38.27 21.87 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.847 179.828 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.69 -52.73 63.88 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.078 0.466 . . . . 0.0 110.645 179.274 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 867' ' ' ASN . . . . . 0.552 ' HB3' ' H ' ' A' ' 868' ' ' HIS . 0.1 OUTLIER -106.19 -127.35 0.25 Allowed 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.798 -0.816 . . . . 0.0 108.798 176.292 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 868' ' ' HIS . . . . . 0.552 ' H ' ' HB3' ' A' ' 867' ' ' ASN . 0.2 OUTLIER -165.19 -56.17 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 110.07 -0.345 . . . . 0.0 110.07 174.371 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 869' ' ' ILE . . . . . 0.567 ' HA ' ' HG3' ' A' ' 826' ' ' MET . 2.4 mp 74.24 140.55 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 O-C-N 123.758 0.661 . . . . 0.0 111.562 174.73 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -87.43 -57.99 2.75 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.417 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 871' ' ' ILE . . . . . 0.517 HG12 ' HE1' ' A' ' 825' ' ' MET . 41.4 mm -111.82 126.99 69.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.323 -179.823 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 872' ' ' VAL . . . . . 0.659 ' HB ' ' HB ' ' A' ' 899' ' ' VAL . 0.1 OUTLIER -105.11 137.02 36.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.788 -178.689 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 873' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -125.0 124.76 42.68 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 173.809 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -121.89 101.79 7.78 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 120.989 0.423 . . . . 0.0 109.993 178.95 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 875' ' ' ASP . . . . . 0.67 ' HB2' ' HE2' ' A' ' 925' ' ' LYS . 0.5 OUTLIER -107.48 115.67 30.56 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 122.013 0.911 . . . . 0.0 110.907 -178.673 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 3.1 p -137.33 128.87 41.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 114.951 -1.022 . . . . 0.0 110.213 -176.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 877' ' ' ASN . . . . . 0.582 ' ND2' ' HB3' ' A' ' 904' ' ' ALA . 1.8 t30 -155.96 64.28 0.58 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.43 0.633 . . . . 0.0 110.393 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 6.8 mmt . . . . . 0 C--N 1.32 -0.699 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 176.401 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.34 0 N-CA-C 112.406 -0.278 . . . . 0.0 112.406 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 884' ' ' TYR . . . . . 0.432 ' O ' ' HB2' ' A' ' 888' ' ' GLN . 2.7 t80 -138.5 -50.91 0.56 Allowed 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 177.641 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -66.05 -46.54 77.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.64 179.43 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 886' ' ' LEU . . . . . 0.524 ' HG ' ' N ' ' A' ' 887' ' ' THR . 0.0 OUTLIER -62.97 -45.94 90.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.67 -177.974 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 887' ' ' THR . . . . . 0.524 ' N ' ' HG ' ' A' ' 886' ' ' LEU . 0.0 OUTLIER -65.39 -42.37 92.72 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.075 -179.469 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 888' ' ' GLN . . . . . 0.432 ' HB2' ' O ' ' A' ' 884' ' ' TYR . 0.3 OUTLIER -64.69 -47.3 78.87 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.889 -178.712 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 889' ' ' ARG . . . . . 0.532 ' HD3' ' OE1' ' A' ' 892' ' ' GLN . 13.1 mmt180 -66.54 -32.41 73.75 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.532 -0.303 . . . . 0.0 111.074 -177.537 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 890' ' ' ILE . . . . . 0.499 HG23 HD13 ' A' ' 895' ' ' LEU . 5.3 mt -60.55 -51.17 76.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.964 0.412 . . . . 0.0 110.718 178.616 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 891' ' ' ARG . . . . . 0.632 ' HB3' ' HA2' ' A' ' 918' ' ' GLY . 0.1 OUTLIER -74.67 -31.16 61.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.859 -178.997 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 892' ' ' GLN . . . . . 0.532 ' OE1' ' HD3' ' A' ' 889' ' ' ARG . 7.5 mt-30 -65.61 -41.99 92.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.589 179.313 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.14 -29.21 68.86 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.009 177.218 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 92.7 64.03 1.11 Allowed Glycine 0 N--CA 1.443 -0.842 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.736 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 895' ' ' LEU . . . . . 0.499 HD13 HG23 ' A' ' 890' ' ' ILE . 0.3 OUTLIER -67.26 111.09 3.79 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 178.173 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.66 0.58 56.28 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.14 -176.167 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 897' ' ' LEU . . . . . 0.691 HD11 HD21 ' A' ' 864' ' ' LEU . 0.0 OUTLIER -107.95 135.78 19.82 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.436 176.806 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -67.96 124.78 12.23 Favored 'Trans proline' 0 C--O 1.235 0.338 0 C-N-CA 122.653 2.235 . . . . 0.0 112.32 -177.936 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 899' ' ' VAL . . . . . 0.659 ' HB ' ' HB ' ' A' ' 872' ' ' VAL . 0.2 OUTLIER -113.62 131.8 64.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 121.573 0.702 . . . . 0.0 110.526 179.783 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 900' ' ' ILE . . . . . 0.679 HG23 ' HB2' ' A' ' 921' ' ' SER . 0.4 OUTLIER -101.09 117.85 46.95 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.161 178.873 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -91.68 117.06 5.13 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.809 -0.71 . . . . 0.0 111.496 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 902' ' ' VAL . . . . . 0.713 ' HB ' ' HB2' ' A' ' 923' ' ' LEU . 0.5 OUTLIER -105.66 134.4 47.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.717 0 CA-C-O 121.425 0.631 . . . . 0.0 110.699 -175.921 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -139.73 159.32 42.44 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.344 -175.741 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 904' ' ' ALA . . . . . 0.612 ' HB2' ' HB2' ' A' ' 925' ' ' LYS . . . -109.95 114.33 27.79 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 122.35 -0.219 . . . . 0.0 110.485 179.157 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 61.02 54.66 3.31 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.667 -178.807 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -104.33 93.28 4.73 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.36 177.166 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.37 125.66 21.76 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.598 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . 59.59 48.08 9.97 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.143 -178.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.22 -30.03 70.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.153 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 910' ' ' GLU . . . . . 0.49 ' HA ' ' SG ' ' A' ' 922' ' ' CYS . 0.0 OUTLIER -65.01 -43.99 90.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.014 175.646 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -63.33 -43.25 98.28 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.341 177.826 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -61.46 -42.38 98.69 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.977 179.17 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.97 -41.52 91.07 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.145 -179.662 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 69.4 m -69.5 -31.67 70.05 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.862 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.65 -46.25 89.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.94 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 916' ' ' GLU . . . . . 0.546 ' HG2' ' H ' ' A' ' 918' ' ' GLY . 0.0 OUTLIER -77.71 -32.29 52.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.557 178.615 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 917' ' ' SER . . . . . 0.488 ' N ' ' HG2' ' A' ' 916' ' ' GLU . 0.1 OUTLIER 47.03 46.82 16.06 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.383 -178.664 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 918' ' ' GLY . . . . . 0.632 ' HA2' ' HB3' ' A' ' 891' ' ' ARG . . . -122.56 -32.2 0.98 Allowed Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.605 -178.361 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 919' ' ' MET . . . . . 0.651 ' HA ' HG13 ' A' ' 899' ' ' VAL . 3.3 mtt -83.16 -86.87 0.1 Allowed 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 121.206 -0.198 . . . . 0.0 110.5 179.819 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 920' ' ' ASP . . . . . 0.555 ' HB2' ' O ' ' A' ' 919' ' ' MET . 43.8 t0 161.18 -67.72 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.616 0 O-C-N 124.183 0.927 . . . . 0.0 109.276 177.295 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 921' ' ' SER . . . . . 0.679 ' HB2' HG23 ' A' ' 900' ' ' ILE . 66.3 m -127.06 -177.87 4.21 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.502 -178.578 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 922' ' ' CYS . . . . . 0.49 ' SG ' ' HA ' ' A' ' 910' ' ' GLU . 0.5 OUTLIER -139.59 145.44 38.58 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.897 0.379 . . . . 0.0 111.094 -177.021 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 923' ' ' LEU . . . . . 0.713 ' HB2' ' HB ' ' A' ' 902' ' ' VAL . 58.4 mt -130.04 166.73 19.53 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.041 179.346 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 924' ' ' SER . . . . . 0.508 ' O ' HG23 ' A' ' 927' ' ' VAL . 0.7 OUTLIER -91.52 144.75 25.23 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.016 173.971 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 925' ' ' LYS . . . . . 0.67 ' HE2' ' HB2' ' A' ' 875' ' ' ASP . 2.7 tmtt? -58.72 -46.71 99.55 Favored Pre-proline 0 N--CA 1.467 0.38 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 926' ' ' PRO . . . . . 0.496 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 46.7 Cg_endo -69.69 55.38 1.24 Allowed 'Trans proline' 0 C--N 1.355 0.908 0 C-N-CA 122.055 1.837 . . . . 0.0 112.592 174.296 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 927' ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' ' 924' ' ' SER . 0.9 OUTLIER -67.97 129.19 32.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.789 176.786 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.57 167.89 10.86 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.824 179.841 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 929' ' ' LEU . . . . . 0.63 HD23 ' HG2' ' A' ' 843' ' ' GLN . 0.0 OUTLIER -54.9 -45.38 74.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.872 0.367 . . . . 0.0 110.764 179.201 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -64.06 -40.22 95.8 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.912 0.387 . . . . 0.0 110.721 -178.947 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 13.6 t -65.27 -49.98 75.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.802 -178.743 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 932' ' ' ILE . . . . . 0.591 ' O ' ' HB2' ' A' ' 936' ' ' LEU . 2.9 tp -66.23 -31.4 53.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.812 0.339 . . . . 0.0 110.659 -179.123 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 933' ' ' LYS . . . . . 0.565 ' HA ' HD21 ' A' ' 847' ' ' LEU . 0.3 OUTLIER -66.21 -49.17 68.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.983 178.936 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 934' ' ' GLN . . . . . 0.467 ' HG3' ' N ' ' A' ' 935' ' ' THR . 0.1 OUTLIER -75.22 -42.31 55.75 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.648 -174.375 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 935' ' ' THR . . . . . 0.467 ' N ' ' HG3' ' A' ' 934' ' ' GLN . 3.3 m -70.14 -42.2 72.89 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.531 0.197 . . . . 0.0 111.531 -175.832 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 936' ' ' LEU . . . . . 0.591 ' HB2' ' O ' ' A' ' 932' ' ' ILE . 0.7 OUTLIER -67.17 -44.54 79.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.695 0.283 . . . . 0.0 110.788 -179.985 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 80.4 m -68.17 -38.66 82.3 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.226 -178.79 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 938' ' ' LEU . . . . . 0.505 ' O ' ' HB2' ' A' ' 942' ' ' ARG . 0.0 OUTLIER -63.52 -42.18 98.46 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.907 0.384 . . . . 0.0 110.423 178.078 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 939' ' ' TYR . . . . . 0.492 ' O ' HG22 ' A' ' 943' ' ' VAL . 0.4 OUTLIER -69.28 -40.91 77.48 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.91 179.311 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -59.15 -47.83 83.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.588 -178.175 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 941' ' ' GLU . . . . . 0.441 ' HG3' ' N ' ' A' ' 942' ' ' ARG . 3.8 pt-20 -71.53 -32.96 68.74 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.759 0.314 . . . . 0.0 110.598 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 942' ' ' ARG . . . . . 0.505 ' HB2' ' O ' ' A' ' 938' ' ' LEU . 2.3 ttp180 -65.23 -48.26 73.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.315 -178.016 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 943' ' ' VAL . . . . . 0.492 HG22 ' O ' ' A' ' 939' ' ' TYR . 18.1 m -70.92 -36.67 64.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 120.962 0.411 . . . . 0.0 111.367 -178.112 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.3 -38.68 63.27 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.494 -176.83 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 8.5 pttp -70.76 -35.39 72.6 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.657 0.265 . . . . 0.0 110.669 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 19.8 m -73.03 -23.26 60.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.13 0.491 . . . . 0.0 110.423 177.287 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.22 -21.57 33.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.371 176.647 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 32.3 t0 . . . . . 0 N--CA 1.464 0.274 0 O-C-N 123.874 0.733 . . . . 0.0 110.826 179.482 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.452 -0.351 0 CA-C-O 120.808 0.337 . . . . 0.0 111.547 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 88.8 3.31 77.26 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.832 -0.699 . . . . 0.0 113.402 171.1 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.87 137.83 57.46 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 178.326 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 708' ' ' ARG . . . . . . . . . . . . . 3.8 mtt85 -103.02 156.29 17.78 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.215 0.531 . . . . 0.0 111.615 -177.354 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -138.74 128.78 25.34 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.02 -0.991 . . . . 0.0 108.741 174.167 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 710' ' ' TRP . . . . . 0.823 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 96.5 m95 -92.26 129.31 38.24 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.408 0.623 . . . . 0.0 110.468 -176.263 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 711' ' ' LEU . . . . . 0.636 HD21 ' HB2' ' A' ' 719' ' ' CYS . 0.9 OUTLIER -118.1 125.95 51.3 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.668 -172.657 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -126.15 52.7 1.67 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.311 0.577 . . . . 0.0 110.045 177.681 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 713' ' ' VAL . . . . . 0.699 ' HA ' ' HB3' ' A' ' 750' ' ' ASP . 87.5 t -111.95 120.96 63.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.917 179.434 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 714' ' ' ARG . . . . . 0.471 ' NH2' ' HB3' ' A' ' 751' ' ' GLU . 1.9 mtm180 -81.34 -19.57 42.52 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.081 0.467 . . . . 0.0 110.461 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -75.62 100.17 4.54 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.853 176.863 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 716' ' ' ALA . . . . . 0.622 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -61.68 -35.29 77.57 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.714 -173.936 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -65.07 -46.79 79.74 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.008 0.433 . . . . 0.0 110.44 177.923 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 2.3 tt -69.27 -45.17 70.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.762 -179.504 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 719' ' ' CYS . . . . . 0.636 ' HB2' HD21 ' A' ' 711' ' ' LEU . 8.3 p -66.82 -40.68 88.12 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.941 -177.325 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 720' ' ' GLN . . . . . 0.456 ' HB2' ' O ' ' A' ' 716' ' ' ALA . 0.1 OUTLIER -59.95 -41.33 91.63 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-O 120.586 0.232 . . . . 0.0 110.811 177.925 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -56.71 -52.82 63.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.899 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 722' ' ' LEU . . . . . 0.443 HD13 HG21 ' A' ' 748' ' ' ILE . 3.2 mt -67.08 -47.46 71.17 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.094 -178.44 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 723' ' ' GLU . . . . . 0.909 ' HA ' HG21 ' A' ' 733' ' ' VAL . 0.3 OUTLIER -61.42 -39.29 90.25 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.278 -174.386 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 724' ' ' THR . . . . . 0.558 ' HA ' ' CG ' ' A' ' 727' ' ' GLN . 88.3 m -73.01 -34.2 66.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.693 0.282 . . . . 0.0 111.155 -178.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 50.4 m -61.98 -36.15 80.62 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.761 0.315 . . . . 0.0 110.933 177.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 726' ' ' LEU . . . . . 0.554 HD21 HD12 ' A' ' 795' ' ' LEU . 1.1 mt -78.42 -41.36 33.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.271 -178.757 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 727' ' ' GLN . . . . . 0.558 ' CG ' ' HA ' ' A' ' 724' ' ' THR . 1.7 pt20 -74.2 -4.82 38.23 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.973 0.416 . . . . 0.0 111.111 -179.287 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.4 -22.26 65.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.171 175.102 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 729' ' ' SER . . . . . 0.51 ' HB2' ' H ' ' A' ' 730' ' ' GLY . 0.1 OUTLIER -104.38 -107.98 0.28 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.227 177.358 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 730' ' ' GLY . . . . . 0.51 ' H ' ' HB2' ' A' ' 729' ' ' SER . . . -138.93 25.55 2.79 Favored Glycine 0 CA--C 1.51 -0.239 0 N-CA-C 110.922 -0.871 . . . . 0.0 110.922 179.134 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 731' ' ' ILE . . . . . 0.44 ' O ' ' HA ' ' A' ' 727' ' ' GLN . 1.0 OUTLIER -107.47 146.68 13.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 -178.067 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 732' ' ' VAL . . . . . . . . . . . . . 2.1 p -123.36 131.57 72.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.043 0.449 . . . . 0.0 110.981 -176.693 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 733' ' ' VAL . . . . . 0.909 HG21 ' HA ' ' A' ' 723' ' ' GLU . 3.7 t -101.44 147.56 8.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 177.768 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -149.01 141.61 24.41 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.816 0.341 . . . . 0.0 111.057 -173.899 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -59.48 118.21 5.77 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.829 178.325 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 736' ' ' TYR . . . . . 0.823 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 36.5 t80 -85.31 91.01 8.06 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.189 0.519 . . . . 0.0 110.833 -179.494 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 737' ' ' GLU . . . . . 0.491 ' H ' ' HG3' ' A' ' 737' ' ' GLU . 0.0 OUTLIER -93.46 -128.66 0.12 Allowed 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.312 172.061 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 738' ' ' GLY . . . . . 0.482 ' H ' ' HB2' ' A' ' 737' ' ' GLU . . . -80.93 59.33 4.75 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.615 -0.803 . . . . 0.0 112.398 178.155 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 739' ' ' GLN . . . . . 0.495 ' HG2' ' CH2' ' A' ' 710' ' ' TRP . 0.9 OUTLIER -107.37 176.24 5.22 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 -179.049 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 740' ' ' GLU . . . . . 0.441 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 1.1 mt-10 -87.0 141.02 32.91 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.788 -177.918 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 741' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 740' ' ' GLU . 5.4 Cg_endo -87.69 121.39 1.55 Allowed 'Trans proline' 0 N--CA 1.453 -0.888 0 C-N-CA 123.023 2.482 . . . . 0.0 111.585 175.031 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 742' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.16 136.24 20.5 Favored Pre-proline 0 C--N 1.32 -0.708 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.444 -174.754 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 743' ' ' PRO . . . . . 0.752 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 31.8 Cg_endo -65.89 -9.62 23.79 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 123.045 2.497 . . . . 0.0 112.644 177.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -101.84 -1.1 32.97 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.657 175.564 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 37.2 m-20 -110.79 150.85 28.52 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.894 0.378 . . . . 0.0 110.911 -174.858 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 2.4 p -117.23 136.75 53.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.449 -178.057 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 747' ' ' LEU . . . . . 0.408 HD23 ' O ' ' A' ' 710' ' ' TRP . 0.4 OUTLIER -100.45 136.8 39.76 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.015 -0.538 . . . . 0.0 109.984 177.707 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 748' ' ' ILE . . . . . 0.443 HG21 HD13 ' A' ' 722' ' ' LEU . 18.0 mt -120.12 107.69 21.52 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 171.22 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.05 164.79 11.69 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.813 -0.631 . . . . 0.0 112.159 -170.536 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 750' ' ' ASP . . . . . 0.699 ' HB3' ' HA ' ' A' ' 713' ' ' VAL . 0.0 OUTLIER -129.01 129.34 45.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.936 173.751 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 751' ' ' GLU . . . . . 0.968 ' HG2' ' H ' ' A' ' 752' ' ' VAL . 20.7 tt0 65.3 -178.44 0.18 Allowed 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.682 0.753 . . . . 0.0 111.697 -179.741 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 752' ' ' VAL . . . . . 0.968 ' H ' ' HG2' ' A' ' 751' ' ' GLU . 4.5 p -61.66 132.55 27.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 114.917 -1.038 . . . . 0.0 111.294 178.176 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 8.1 p -129.69 153.77 39.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.168 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -96.54 40.95 1.12 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.758 0.313 . . . . 0.0 111.559 -177.825 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.08 154.29 40.02 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 177.722 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 756' ' ' LYS . . . . . 0.429 ' O ' ' HB3' ' A' ' 757' ' ' TRP . 3.7 tptp -102.24 -37.6 8.03 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 121.316 -0.154 . . . . 0.0 111.271 -177.182 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 757' ' ' TRP . . . . . 0.525 ' CD1' ' HB ' ' A' ' 762' ' ' VAL . 63.5 t-105 72.1 105.34 0.07 Allowed 'General case' 0 N--CA 1.468 0.432 0 O-C-N 123.88 0.737 . . . . 0.0 111.312 179.273 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -100.27 84.4 2.81 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.061 177.177 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 759' ' ' GLY . . . . . 0.752 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -144.71 -149.08 4.97 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.574 -0.822 . . . . 0.0 113.134 -177.534 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.97 -53.74 45.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.238 0.542 . . . . 0.0 109.872 -179.566 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -164.04 156.3 17.1 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.068 178.204 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 762' ' ' VAL . . . . . 0.525 ' HB ' ' CD1' ' A' ' 757' ' ' TRP . 2.4 p -134.39 113.71 17.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 175.841 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -111.67 105.87 19.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.22 -177.65 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 764' ' ' THR . . . . . 0.783 ' HB ' HG12 ' A' ' 782' ' ' VAL . 68.1 m -99.23 120.48 39.61 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.546 -177.218 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 765' ' ' PHE . . . . . 0.527 ' CE1' HG23 ' A' ' 785' ' ' VAL . 8.8 m-85 -76.64 130.34 37.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.138 175.424 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 766' ' ' CYS . . . . . 0.545 ' O ' ' HA ' ' A' ' 784' ' ' SER . 3.2 m -105.25 131.45 52.69 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-O 120.968 0.413 . . . . 0.0 109.964 176.201 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.6 22.54 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 178.687 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 768' ' ' ARG . . . . . 0.436 ' HB3' ' H ' ' A' ' 769' ' ' HIS . 0.0 OUTLIER -157.66 -104.24 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.8 -1.091 . . . . 0.0 108.424 -177.088 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 769' ' ' HIS . . . . . 0.436 ' H ' ' HB3' ' A' ' 768' ' ' ARG . 0.2 OUTLIER -111.13 147.77 34.15 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 109.921 -0.399 . . . . 0.0 109.921 171.409 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 4.6 mt -106.81 154.05 7.86 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.802 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.867 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 771' ' ' GLY . . . . . 0.72 ' HA3' HG23 ' A' ' 752' ' ' VAL . . . -151.09 -39.65 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.871 -0.68 . . . . 0.0 111.765 -179.451 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 772' ' ' ILE . . . . . 0.443 ' HA ' ' HD3' ' A' ' 773' ' ' PRO . 32.9 mm -88.42 131.26 42.76 Favored Pre-proline 0 C--N 1.324 -0.503 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 176.608 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 773' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 772' ' ' ILE . 12.1 Cg_exo -70.64 172.98 12.45 Favored 'Trans proline' 0 N--CA 1.463 -0.316 0 C-N-CA 122.759 2.306 . . . . 0.0 111.936 178.43 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 774' ' ' LEU . . . . . 0.554 ' HB3' HG22 ' A' ' 782' ' ' VAL . 0.7 OUTLIER -90.16 -152.57 0.26 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.734 -179.045 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 775' ' ' GLU . . . . . 0.534 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 1.2 mp0 -62.21 72.42 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.61 -21.47 30.33 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 168.177 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 777' ' ' ALA . . . . . 0.46 ' HB3' ' HG3' ' A' ' 780' ' ' GLU . . . -143.1 155.35 62.02 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 114.321 -1.309 . . . . 0.0 109.102 179.623 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -65.22 78.08 0.23 Allowed 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.891 2.394 . . . . 0.0 111.731 175.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 163.59 -28.31 0.23 Allowed Glycine 0 N--CA 1.447 -0.604 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.54 -178.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 780' ' ' GLU . . . . . 0.534 ' O ' ' HG3' ' A' ' 775' ' ' GLU . 3.5 mt-10 -89.04 121.95 31.89 Favored 'General case' 0 C--O 1.222 -0.39 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 179.385 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 34.4 m95 -139.38 139.0 37.06 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.929 0.395 . . . . 0.0 110.647 -178.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 782' ' ' VAL . . . . . 0.783 HG12 ' HB ' ' A' ' 764' ' ' THR . 28.5 m -138.37 153.52 26.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 169.334 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 783' ' ' HIS . . . . . . . . . . . . . 4.9 t-160 -155.88 120.7 4.71 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.765 0.317 . . . . 0.0 110.454 176.746 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 784' ' ' SER . . . . . 0.545 ' HA ' ' O ' ' A' ' 766' ' ' CYS . 0.4 OUTLIER -84.73 100.86 11.77 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.059 178.268 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 785' ' ' VAL . . . . . 0.527 HG23 ' CE1' ' A' ' 765' ' ' PHE . 0.0 OUTLIER -162.01 -178.51 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.53 178.548 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -113.8 31.87 6.23 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.79 0.329 . . . . 0.0 110.572 178.065 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 59.46 73.19 0.7 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.009 178.906 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 788' ' ' PRO . . . . . 0.676 ' HD2' ' OE1' ' A' ' 790' ' ' GLU . 12.0 Cg_exo -71.8 -67.91 0.02 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.711 2.274 . . . . 0.0 110.947 173.825 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 1.4 p-80 176.45 28.48 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 122.784 0.434 . . . . 0.0 110.816 175.246 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 790' ' ' GLU . . . . . 0.676 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -101.25 -43.83 5.85 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.02 0.438 . . . . 0.0 110.265 -177.923 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 791' ' ' LEU . . . . . 0.486 HD22 ' CE2' ' A' ' 765' ' ' PHE . 0.2 OUTLIER -66.66 -47.47 56.21 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 115.822 -0.627 . . . . 0.0 111.788 179.07 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 792' ' ' PRO . . . . . 0.437 ' HG3' HD23 ' A' ' 722' ' ' LEU . 39.8 Cg_exo -57.25 -33.65 96.4 Favored 'Trans proline' 0 C--N 1.359 1.102 0 C-N-CA 121.701 1.6 . . . . 0.0 111.58 175.775 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -68.61 -41.76 79.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.584 177.699 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.57 -28.43 65.96 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.878 178.431 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 795' ' ' LEU . . . . . 0.554 HD12 HD21 ' A' ' 726' ' ' LEU . 0.2 OUTLIER -63.88 -40.5 96.69 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.959 -0.386 . . . . 0.0 109.959 177.521 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -68.71 -34.61 75.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.025 0.44 . . . . 0.0 110.764 176.707 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.9 -49.05 64.15 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.666 179.681 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -66.09 -31.17 52.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.595 177.856 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -62.16 -34.4 76.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.024 177.789 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 4.6 mt . . . . . 0 C--O 1.234 0.255 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.409 -178.253 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 2.0 t0 . . . . . 0 N--CA 1.454 -0.274 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 2.6 mtt -76.41 120.45 21.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.237 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 826' ' ' MET . . . . . . . . . . . . . 37.0 ttm -94.02 121.36 35.42 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.288 0.566 . . . . 0.0 111.579 -177.373 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 827' ' ' ILE . . . . . 0.613 HG21 HD11 ' A' ' 936' ' ' LEU . 13.6 mm -112.91 130.74 66.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 114.966 -1.015 . . . . 0.0 109.087 175.292 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 828' ' ' LEU . . . . . 0.637 ' HB3' HG22 ' A' ' 872' ' ' VAL . 34.6 tp -95.21 114.41 26.2 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.196 0.522 . . . . 0.0 110.024 -179.717 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 829' ' ' VAL . . . . . 0.882 ' HB ' ' HD2' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -103.09 107.31 21.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.033 -178.94 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 830' ' ' VAL . . . . . 0.656 HG22 ' HB3' ' A' ' 854' ' ' ALA . 8.9 t -109.2 130.85 61.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.197 179.59 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 831' ' ' ASP . . . . . 0.757 ' HB2' ' NE ' ' A' ' 837' ' ' ARG . 8.6 t0 -135.97 146.01 46.79 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 175.036 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.49 -17.9 62.32 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.234 0.54 . . . . 0.0 109.802 173.974 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 7.6 m80 -108.25 103.43 50.51 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.393 175.247 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_exo -57.34 -48.85 15.73 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 123.123 2.548 . . . . 0.0 113.984 -173.282 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 835' ' ' ILE . . . . . 0.428 HD13 ' HA ' ' A' ' 835' ' ' ILE . 0.3 OUTLIER -63.94 -35.62 74.0 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-O 120.957 0.408 . . . . 0.0 110.185 -178.164 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 836' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -62.46 -49.02 77.09 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.62 177.474 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 837' ' ' ARG . . . . . 0.882 ' HD2' ' HB ' ' A' ' 829' ' ' VAL . 0.0 OUTLIER -60.27 -47.0 87.87 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.633 -178.915 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 838' ' ' ARG . . . . . 0.41 ' HG2' HD13 ' A' ' 835' ' ' ILE . 0.0 OUTLIER -63.79 -31.11 72.18 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 123.112 0.258 . . . . 0.0 111.144 -176.256 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.82 -47.43 21.48 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.388 -176.19 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 840' ' ' LEU . . . . . . . . . . . . . 2.6 pp -73.36 -26.1 60.87 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.537 178.612 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -67.61 -29.7 69.1 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 173.789 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -64.57 -43.34 94.2 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 174.345 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 843' ' ' GLN . . . . . 0.407 ' HB3' ' CD2' ' A' ' 929' ' ' LEU . 8.1 mm-40 -61.24 -41.23 96.53 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.413 175.315 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 844' ' ' LEU . . . . . 0.501 HD11 HD12 ' A' ' 932' ' ' ILE . 0.1 OUTLIER -58.88 -35.14 72.52 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.373 175.397 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -71.27 -35.22 63.83 Favored Glycine 0 N--CA 1.449 -0.468 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.053 177.072 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.62 -16.73 63.44 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 120.958 0.408 . . . . 0.0 110.431 176.715 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 24.3 mt -80.19 -12.42 59.64 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.588 176.03 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 92.4 19.8 37.28 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 121.018 -0.61 . . . . 0.0 112.784 178.563 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 31.1 m-85 -110.82 163.28 13.95 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.632 0.253 . . . . 0.0 110.611 -179.022 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.81 108.06 20.66 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.255 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -98.77 135.74 39.81 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.669 -178.08 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.71 128.06 55.6 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 173.537 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.66 131.86 40.0 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.291 0.567 . . . . 0.0 112.19 -173.237 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 854' ' ' ALA . . . . . 0.656 ' HB3' HG22 ' A' ' 830' ' ' VAL . . . -140.01 156.95 46.38 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.631 175.379 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 855' ' ' ASN . . . . . 0.579 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 17.0 p-10 -146.04 71.77 1.27 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.229 0.537 . . . . 0.0 111.667 -179.149 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 856' ' ' ASP . . . . . 0.579 ' HB2' ' O ' ' A' ' 855' ' ' ASN . 3.9 t70 162.96 174.52 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.209 1.004 . . . . 0.0 108.769 175.191 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 857' ' ' GLY . . . . . 0.401 ' HA3' ' HB2' ' A' ' 886' ' ' LEU . . . -83.93 -39.19 9.58 Favored Glycine 0 N--CA 1.446 -0.684 0 N-CA-C 110.878 -0.889 . . . . 0.0 110.878 175.787 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 858' ' ' VAL . . . . . 0.433 ' O ' ' HB2' ' A' ' 862' ' ' ASN . 6.7 m -73.41 -31.56 33.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.811 0.338 . . . . 0.0 110.297 177.488 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 859' ' ' ASP . . . . . 0.404 ' H ' ' HB3' ' A' ' 856' ' ' ASP . 25.5 t0 -65.59 -48.72 71.37 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.521 178.358 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -62.66 -42.42 99.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.411 -179.233 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 861' ' ' LEU . . . . . 0.578 HD21 ' HG ' ' A' ' 893' ' ' LEU . 56.3 tp -69.26 -38.19 78.29 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.877 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 862' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' A' ' 858' ' ' VAL . 33.7 t30 -57.83 -54.93 41.35 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.9 -179.29 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 8.1 p -63.09 -31.49 52.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.646 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 864' ' ' LEU . . . . . 0.522 HD11 HD21 ' A' ' 897' ' ' LEU . 0.6 OUTLIER -64.39 -36.69 84.96 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.02 178.673 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -76.3 -24.73 54.38 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.263 0.554 . . . . 0.0 110.255 179.627 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.44 -53.21 8.44 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.015 179.413 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -135.31 144.57 46.81 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.207 -175.786 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 2.0 p80 -70.4 138.24 51.13 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.184 0.516 . . . . 0.0 111.792 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 869' ' ' ILE . . . . . 0.623 HG21 ' HB2' ' A' ' 828' ' ' LEU . 5.6 mt -131.69 139.42 50.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 175.514 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -77.06 -59.39 2.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.863 0.363 . . . . 0.0 111.197 -173.936 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 871' ' ' ILE . . . . . 0.434 HG22 HG23 ' A' ' 827' ' ' ILE . 1.1 mp -117.95 130.46 72.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 CA-C-O 120.908 0.385 . . . . 0.0 110.141 -179.442 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 872' ' ' VAL . . . . . 0.637 HG22 ' HB3' ' A' ' 828' ' ' LEU . 53.8 t -123.42 125.11 71.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.21 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 873' ' ' LEU . . . . . 0.667 HD11 HG12 ' A' ' 829' ' ' VAL . 0.1 OUTLIER -118.74 131.63 56.13 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.9 0.381 . . . . 0.0 110.268 178.391 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -109.8 101.2 10.09 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.699 -178.125 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 875' ' ' ASP . . . . . 0.522 ' HB3' ' HE2' ' A' ' 925' ' ' LYS . 0.3 OUTLIER -90.48 118.15 29.73 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.466 -179.368 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -131.58 117.04 33.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-O 120.883 0.373 . . . . 0.0 111.229 179.13 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -62.61 -61.03 2.71 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 172.902 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.319 -0.749 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 168.202 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 0.204 0 CA-C-O 120.126 -0.264 . . . . 0.0 113.717 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -59.27 -28.89 67.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.5 0.667 . . . . 0.0 109.562 176.68 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 885' ' ' ARG . . . . . 0.478 ' HD2' ' N ' ' A' ' 886' ' ' LEU . 0.0 OUTLIER -61.02 -31.68 71.3 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.144 -0.934 . . . . 0.0 110.728 -179.275 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 886' ' ' LEU . . . . . 0.478 ' N ' ' HD2' ' A' ' 885' ' ' ARG . 0.0 OUTLIER -67.7 -47.63 68.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.748 0.308 . . . . 0.0 110.299 -178.768 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 887' ' ' THR . . . . . 0.427 ' N ' ' HG ' ' A' ' 886' ' ' LEU . 0.0 OUTLIER -69.53 -38.46 77.52 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.311 0.577 . . . . 0.0 110.655 -178.704 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -62.83 -51.29 67.6 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.745 177.749 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 889' ' ' ARG . . . . . 0.465 ' HB2' ' O ' ' A' ' 885' ' ' ARG . 0.0 OUTLIER -62.48 -42.78 99.72 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.988 -174.432 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 890' ' ' ILE . . . . . . . . . . . . . 1.4 tt -67.96 -41.27 84.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 120.857 -0.337 . . . . 0.0 111.411 -176.298 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 891' ' ' ARG . . . . . 0.649 ' HA ' HD23 ' A' ' 895' ' ' LEU . 0.1 OUTLIER -75.31 -27.03 59.14 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.675 0.274 . . . . 0.0 111.26 179.717 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 30.4 tp60 -77.63 -37.16 50.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.046 -179.133 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 893' ' ' LEU . . . . . 0.578 ' HG ' HD21 ' A' ' 861' ' ' LEU . 0.5 OUTLIER -73.97 -32.35 63.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.751 179.764 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 121.91 83.11 0.67 Allowed Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.877 176.133 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 895' ' ' LEU . . . . . 0.649 HD23 ' HA ' ' A' ' 891' ' ' ARG . 0.2 OUTLIER -89.09 135.99 33.26 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 110.236 -0.283 . . . . 0.0 110.236 178.035 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -131.48 26.5 4.76 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.919 0.39 . . . . 0.0 111.532 -177.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 897' ' ' LEU . . . . . 0.522 HD21 HD11 ' A' ' 864' ' ' LEU . 0.0 OUTLIER -145.56 154.65 52.8 Favored Pre-proline 0 C--N 1.323 -0.56 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.311 -175.784 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -63.67 110.6 1.3 Allowed 'Trans proline' 0 C--O 1.236 0.41 0 C-N-CA 122.72 2.28 . . . . 0.0 112.16 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 899' ' ' VAL . . . . . . . . . . . . . 26.7 t -100.95 112.94 35.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.44 0.638 . . . . 0.0 110.643 177.783 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 900' ' ' ILE . . . . . 0.674 HG23 ' HB2' ' A' ' 921' ' ' SER . 2.0 mt -90.45 106.63 17.55 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.812 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.303 179.512 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 901' ' ' GLY . . . . . 0.583 ' O ' ' HA ' ' A' ' 922' ' ' CYS . . . -85.91 119.09 5.01 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 120.755 -0.736 . . . . 0.0 111.511 178.679 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 902' ' ' VAL . . . . . 0.667 ' HB ' HD12 ' A' ' 923' ' ' LEU . 0.1 OUTLIER -124.12 119.5 56.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-O 121.084 0.468 . . . . 0.0 110.251 -178.203 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 903' ' ' THR . . . . . 0.445 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.0 OUTLIER -120.02 160.05 23.56 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.981 -176.193 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 904' ' ' ALA . . . . . 0.601 ' HA ' ' HB2' ' A' ' 925' ' ' LYS . . . -72.48 139.41 47.63 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 173.13 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -64.68 105.36 0.97 Allowed 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.091 0.472 . . . . 0.0 110.451 -177.695 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -117.99 -42.93 2.78 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.509 -0.769 . . . . 0.0 111.195 -174.705 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -158.76 -73.97 0.08 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.363 -176.136 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -161.58 55.22 0.27 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.308 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 909' ' ' GLU . . . . . 0.439 ' HG3' ' H ' ' A' ' 909' ' ' GLU . 0.0 OUTLIER -65.88 -29.84 70.34 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.456 -177.232 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 910' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.67 -37.49 76.13 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.537 174.924 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -67.77 -41.57 83.06 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.303 178.261 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -62.28 -37.14 84.35 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.405 177.414 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 913' ' ' ARG . . . . . 0.406 HH11 ' HD3' ' A' ' 913' ' ' ARG . 0.0 OUTLIER -66.17 -37.37 85.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.508 177.288 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 76.9 m -65.97 -33.54 76.05 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.321 176.804 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.97 -39.69 75.82 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.637 176.451 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -66.22 -52.02 51.93 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.138 -178.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 46.6 48.18 14.34 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -133.0 -33.41 0.37 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.937 176.929 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 919' ' ' MET . . . . . 0.537 ' O ' ' HB2' ' A' ' 920' ' ' ASP . 12.8 mtt -65.76 -80.96 0.03 OUTLIER 'General case' 0 C--O 1.236 0.394 0 CA-C-O 120.654 0.264 . . . . 0.0 111.386 179.254 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 920' ' ' ASP . . . . . 0.537 ' HB2' ' O ' ' A' ' 919' ' ' MET . 12.4 t70 168.54 -85.53 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.788 177.067 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 921' ' ' SER . . . . . 0.674 ' HB2' HG23 ' A' ' 900' ' ' ILE . 0.0 OUTLIER -109.33 175.79 5.32 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.151 -173.562 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 922' ' ' CYS . . . . . 0.583 ' HA ' ' O ' ' A' ' 901' ' ' GLY . 0.0 OUTLIER -146.43 137.54 24.34 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 120.753 0.311 . . . . 0.0 111.501 -179.925 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 923' ' ' LEU . . . . . 0.667 HD12 ' HB ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -143.0 -175.81 4.66 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.846 175.387 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 924' ' ' SER . . . . . 0.609 ' HB3' ' HD2' ' A' ' 926' ' ' PRO . 0.5 OUTLIER -114.35 150.53 34.43 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.744 0.307 . . . . 0.0 110.776 -179.644 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 925' ' ' LYS . . . . . 0.601 ' HB2' ' HA ' ' A' ' 904' ' ' ALA . 0.0 OUTLIER -50.56 -40.29 59.5 Favored Pre-proline 0 CA--C 1.54 0.579 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 -175.515 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 926' ' ' PRO . . . . . 0.609 ' HD2' ' HB3' ' A' ' 924' ' ' SER . 40.8 Cg_exo -61.08 72.33 0.08 OUTLIER 'Trans proline' 0 C--N 1.361 1.187 0 C-N-CA 121.892 1.728 . . . . 0.0 113.286 174.503 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 927' ' ' VAL . . . . . 0.686 HG13 HG12 ' A' ' 931' ' ' VAL . 3.8 t -107.44 124.75 63.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.92 177.08 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 928' ' ' THR . . . . . 0.546 ' OG1' ' HB ' ' A' ' 931' ' ' VAL . 3.0 p -88.89 171.0 10.23 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.162 -179.345 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 929' ' ' LEU . . . . . 0.48 ' O ' HD22 ' A' ' 929' ' ' LEU . 1.3 tm? -63.47 -46.33 86.68 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.864 0.364 . . . . 0.0 110.087 176.91 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -63.76 -42.15 97.86 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.832 0.348 . . . . 0.0 110.858 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 931' ' ' VAL . . . . . 0.686 HG12 HG13 ' A' ' 927' ' ' VAL . 0.8 OUTLIER -68.37 -32.41 55.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.656 179.618 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 932' ' ' ILE . . . . . 0.638 ' O ' ' HB2' ' A' ' 936' ' ' LEU . 0.4 OUTLIER -64.68 -40.06 87.77 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.255 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 175.565 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 5.2 ttmt -66.17 -45.95 79.09 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.545 178.976 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -61.5 -53.81 51.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.24 -179.511 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 3.6 m -65.07 -39.35 93.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.189 -177.549 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 936' ' ' LEU . . . . . 0.638 ' HB2' ' O ' ' A' ' 932' ' ' ILE . 4.9 tp -60.85 -48.15 83.14 Favored 'General case' 0 C--O 1.223 -0.308 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.316 177.368 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 93.2 m -62.93 -41.58 99.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.169 -179.279 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.66 -46.89 87.67 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.105 0.478 . . . . 0.0 111.456 -179.362 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -78.51 -32.84 48.31 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.218 -177.443 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 940' ' ' ALA . . . . . 0.491 ' O ' ' HB2' ' A' ' 944' ' ' ARG . . . -66.94 -41.41 87.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.945 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 941' ' ' GLU . . . . . 0.569 ' HG3' ' N ' ' A' ' 942' ' ' ARG . 0.2 OUTLIER -66.94 -35.78 80.74 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.84 -0.429 . . . . 0.0 109.84 176.795 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 942' ' ' ARG . . . . . 0.569 ' N ' ' HG3' ' A' ' 941' ' ' GLU . 0.0 OUTLIER -60.23 -48.43 81.78 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.855 -179.764 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 13.7 m -76.11 -30.21 20.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.021 -179.213 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 944' ' ' ARG . . . . . 0.491 ' HB2' ' O ' ' A' ' 940' ' ' ALA . 0.0 OUTLIER -65.47 -41.26 93.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.178 179.67 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 945' ' ' LYS . . . . . 0.475 ' HG2' ' O ' ' A' ' 942' ' ' ARG . 4.4 pttt -71.9 -31.31 66.27 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.706 179.615 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 15.0 m -68.96 -35.51 76.84 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 120.879 0.371 . . . . 0.0 110.952 174.688 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 3.1 ttm180 -77.52 -19.89 55.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.531 178.675 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 15.3 t0 . . . . . 0 C--N 1.33 -0.244 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.129 177.847 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 705' ' ' SER . . . . . 0.411 ' HA ' ' O ' ' A' ' 730' ' ' GLY . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.267 0 CA-C-O 121.216 0.531 . . . . 0.0 110.854 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . -157.31 -0.66 0.1 OUTLIER Glycine 0 N--CA 1.445 -0.702 0 C-N-CA 120.295 -0.955 . . . . 0.0 113.428 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 707' ' ' LYS . . . . . 0.486 ' HG2' ' N ' ' A' ' 708' ' ' ARG . 0.0 OUTLIER -131.88 154.75 48.89 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 117.487 0.644 . . . . 0.0 110.039 179.699 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 708' ' ' ARG . . . . . 0.486 ' N ' ' HG2' ' A' ' 707' ' ' LYS . 0.0 OUTLIER -108.92 154.87 21.54 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.687 -175.18 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 709' ' ' CYS . . . . . 0.434 ' O ' ' HA ' ' A' ' 733' ' ' VAL . 74.6 m -142.73 143.93 32.45 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.773 175.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 710' ' ' TRP . . . . . 0.552 ' CZ3' ' HG3' ' A' ' 739' ' ' GLN . 86.0 m95 -111.36 143.79 41.6 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 120.939 0.4 . . . . 0.0 110.577 -179.868 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 711' ' ' LEU . . . . . 0.441 ' CD1' ' HB2' ' A' ' 719' ' ' CYS . 0.3 OUTLIER -133.51 132.86 41.47 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.46 0.648 . . . . 0.0 110.806 179.178 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -127.24 60.22 1.4 Allowed 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.326 176.394 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 713' ' ' VAL . . . . . 0.747 HG13 ' HB3' ' A' ' 750' ' ' ASP . 28.8 t -108.47 120.8 60.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.745 179.588 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 4.0 mtm180 -79.7 -27.47 40.72 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.06 -177.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -72.43 111.8 7.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.907 175.384 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 716' ' ' ALA . . . . . 0.547 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -66.42 -35.37 80.13 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.55 -174.197 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.78 -45.1 87.74 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.063 0.459 . . . . 0.0 110.631 178.857 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 718' ' ' LEU . . . . . 0.648 HD11 ' HA ' ' A' ' 786' ' ' ALA . 0.3 OUTLIER -71.03 -45.1 64.51 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.868 179.805 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 719' ' ' CYS . . . . . 0.547 ' SG ' ' HA ' ' A' ' 716' ' ' ALA . 2.4 p -65.5 -43.61 89.6 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.821 -177.011 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 720' ' ' GLN . . . . . 0.632 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 19.0 tp60 -63.3 -39.74 95.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.942 -179.589 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -55.91 -54.85 39.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.895 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 6.7 mt -68.17 -48.35 65.53 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.19 -178.28 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 723' ' ' GLU . . . . . 0.638 ' HB2' HG11 ' A' ' 733' ' ' VAL . 0.2 OUTLIER -64.07 -38.13 89.96 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.675 -173.439 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 724' ' ' THR . . . . . 0.566 ' N ' ' HG3' ' A' ' 723' ' ' GLU . 4.1 m -71.77 -40.27 69.38 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 120.601 0.239 . . . . 0.0 110.728 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 20.1 m -62.06 -38.57 89.27 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.465 178.261 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 726' ' ' LEU . . . . . 0.425 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 49.5 mt -67.55 -48.95 65.47 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.454 177.615 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -59.65 -27.28 66.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.233 -179.298 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 728' ' ' ARG . . . . . 0.406 HH11 ' HD3' ' A' ' 728' ' ' ARG . 0.1 OUTLIER -64.42 -24.57 67.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.542 -179.321 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 72.1 m -103.19 7.09 38.63 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.946 0.403 . . . . 0.0 111.23 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 730' ' ' GLY . . . . . 0.411 ' O ' ' HA ' ' A' ' 705' ' ' SER . . . 92.26 1.46 69.37 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.774 177.913 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 731' ' ' ILE . . . . . 0.425 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 11.9 mm -66.91 127.21 28.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 120.647 0.261 . . . . 0.0 110.33 177.856 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 732' ' ' VAL . . . . . 0.484 ' O ' ' HG2' ' A' ' 708' ' ' ARG . 0.7 OUTLIER -88.73 104.59 14.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.461 0.648 . . . . 0.0 109.856 179.888 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 733' ' ' VAL . . . . . 0.638 HG11 ' HB2' ' A' ' 723' ' ' GLU . 1.6 p -99.53 141.7 16.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.385 -179.714 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 734' ' ' THR . . . . . 0.447 ' HB ' ' CZ3' ' A' ' 710' ' ' TRP . 0.2 OUTLIER -136.93 138.49 40.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.493 178.974 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.6 136.18 52.63 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.418 176.137 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -78.49 79.98 4.9 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.224 -176.917 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -70.18 -79.36 0.06 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.768 177.263 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -151.77 61.0 0.4 Allowed Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 121.149 -0.548 . . . . 0.0 111.828 179.216 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 739' ' ' GLN . . . . . 0.552 ' HG3' ' CZ3' ' A' ' 710' ' ' TRP . 1.1 mm-40 -114.45 176.24 5.13 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.824 0.345 . . . . 0.0 110.557 -177.413 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 740' ' ' GLU . . . . . 0.449 ' HG3' ' HD2' ' A' ' 741' ' ' PRO . 0.8 OUTLIER -93.42 141.13 23.52 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.866 -179.683 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 741' ' ' PRO . . . . . 0.567 ' HA ' ' CZ3' ' A' ' 757' ' ' TRP . 15.7 Cg_endo -58.45 132.38 48.2 Favored 'Trans proline' 0 C--O 1.234 0.291 0 C-N-CA 123.014 2.476 . . . . 0.0 112.219 176.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 742' ' ' THR . . . . . 0.537 ' HB ' ' HB2' ' A' ' 745' ' ' ASP . 0.2 OUTLIER -105.92 131.8 21.43 Favored Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.611 179.631 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -66.12 -17.99 55.72 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 123.363 2.709 . . . . 0.0 113.391 -175.782 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -105.41 4.15 30.42 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.691 0.281 . . . . 0.0 110.531 178.676 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 745' ' ' ASP . . . . . 0.537 ' HB2' ' HB ' ' A' ' 742' ' ' THR . 14.0 m-20 -115.37 156.86 24.77 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.158 -174.829 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 29.4 m -119.97 148.11 23.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.922 -177.741 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 747' ' ' LEU . . . . . 0.556 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 0.0 OUTLIER -112.76 118.48 35.09 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.627 -0.261 . . . . 0.0 110.367 178.062 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 4.3 mt -104.47 107.24 21.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 173.468 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 1.5 t -117.42 163.8 15.83 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.59 0.233 . . . . 0.0 110.851 -175.858 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 750' ' ' ASP . . . . . 0.747 ' HB3' HG13 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -121.02 130.21 53.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.172 0.51 . . . . 0.0 110.902 -179.797 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 67.06 177.93 0.23 Allowed 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 114.656 -1.156 . . . . 0.0 111.297 -175.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 752' ' ' VAL . . . . . 0.607 HG22 HG12 ' A' ' 772' ' ' ILE . 69.9 t -80.68 91.82 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.411 0.624 . . . . 0.0 110.939 -176.96 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 2.0 t -86.9 -6.62 10.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.421 176.081 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 3.6 m 59.26 39.81 22.15 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.635 179.172 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.83 133.91 44.6 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.257 -0.428 . . . . 0.0 109.988 176.782 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 756' ' ' LYS . . . . . 0.498 ' HA ' ' HD2' ' A' ' 756' ' ' LYS . 4.9 mmmt -100.8 81.4 2.28 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.138 0.494 . . . . 0.0 110.326 -179.682 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 757' ' ' TRP . . . . . 0.567 ' CZ3' ' HA ' ' A' ' 741' ' ' PRO . 65.7 t-105 -75.96 95.5 3.58 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.378 178.628 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -94.6 59.83 2.51 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.336 0.588 . . . . 0.0 110.025 175.952 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 759' ' ' GLY . . . . . . . . . . . . . . . -108.07 -127.01 5.55 Favored Glycine 0 N--CA 1.446 -0.647 0 N-CA-C 111.187 -0.765 . . . . 0.0 111.187 176.94 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 32.0 ttt85 -77.47 -58.83 3.06 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.15 0.5 . . . . 0.0 109.83 175.654 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -156.64 152.95 27.78 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.525 -0.762 . . . . 0.0 109.749 179.141 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 762' ' ' VAL . . . . . 0.466 ' HB ' ' HB3' ' A' ' 757' ' ' TRP . 2.1 p -131.82 123.41 51.6 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-O 121.171 0.51 . . . . 0.0 110.421 178.359 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 763' ' ' VAL . . . . . 0.571 HG11 HD11 ' A' ' 791' ' ' LEU . 84.3 t -105.92 115.15 47.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.091 178.709 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 764' ' ' THR . . . . . 0.455 ' O ' ' HA ' ' A' ' 782' ' ' VAL . 9.2 m -106.99 110.87 23.12 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.175 -178.755 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 765' ' ' PHE . . . . . 0.499 ' HE1' HG23 ' A' ' 785' ' ' VAL . 40.5 m-85 -70.73 152.72 43.51 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 171.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 766' ' ' CYS . . . . . 0.469 ' SG ' ' HB ' ' A' ' 782' ' ' VAL . 0.0 OUTLIER -157.5 133.56 9.49 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 178.32 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 767' ' ' ARG . . . . . 0.417 ' HB2' ' HE ' ' A' ' 767' ' ' ARG . 0.0 OUTLIER -126.1 -8.97 6.51 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.775 177.105 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 768' ' ' ARG . . . . . 0.525 ' HA ' ' HD2' ' A' ' 768' ' ' ARG . 2.3 mmm-85 -122.45 -72.89 0.66 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.013 0.435 . . . . 0.0 110.983 179.441 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -103.29 129.94 50.42 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.222 -0.658 . . . . 0.0 109.222 -178.398 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 770' ' ' ILE . . . . . 0.469 HG23 ' O ' ' A' ' 770' ' ' ILE . 0.2 OUTLIER -114.65 12.51 8.02 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 CA-C-O 121.645 0.736 . . . . 0.0 111.328 -173.241 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -76.15 41.83 1.58 Allowed Glycine 0 CA--C 1.521 0.411 0 CA-C-N 115.542 -0.753 . . . . 0.0 113.291 -177.35 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 772' ' ' ILE . . . . . 0.607 HG12 HG22 ' A' ' 752' ' ' VAL . 1.1 mm -105.84 145.01 30.04 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 174.514 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 773' ' ' PRO . . . . . 0.498 ' HB2' ' HG2' ' A' ' 780' ' ' GLU . 54.3 Cg_exo -51.11 107.77 0.19 Allowed 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.165 1.91 . . . . 0.0 111.817 173.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 774' ' ' LEU . . . . . 0.61 ' HG ' ' HG2' ' A' ' 776' ' ' LYS . 0.5 OUTLIER -101.99 -155.37 0.52 Allowed 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.255 179.618 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 775' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 1.8 mp0 -66.35 10.0 0.14 Allowed 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -179.085 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 776' ' ' LYS . . . . . 0.61 ' HG2' ' HG ' ' A' ' 774' ' ' LEU . 8.9 ptpt -71.03 -18.32 62.58 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 166.272 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -121.06 136.23 25.49 Favored Pre-proline 0 N--CA 1.451 -0.421 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.325 174.627 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -65.28 111.82 1.91 Allowed 'Trans proline' 0 CA--C 1.529 0.24 0 C-N-CA 122.587 2.191 . . . . 0.0 112.59 -177.761 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 110.14 -8.66 31.21 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.907 -0.663 . . . . 0.0 112.024 179.434 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 780' ' ' GLU . . . . . 0.498 ' HG2' ' HB2' ' A' ' 773' ' ' PRO . 0.1 OUTLIER -107.59 134.76 50.12 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 179.954 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 30.4 m95 -135.79 148.73 48.87 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.245 -0.28 . . . . 0.0 110.245 -178.086 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 782' ' ' VAL . . . . . 0.469 ' HB ' ' SG ' ' A' ' 766' ' ' CYS . 19.3 m -132.1 165.23 32.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 168.215 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 783' ' ' HIS . . . . . 0.416 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.2 OUTLIER -171.29 134.16 0.88 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.973 0.416 . . . . 0.0 111.502 177.038 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 784' ' ' SER . . . . . 0.487 ' O ' HG13 ' A' ' 785' ' ' VAL . 0.0 OUTLIER -98.81 99.25 10.31 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.515 178.208 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 785' ' ' VAL . . . . . 0.499 HG23 ' HE1' ' A' ' 765' ' ' PHE . 0.0 OUTLIER -171.39 -179.3 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 C-N-CA 122.796 0.438 . . . . 0.0 110.17 178.816 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 786' ' ' ALA . . . . . 0.648 ' HA ' HD11 ' A' ' 718' ' ' LEU . . . -107.95 22.24 16.23 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.696 -0.683 . . . . 0.0 109.92 171.817 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 787' ' ' ALA . . . . . 0.407 ' HB2' ' CZ ' ' A' ' 765' ' ' PHE . . . 58.98 63.11 3.9 Favored Pre-proline 0 N--CA 1.468 0.43 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.973 -178.857 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 788' ' ' PRO . . . . . 0.459 ' HD3' ' HB ' ' A' ' 785' ' ' VAL . 24.3 Cg_exo -63.71 -53.46 1.32 Allowed 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.569 2.179 . . . . 0.0 112.844 -178.151 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 8.2 p-80 -172.13 25.71 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 790' ' ' GLU . . . . . 0.451 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -121.9 -46.81 2.2 Favored 'General case' 0 C--N 1.323 -0.578 0 O-C-N 122.034 -0.416 . . . . 0.0 111.091 -179.963 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 791' ' ' LEU . . . . . 0.571 HD11 HG11 ' A' ' 763' ' ' VAL . 0.5 OUTLIER -57.85 -54.61 53.59 Favored Pre-proline 0 CA--C 1.537 0.48 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -178.826 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 792' ' ' PRO . . . . . 0.406 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 12.7 Cg_endo -60.59 -26.74 83.51 Favored 'Trans proline' 0 C--N 1.355 0.915 0 C-N-CA 121.432 1.421 . . . . 0.0 112.019 178.959 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -70.43 -43.54 69.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.955 0.407 . . . . 0.0 110.264 177.041 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 794' ' ' LEU . . . . . 0.528 ' O ' ' HB ' ' A' ' 798' ' ' ILE . 0.1 OUTLIER -61.91 -37.82 86.08 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.332 177.537 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 795' ' ' LEU . . . . . 0.422 HD21 HG21 ' A' ' 763' ' ' VAL . 1.3 mm? -63.04 -49.9 72.78 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.156 0.503 . . . . 0.0 110.816 179.477 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -59.99 -48.33 82.16 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.185 -179.227 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 797' ' ' ARG . . . . . 0.446 ' HG2' ' HA ' ' A' ' 794' ' ' LEU . 0.3 OUTLIER -71.99 -20.83 61.66 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.667 -178.288 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 798' ' ' ILE . . . . . 0.528 ' HB ' ' O ' ' A' ' 794' ' ' LEU . 0.1 OUTLIER -72.01 -31.19 39.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.959 0.409 . . . . 0.0 110.247 178.442 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -85.37 -56.22 3.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.216 175.817 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 800' ' ' LEU . . . . . 0.432 ' HG ' ' HA ' ' A' ' 797' ' ' ARG . 4.8 mt . . . . . 0 N--CA 1.467 0.391 0 O-C-N 123.934 0.771 . . . . 0.0 112.562 178.078 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 824' ' ' ASP . . . . . 0.41 ' HB3' ' HE1' ' A' ' 849' ' ' TYR . 25.1 t70 . . . . . 0 CA--C 1.517 -0.315 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -106.78 124.57 49.8 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.457 173.092 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 826' ' ' MET . . . . . . . . . . . . . 2.9 ttt -96.64 113.26 24.81 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.456 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 827' ' ' ILE . . . . . 0.661 HD12 ' HB ' ' A' ' 871' ' ' ILE . 9.4 mm -113.13 134.46 55.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.281 -179.548 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 828' ' ' LEU . . . . . 0.908 HD23 HG12 ' A' ' 869' ' ' ILE . 0.3 OUTLIER -101.06 120.42 40.18 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.897 178.215 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -102.85 95.78 4.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.209 0.528 . . . . 0.0 110.088 178.828 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 830' ' ' VAL . . . . . 0.476 HG22 HD12 ' A' ' 828' ' ' LEU . 1.7 t -113.16 109.13 27.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.346 -177.807 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 831' ' ' ASP . . . . . 0.728 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 18.8 t70 -124.88 159.46 31.07 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 110.22 -0.289 . . . . 0.0 110.22 179.073 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 832' ' ' ASP . . . . . 0.697 ' HB3' ' HB3' ' A' ' 877' ' ' ASN . 35.0 t70 -75.0 -27.55 60.19 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.954 -176.819 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 6.6 m170 -120.47 111.32 34.96 Favored Pre-proline 0 C--N 1.326 -0.421 0 O-C-N 122.322 -0.236 . . . . 0.0 111.053 -174.035 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 834' ' ' PRO . . . . . 0.467 ' HA ' ' HD2' ' A' ' 837' ' ' ARG . 87.6 Cg_exo -43.59 -36.89 7.59 Favored 'Trans proline' 0 CA--C 1.532 0.407 0 C-N-CA 123.643 2.895 . . . . 0.0 114.369 -176.052 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 835' ' ' ILE . . . . . 0.512 ' O ' ' HG3' ' A' ' 838' ' ' ARG . 1.1 pp -66.13 -44.46 91.72 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 CA-C-O 120.888 0.375 . . . . 0.0 111.214 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 836' ' ' ASN . . . . . 0.445 ' HB3' ' OD2' ' A' ' 831' ' ' ASP . 18.3 t-20 -72.14 -41.87 66.65 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 177.94 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 837' ' ' ARG . . . . . 0.728 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 0.1 OUTLIER -53.8 -46.07 70.97 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.733 -1.121 . . . . 0.0 111.437 179.044 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 838' ' ' ARG . . . . . 0.512 ' HG3' ' O ' ' A' ' 835' ' ' ILE . 0.0 OUTLIER -72.76 -29.05 63.0 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 121.0 -0.28 . . . . 0.0 110.88 179.265 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.34 -47.11 83.53 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.645 -0.252 . . . . 0.0 111.371 -178.977 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 840' ' ' LEU . . . . . 0.473 ' H ' ' HG ' ' A' ' 840' ' ' LEU . 0.0 OUTLIER -71.35 -32.72 68.86 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.952 0.406 . . . . 0.0 110.254 178.188 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -63.64 -33.98 76.83 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.327 0.584 . . . . 0.0 110.39 177.047 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -65.53 -44.63 86.33 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.396 177.612 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 843' ' ' GLN . . . . . 0.752 ' HG3' HD23 ' A' ' 929' ' ' LEU . 1.2 mp0 -64.75 -41.69 95.73 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.542 179.012 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 844' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.66 -31.82 72.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.419 175.587 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -61.8 -43.12 99.65 Favored Glycine 0 N--CA 1.451 -0.329 0 CA-C-N 115.771 -0.649 . . . . 0.0 112.301 176.91 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -31.48 72.7 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.849 0.356 . . . . 0.0 110.626 176.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 847' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 847' ' ' LEU . 14.8 mt -66.77 -32.65 74.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.63 177.584 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 87.65 27.55 26.67 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.639 177.418 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 849' ' ' TYR . . . . . 0.467 ' HD1' ' HA ' ' A' ' 849' ' ' TYR . 0.1 OUTLIER -114.45 167.11 11.0 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 122.804 -0.233 . . . . 0.0 110.674 -179.261 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -71.01 118.64 14.05 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.481 -175.852 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -123.54 107.82 11.96 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.456 179.287 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.58 119.4 35.0 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 177.048 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.13 110.19 21.22 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.074 0.464 . . . . 0.0 111.709 -171.201 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 854' ' ' ALA . . . . . 0.446 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -121.78 155.93 34.26 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.897 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -137.23 79.07 1.73 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.341 -177.77 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 856' ' ' ASP . . . . . 0.434 ' CG ' ' H ' ' A' ' 857' ' ' GLY . 7.5 t70 -175.61 -166.92 0.22 Allowed 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.1 177.074 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 857' ' ' GLY . . . . . 0.434 ' H ' ' CG ' ' A' ' 856' ' ' ASP . . . -124.14 -53.61 0.19 Allowed Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 121.226 -0.511 . . . . 0.0 111.907 178.796 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -71.7 -31.02 40.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.899 0.381 . . . . 0.0 110.757 -177.346 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.76 -19.91 65.16 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.973 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 860' ' ' ALA . . . . . 0.473 ' O ' ' HG ' ' A' ' 864' ' ' LEU . . . -64.73 -51.06 64.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.753 0.311 . . . . 0.0 110.203 176.077 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 861' ' ' LEU . . . . . 0.859 HD23 HG13 ' A' ' 890' ' ' ILE . 1.4 tm? -58.87 -39.78 82.4 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.375 0.607 . . . . 0.0 109.636 175.275 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 28.7 t30 -55.02 -42.31 72.45 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.027 177.556 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 863' ' ' VAL . . . . . 0.591 HG13 HD13 ' A' ' 869' ' ' ILE . 0.4 OUTLIER -71.16 -32.34 47.36 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.71 -177.497 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 864' ' ' LEU . . . . . 0.724 HD13 HD21 ' A' ' 897' ' ' LEU . 4.4 mt -68.02 -37.59 81.57 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.409 0.623 . . . . 0.0 110.5 178.912 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 1.4 m -78.92 -16.14 57.39 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.317 179.254 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 1.4 mtmm -81.53 -57.49 3.44 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.514 177.169 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -139.53 151.32 46.03 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.448 -178.339 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 80.3 t60 -78.24 105.52 9.53 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.286 0.565 . . . . 0.0 111.156 -177.775 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 869' ' ' ILE . . . . . 0.908 HG12 HD23 ' A' ' 828' ' ' LEU . 1.5 mp -93.86 146.24 6.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 171.846 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -84.06 -52.34 6.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.817 0.341 . . . . 0.0 110.884 -175.141 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 871' ' ' ILE . . . . . 0.661 ' HB ' HD12 ' A' ' 827' ' ' ILE . 12.9 mm -124.59 122.46 63.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.14 -179.237 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 872' ' ' VAL . . . . . 0.634 ' HB ' HG13 ' A' ' 899' ' ' VAL . 2.5 t -103.54 124.94 58.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.863 178.147 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 873' ' ' LEU . . . . . . . . . . . . . 67.7 mt -107.25 110.29 22.29 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 176.186 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -113.62 99.7 7.93 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.679 -179.513 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 875' ' ' ASP . . . . . 0.516 ' HA ' HG13 ' A' ' 902' ' ' VAL . 47.2 t0 -97.48 113.26 24.91 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.219 -178.736 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -103.86 103.53 15.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.868 -178.004 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 877' ' ' ASN . . . . . 0.697 ' HB3' ' HB3' ' A' ' 832' ' ' ASP . 0.4 OUTLIER -65.45 -42.6 92.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.623 178.129 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 10.1 ttp . . . . . 0 C--N 1.327 -0.409 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.942 -177.561 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.652 0 N-CA-C 111.504 -0.639 . . . . 0.0 111.504 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.63 -33.21 75.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.208 0.527 . . . . 0.0 109.754 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 885' ' ' ARG . . . . . 0.408 ' O ' ' HB2' ' A' ' 889' ' ' ARG . 0.6 OUTLIER -72.56 -31.33 65.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.528 176.919 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.59 -51.05 62.67 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.808 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 887' ' ' THR . . . . . 0.651 HG21 ' HB2' ' A' ' 916' ' ' GLU . 44.4 m -63.52 -41.48 98.48 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.037 0.446 . . . . 0.0 111.007 178.894 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 888' ' ' GLN . . . . . 0.478 ' O ' ' HB2' ' A' ' 892' ' ' GLN . 1.5 tp60 -63.2 -41.7 99.2 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.765 178.757 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 889' ' ' ARG . . . . . 0.408 ' HB2' ' O ' ' A' ' 885' ' ' ARG . 0.0 OUTLIER -66.09 -43.39 87.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.264 -178.227 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 890' ' ' ILE . . . . . 0.859 HG13 HD23 ' A' ' 861' ' ' LEU . 13.0 tt -66.37 -41.1 88.28 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.502 -176.753 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 891' ' ' ARG . . . . . 0.433 ' HG3' ' N ' ' A' ' 892' ' ' GLN . 0.2 OUTLIER -75.4 -29.09 59.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.541 0.21 . . . . 0.0 111.153 179.413 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 892' ' ' GLN . . . . . 0.478 ' HB2' ' O ' ' A' ' 888' ' ' GLN . 1.2 tp60 -73.31 -50.36 22.53 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 120.83 0.348 . . . . 0.0 111.389 -177.545 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.12 -38.16 78.73 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.725 -177.77 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 121.95 82.39 0.64 Allowed Glycine 0 N--CA 1.445 -0.752 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.656 177.771 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 895' ' ' LEU . . . . . 0.571 ' O ' ' HG ' ' A' ' 895' ' ' LEU . 0.1 OUTLIER -59.73 130.85 48.84 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 175.793 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -117.96 13.27 13.94 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.57 0.582 . . . . 0.0 112.57 -171.547 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 897' ' ' LEU . . . . . 0.724 HD21 HD13 ' A' ' 864' ' ' LEU . 0.0 OUTLIER -157.31 166.52 16.44 Favored Pre-proline 0 C--N 1.321 -0.645 0 CA-C-N 116.616 -0.266 . . . . 0.0 111.331 -174.38 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_exo -71.06 108.55 2.35 Favored 'Trans proline' 0 C--O 1.239 0.545 0 C-N-CA 122.492 2.128 . . . . 0.0 111.622 173.412 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 899' ' ' VAL . . . . . 0.634 HG13 ' HB ' ' A' ' 872' ' ' VAL . 2.4 t -97.54 121.32 47.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.868 176.539 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 900' ' ' ILE . . . . . . . . . . . . . 2.7 mp -103.48 106.27 19.87 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-O 121.242 0.544 . . . . 0.0 109.987 178.856 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -94.61 97.73 2.2 Favored Glycine 0 N--CA 1.443 -0.897 0 CA-C-N 115.458 -0.792 . . . . 0.0 112.203 -178.395 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 902' ' ' VAL . . . . . 0.516 HG13 ' HA ' ' A' ' 875' ' ' ASP . 0.2 OUTLIER -79.86 123.77 37.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 175.098 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -118.68 143.73 46.66 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.015 0.436 . . . . 0.0 111.094 -174.111 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 904' ' ' ALA . . . . . 0.548 ' HA ' ' HB2' ' A' ' 925' ' ' LYS . . . -82.22 119.23 23.82 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.198 178.7 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 62.8 56.68 1.87 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.985 174.412 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 906' ' ' ALA . . . . . 0.541 ' HB3' ' HG3' ' A' ' 909' ' ' GLU . . . -107.46 -39.08 5.75 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.232 174.794 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 72.48 -65.68 0.34 Allowed 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.797 177.673 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -82.86 53.93 2.56 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.077 0.465 . . . . 0.0 109.791 176.328 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 909' ' ' GLU . . . . . 0.541 ' HG3' ' HB3' ' A' ' 906' ' ' ALA . 3.4 mp0 -62.63 -35.24 78.95 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.928 -177.667 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 910' ' ' GLU . . . . . 0.476 ' H ' ' HG3' ' A' ' 910' ' ' GLU . 0.0 OUTLIER -62.62 -45.29 93.53 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.421 0.629 . . . . 0.0 110.194 176.289 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 1.1 tttt -63.69 -37.21 86.49 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.489 177.326 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 18.6 tt0 -60.57 -42.58 96.95 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.471 177.13 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.88 -40.34 76.03 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.563 178.542 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 3.9 m -75.58 -31.16 59.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.037 179.38 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.73 -52.73 18.98 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.664 -175.767 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 916' ' ' GLU . . . . . 0.651 ' HB2' HG21 ' A' ' 887' ' ' THR . 0.2 OUTLIER -79.23 -44.68 21.33 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.457 -177.341 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 67.4 m 50.72 45.4 27.12 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 123.257 0.348 . . . . 0.0 111.852 -176.802 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 918' ' ' GLY . . . . . 0.407 ' H ' ' CD ' ' A' ' 916' ' ' GLU . . . -122.23 -33.56 0.89 Allowed Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.561 -0.828 . . . . 0.0 112.133 -179.706 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 919' ' ' MET . . . . . 0.61 ' HB3' ' HB ' ' A' ' 899' ' ' VAL . 5.4 mmt -90.9 -71.82 0.61 Allowed 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 176.977 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 920' ' ' ASP . . . . . 0.449 ' HB2' ' O ' ' A' ' 919' ' ' MET . 13.6 t70 158.59 -67.34 0.0 OUTLIER 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 114.399 -1.273 . . . . 0.0 108.959 175.135 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -118.9 167.71 11.46 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.26 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 922' ' ' CYS . . . . . 0.535 ' HB2' ' O ' ' A' ' 909' ' ' GLU . 85.0 m -143.47 133.71 24.51 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.225 -0.443 . . . . 0.0 109.985 177.221 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 923' ' ' LEU . . . . . . . . . . . . . 56.0 mt -120.93 169.4 10.5 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.9 -178.788 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 924' ' ' SER . . . . . 0.435 ' O ' HG23 ' A' ' 927' ' ' VAL . 0.7 OUTLIER -84.66 150.4 25.17 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.4 177.066 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 925' ' ' LYS . . . . . 0.548 ' HB2' ' HA ' ' A' ' 904' ' ' ALA . 0.0 OUTLIER -58.38 -40.82 85.69 Favored Pre-proline 0 CA--C 1.541 0.621 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -179.432 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -64.8 73.83 0.22 Allowed 'Trans proline' 0 C--N 1.357 0.999 0 C-N-CA 122.102 1.868 . . . . 0.0 112.757 173.433 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 927' ' ' VAL . . . . . 0.435 HG23 ' O ' ' A' ' 924' ' ' SER . 8.9 t -100.94 114.54 40.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 121.12 0.486 . . . . 0.0 109.828 174.791 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.53 177.46 7.74 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.251 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 929' ' ' LEU . . . . . 0.752 HD23 ' HG3' ' A' ' 843' ' ' GLN . 1.6 tm? -57.82 -45.45 86.15 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.804 0.335 . . . . 0.0 110.401 177.723 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 930' ' ' ASP . . . . . 0.443 ' O ' ' HG2' ' A' ' 934' ' ' GLN . 3.4 t0 -66.5 -40.65 89.37 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.665 -178.452 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 50.8 t -64.7 -47.9 86.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.868 -179.1 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 932' ' ' ILE . . . . . 0.407 HG22 ' O ' ' A' ' 929' ' ' LEU . 0.0 OUTLIER -64.95 -31.97 56.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.936 0.398 . . . . 0.0 110.09 178.673 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 4.8 ttmt -65.74 -48.31 72.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.242 177.36 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 934' ' ' GLN . . . . . 0.459 ' O ' ' HB3' ' A' ' 938' ' ' LEU . 56.5 mm-40 -60.54 -48.77 80.29 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.447 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 13.4 m -59.62 -51.85 68.06 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.371 -178.877 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 936' ' ' LEU . . . . . 0.466 HD11 HG13 ' A' ' 827' ' ' ILE . 0.3 OUTLIER -63.65 -47.19 82.28 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.208 -177.76 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 32.3 m -63.53 -50.29 70.15 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -178.014 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 938' ' ' LEU . . . . . 0.459 ' HB3' ' O ' ' A' ' 934' ' ' GLN . 0.0 OUTLIER -66.32 -36.33 82.66 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.466 -0.333 . . . . 0.0 111.232 -175.832 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -76.03 -37.66 58.11 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.843 -0.343 . . . . 0.0 111.03 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -65.07 -37.77 88.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.947 0.403 . . . . 0.0 110.713 178.498 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 941' ' ' GLU . . . . . 0.649 ' O ' ' HG2' ' A' ' 945' ' ' LYS . 2.2 pt-20 -75.76 -29.01 58.69 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.678 -0.409 . . . . 0.0 110.52 177.385 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 942' ' ' ARG . . . . . . . . . . . . . 1.4 tpt85 -66.59 -47.49 72.56 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.567 179.09 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 27.9 m -67.24 -29.16 44.96 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 121.283 0.563 . . . . 0.0 109.861 176.882 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.91 -24.93 66.15 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.804 175.861 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 945' ' ' LYS . . . . . 0.649 ' HG2' ' O ' ' A' ' 941' ' ' GLU . 9.6 mmtt -73.87 -43.63 58.0 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 120.855 0.36 . . . . 0.0 110.183 176.821 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.32 -30.89 71.92 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.743 177.95 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.39 -19.31 46.6 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.248 174.862 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 29.6 t70 . . . . . 0 C--N 1.33 -0.267 0 CA-C-N 114.957 -1.02 . . . . 0.0 111.538 177.914 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 3.3 m . . . . . 0 N--CA 1.454 -0.245 0 CA-C-O 120.908 0.385 . . . . 0.0 111.368 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 106.75 -12.71 42.18 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.76 175.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -75.48 132.0 40.49 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 174.618 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 708' ' ' ARG . . . . . 0.726 ' HG3' ' HB ' ' A' ' 732' ' ' VAL . 2.8 ttt180 -97.3 152.78 18.55 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.19 0.519 . . . . 0.0 111.445 -171.586 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -130.18 117.84 20.51 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.947 176.502 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 710' ' ' TRP . . . . . 0.469 ' O ' HD23 ' A' ' 747' ' ' LEU . 47.2 m95 -94.82 120.19 34.65 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.56 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 711' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -122.36 132.38 54.35 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.393 0.616 . . . . 0.0 111.199 -177.686 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -125.76 70.4 1.2 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.422 176.093 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 713' ' ' VAL . . . . . 0.643 HG13 ' HB3' ' A' ' 750' ' ' ASP . 60.8 t -128.15 120.58 53.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.114 -0.948 . . . . 0.0 109.952 -176.727 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 714' ' ' ARG . . . . . 0.572 ' HD2' ' OD2' ' A' ' 750' ' ' ASP . 0.3 OUTLIER -91.94 -8.99 44.71 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.385 -175.734 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -83.23 113.65 20.82 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 176.2 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 716' ' ' ALA . . . . . 0.402 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -58.0 -43.95 86.93 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.49 -173.793 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.34 -45.66 86.89 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.009 0.433 . . . . 0.0 110.331 -179.171 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.15 -50.55 60.8 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.235 -179.396 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 719' ' ' CYS . . . . . 0.402 ' SG ' ' HA ' ' A' ' 716' ' ' ALA . 13.9 p -67.13 -44.9 78.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.221 -174.446 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 720' ' ' GLN . . . . . 0.631 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 0.3 OUTLIER -65.51 -37.87 88.04 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 121.002 -0.279 . . . . 0.0 111.173 -177.016 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 39.2 t80 -60.59 -48.16 83.02 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 121.013 -0.275 . . . . 0.0 110.692 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 722' ' ' LEU . . . . . 0.418 HD13 HG21 ' A' ' 748' ' ' ILE . 15.9 mt -66.16 -48.78 69.62 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.628 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 723' ' ' GLU . . . . . 0.887 ' HB2' HG11 ' A' ' 733' ' ' VAL . 8.7 pt-20 -61.88 -37.49 84.75 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.721 -175.181 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 724' ' ' THR . . . . . 0.541 ' HA ' ' HG2' ' A' ' 727' ' ' GLN . 26.2 m -68.96 -38.23 79.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.92 0.391 . . . . 0.0 110.797 179.226 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 24.3 m -70.71 -28.41 64.71 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.11 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 726' ' ' LEU . . . . . . . . . . . . . 18.3 mt -80.14 -44.21 20.3 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.98 0.419 . . . . 0.0 110.747 179.142 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 727' ' ' GLN . . . . . 0.541 ' HG2' ' HA ' ' A' ' 724' ' ' THR . 12.2 pt20 -72.03 -7.89 51.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.957 0.408 . . . . 0.0 110.705 178.183 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.74 -29.06 70.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.922 178.104 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 2.1 p -104.66 -88.55 0.43 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.065 0.459 . . . . 0.0 110.553 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 730' ' ' GLY . . . . . . . . . . . . . . . -158.05 19.68 0.35 Allowed Glycine 0 N--CA 1.445 -0.751 0 N-CA-C 111.343 -0.703 . . . . 0.0 111.343 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 731' ' ' ILE . . . . . . . . . . . . . 35.0 mm -79.35 128.09 38.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 120.886 0.374 . . . . 0.0 110.601 -179.338 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 732' ' ' VAL . . . . . 0.726 ' HB ' ' HG3' ' A' ' 708' ' ' ARG . 0.1 OUTLIER -79.15 89.26 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.554 -179.525 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 733' ' ' VAL . . . . . 0.887 HG11 ' HB2' ' A' ' 723' ' ' GLU . 94.7 t -66.09 114.43 3.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.015 176.416 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -130.13 133.41 46.62 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.15 0.5 . . . . 0.0 110.862 -178.703 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.8 124.15 20.74 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.926 178.532 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -85.09 96.29 9.39 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.296 0.57 . . . . 0.0 110.556 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -107.95 -10.81 15.45 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.299 178.835 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 148.27 57.1 0.01 OUTLIER Glycine 0 CA--C 1.51 -0.25 0 N-CA-C 111.199 -0.76 . . . . 0.0 111.199 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 17.2 mp0 -106.81 173.99 6.08 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.953 0.406 . . . . 0.0 111.59 -173.069 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 740' ' ' GLU . . . . . 0.434 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 6.2 mm-40 -75.38 141.52 73.6 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.557 -177.725 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 741' ' ' PRO . . . . . 0.589 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 1.9 Cg_endo -84.72 123.52 2.88 Favored 'Trans proline' 0 N--CA 1.455 -0.744 0 C-N-CA 123.108 2.539 . . . . 0.0 112.415 176.388 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 742' ' ' THR . . . . . 0.497 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.0 OUTLIER -111.95 138.26 21.62 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.468 177.564 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 743' ' ' PRO . . . . . 0.497 ' HD2' HG22 ' A' ' 742' ' ' THR . 40.5 Cg_endo -67.12 -6.65 16.63 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 123.166 2.578 . . . . 0.0 113.916 -175.236 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -109.13 1.12 20.16 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.8 0.333 . . . . 0.0 110.895 178.044 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 82.7 m-20 -117.01 157.51 25.69 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-N 116.279 -0.419 . . . . 0.0 109.979 -175.277 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 746' ' ' VAL . . . . . 0.423 HG21 HD11 ' A' ' 795' ' ' LEU . 0.8 OUTLIER -123.6 149.08 27.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 120.915 0.388 . . . . 0.0 111.156 -177.809 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 747' ' ' LEU . . . . . 0.469 HD23 ' O ' ' A' ' 710' ' ' TRP . 0.0 OUTLIER -105.82 112.56 25.68 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.877 176.191 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 748' ' ' ILE . . . . . 0.418 HG21 HD13 ' A' ' 722' ' ' LEU . 17.9 mt -98.88 114.19 35.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 176.76 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 34.8 p -115.01 148.99 38.14 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.685 0.279 . . . . 0.0 111.253 -174.799 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 750' ' ' ASP . . . . . 0.643 ' HB3' HG13 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -98.82 123.28 42.97 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 171.303 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 751' ' ' GLU . . . . . 0.478 ' HB3' ' H ' ' A' ' 752' ' ' VAL . 10.2 mm-40 57.89 -156.48 0.32 Allowed 'General case' 0 C--O 1.236 0.361 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.356 -175.419 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 752' ' ' VAL . . . . . 0.67 HG22 ' H ' ' A' ' 771' ' ' GLY . 4.9 t -87.55 141.06 14.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 121.103 0.478 . . . . 0.0 111.422 -174.251 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 15.6 m -125.29 160.54 30.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.908 177.553 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -84.66 56.56 3.92 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.948 0.404 . . . . 0.0 110.9 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.72 176.3 12.14 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.415 179.304 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.53 -39.24 2.03 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.411 -179.902 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 757' ' ' TRP . . . . . 0.589 ' CH2' ' HA ' ' A' ' 741' ' ' PRO . 76.0 t-105 70.46 158.88 0.19 Allowed 'General case' 0 CA--C 1.537 0.462 0 O-C-N 123.702 0.626 . . . . 0.0 111.576 177.701 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -134.15 -85.45 0.42 Allowed 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 172.175 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 759' ' ' GLY . . . . . . . . . . . . . . . 50.25 -136.44 26.03 Favored Glycine 0 C--N 1.334 0.452 0 CA-C-N 116.394 -0.366 . . . . 0.0 112.946 176.289 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 30.7 ttm-85 -85.29 -50.58 7.23 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.241 0.543 . . . . 0.0 109.587 172.717 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -166.54 158.85 13.8 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.028 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 762' ' ' VAL . . . . . 0.494 ' HB ' ' CD1' ' A' ' 757' ' ' TRP . 2.4 p -120.41 128.09 75.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 174.334 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 763' ' ' VAL . . . . . 0.732 HG11 HD21 ' A' ' 791' ' ' LEU . 11.9 t -112.06 104.71 17.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 121.085 0.469 . . . . 0.0 110.273 -178.919 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 764' ' ' THR . . . . . . . . . . . . . 36.7 m -98.38 125.25 43.45 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.043 -179.088 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 765' ' ' PHE . . . . . 0.441 ' CE2' HG23 ' A' ' 785' ' ' VAL . 14.8 m-85 -83.12 112.99 20.32 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.661 175.275 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -95.1 133.03 39.36 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.161 -178.172 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 767' ' ' ARG . . . . . 0.513 ' HD2' ' HA ' ' A' ' 767' ' ' ARG . 13.6 mmm-85 -118.55 -48.37 2.5 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.731 0.301 . . . . 0.0 110.233 178.153 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.41 -19.13 1.25 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.941 -178.04 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -138.09 144.3 40.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.921 0.391 . . . . 0.0 111.013 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 16.2 mt -124.25 87.59 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.573 -178.419 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 771' ' ' GLY . . . . . 0.67 ' H ' HG22 ' A' ' 752' ' ' VAL . . . -85.7 -33.88 14.93 Favored Glycine 0 N--CA 1.45 -0.378 0 N-CA-C 111.207 -0.757 . . . . 0.0 111.207 175.928 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 772' ' ' ILE . . . . . 0.439 ' HA ' ' HD3' ' A' ' 773' ' ' PRO . 0.9 OUTLIER -98.5 116.17 65.54 Favored Pre-proline 0 C--N 1.322 -0.596 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 173.118 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 773' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 772' ' ' ILE . 6.0 Cg_exo -77.51 -177.98 4.25 Favored 'Trans proline' 0 N--CA 1.461 -0.439 0 C-N-CA 123.101 2.534 . . . . 0.0 113.41 -174.432 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 774' ' ' LEU . . . . . 0.524 HD23 ' H ' ' A' ' 774' ' ' LEU . 1.7 pt? -88.06 -161.2 0.7 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.464 179.374 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 775' ' ' GLU . . . . . 0.502 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 9.8 mp0 -65.37 62.95 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 113.632 0.975 . . . . 0.0 113.632 -176.897 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 776' ' ' LYS . . . . . 0.427 ' HD3' ' CB ' ' A' ' 773' ' ' PRO . 0.1 OUTLIER -108.42 0.85 21.3 Favored 'General case' 0 C--N 1.309 -1.171 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 168.963 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 777' ' ' ALA . . . . . 0.685 ' HB1' ' HD2' ' A' ' 778' ' ' PRO . . . -132.17 164.55 42.41 Favored Pre-proline 0 N--CA 1.447 -0.601 0 CA-C-N 113.833 -1.53 . . . . 0.0 108.435 177.92 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 778' ' ' PRO . . . . . 0.685 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 14.0 Cg_endo -55.91 -17.96 20.59 Favored 'Trans proline' 0 CA--C 1.534 0.476 0 C-N-CA 123.087 2.525 . . . . 0.0 114.577 -173.58 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . -158.54 34.57 0.5 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 119.71 -1.234 . . . . 0.0 113.397 -177.034 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 780' ' ' GLU . . . . . 0.54 ' HB2' ' HB3' ' A' ' 777' ' ' ALA . 0.1 OUTLIER -97.99 122.66 41.38 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.95 0.375 . . . . 0.0 110.043 178.622 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 16.4 m95 -131.46 146.71 52.37 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.521 -178.655 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 4.8 m -139.18 153.89 24.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.553 176.683 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 783' ' ' HIS . . . . . 0.41 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.9 OUTLIER -155.66 127.5 7.46 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.979 0.419 . . . . 0.0 110.688 173.056 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -95.0 99.93 11.86 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.633 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 785' ' ' VAL . . . . . 0.45 ' HB ' ' HD3' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -166.96 -173.57 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.931 179.629 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -124.39 48.19 1.98 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.904 0.383 . . . . 0.0 110.658 175.281 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 787' ' ' ALA . . . . . 0.406 ' N ' ' HD3' ' A' ' 788' ' ' PRO . . . 54.05 66.17 4.63 Favored Pre-proline 0 N--CA 1.467 0.386 0 CA-C-N 115.248 -0.887 . . . . 0.0 112.547 178.547 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 788' ' ' PRO . . . . . 0.775 ' HD2' ' OE1' ' A' ' 790' ' ' GLU . 17.0 Cg_exo -68.75 -61.75 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.655 2.236 . . . . 0.0 111.673 175.653 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 789' ' ' HIS . . . . . 0.501 ' HB3' ' O ' ' A' ' 788' ' ' PRO . 0.1 OUTLIER 175.79 10.47 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 O-C-N 123.32 0.388 . . . . 0.0 111.881 178.235 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 790' ' ' GLU . . . . . 0.775 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -93.77 -41.95 9.4 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.812 0.339 . . . . 0.0 110.6 -175.724 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 791' ' ' LEU . . . . . 0.732 HD21 HG11 ' A' ' 763' ' ' VAL . 0.2 OUTLIER -62.86 -49.17 83.29 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.667 -179.976 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 792' ' ' PRO . . . . . 0.524 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 10.7 Cg_endo -56.12 -30.94 81.35 Favored 'Trans proline' 0 C--N 1.354 0.864 0 C-N-CA 121.8 1.667 . . . . 0.0 112.042 175.402 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -72.91 -44.72 60.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.772 178.097 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -61.68 -38.18 86.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.181 177.05 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 795' ' ' LEU . . . . . 0.423 HD11 HG21 ' A' ' 746' ' ' VAL . 0.4 OUTLIER -66.68 -42.65 86.19 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.886 -179.774 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -63.85 -38.34 90.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.117 0.484 . . . . 0.0 110.481 176.734 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.17 -44.6 87.98 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.74 178.239 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -69.05 -22.15 25.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.525 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.741 -176.789 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -85.3 0.35 52.29 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.03 0.443 . . . . 0.0 110.126 176.33 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 6.6 mt . . . . . 0 N--CA 1.462 0.14 0 CA-C-N 114.847 -1.069 . . . . 0.0 112.521 171.861 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 32.5 t70 . . . . . 0 C--O 1.232 0.152 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -116.68 120.36 38.37 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.834 178.27 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 826' ' ' MET . . . . . 0.482 ' O ' HG22 ' A' ' 869' ' ' ILE . 18.9 ttm -95.13 118.58 32.17 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.349 0.595 . . . . 0.0 112.193 -172.163 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 827' ' ' ILE . . . . . 0.98 ' HB ' HD21 ' A' ' 844' ' ' LEU . 2.5 mm -115.9 135.82 54.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.779 177.404 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 828' ' ' LEU . . . . . 0.467 HD23 HG13 ' A' ' 872' ' ' VAL . 2.7 tp -117.28 128.99 55.61 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.111 0.481 . . . . 0.0 111.094 -177.698 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 829' ' ' VAL . . . . . 0.675 HG12 HD11 ' A' ' 873' ' ' LEU . 0.0 OUTLIER -110.1 110.38 31.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.269 179.511 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 830' ' ' VAL . . . . . 0.709 HG13 ' HB3' ' A' ' 854' ' ' ALA . 0.0 OUTLIER -113.07 101.63 12.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.594 -179.261 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 831' ' ' ASP . . . . . 0.711 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 5.7 t70 -104.76 157.18 17.38 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 110.089 -0.337 . . . . 0.0 110.089 178.774 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -90.06 -21.42 22.33 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.053 177.886 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 833' ' ' HIS . . . . . 0.404 ' HA ' ' HD3' ' A' ' 834' ' ' PRO . 25.7 m170 -111.79 123.04 35.57 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.592 -178.42 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 834' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 833' ' ' HIS . 66.3 Cg_exo -52.25 -44.72 44.3 Favored 'Trans proline' 0 C--O 1.237 0.446 0 C-N-CA 123.666 2.911 . . . . 0.0 114.191 -173.499 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -71.87 -40.14 68.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.637 0.256 . . . . 0.0 111.082 -176.119 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 836' ' ' ASN . . . . . 0.423 ' CG ' ' HE3' ' A' ' 925' ' ' LYS . 5.1 t30 -68.31 -37.04 80.21 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 178.134 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 837' ' ' ARG . . . . . 0.711 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 4.3 ttp85 -54.12 -44.09 71.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.736 176.2 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 838' ' ' ARG . . . . . 0.454 ' HD2' ' O ' ' A' ' 838' ' ' ARG . 0.0 OUTLIER -65.26 -37.66 87.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.217 178.676 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 839' ' ' LEU . . . . . 0.441 ' HG ' ' NE2' ' A' ' 843' ' ' GLN . 9.2 tp -61.1 -49.8 75.84 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.645 -176.588 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 840' ' ' LEU . . . . . 0.524 HD11 ' HB2' ' A' ' 831' ' ' ASP . 0.0 OUTLIER -70.32 -35.57 73.73 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.778 179.564 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -62.79 -39.51 94.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.109 0.48 . . . . 0.0 110.772 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -70.23 -42.62 72.0 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.562 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 843' ' ' GLN . . . . . 0.94 ' HG2' HD12 ' A' ' 929' ' ' LEU . 20.8 mt-30 -55.98 -49.51 73.4 Favored 'General case' 0 C--O 1.23 0.078 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.363 176.321 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 844' ' ' LEU . . . . . 0.98 HD21 ' HB ' ' A' ' 827' ' ' ILE . 0.2 OUTLIER -59.65 -40.38 87.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.018 178.329 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -68.07 -24.05 74.56 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 121.069 -0.586 . . . . 0.0 112.502 179.024 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 5.4 m -86.31 -25.94 25.18 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.911 0.386 . . . . 0.0 110.591 178.767 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 847' ' ' LEU . . . . . 0.577 HD21 ' HA ' ' A' ' 933' ' ' LYS . 0.2 OUTLIER -67.54 -31.76 72.07 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.87 179.209 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 96.76 52.04 1.58 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.473 178.444 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 54.0 m-85 -133.65 174.56 10.31 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 178.362 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.4 107.89 13.57 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 175.477 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -97.57 129.85 44.67 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.618 -174.268 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 852' ' ' LYS . . . . . 0.468 ' HE2' ' SD ' ' A' ' 826' ' ' MET . 1.5 mptt -125.11 122.7 37.9 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 171.812 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 853' ' ' THR . . . . . 0.533 HG23 HG23 ' A' ' 829' ' ' VAL . 0.2 OUTLIER -110.6 144.28 39.72 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.911 0.386 . . . . 0.0 111.905 -175.083 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 854' ' ' ALA . . . . . 0.709 ' HB3' HG13 ' A' ' 830' ' ' VAL . . . -148.51 151.25 34.81 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.705 174.951 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 855' ' ' ASN . . . . . 0.474 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 1.1 t30 -130.69 74.56 1.6 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.318 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 856' ' ' ASP . . . . . 0.624 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 24.2 t0 171.26 146.65 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.34 0 O-C-N 123.595 0.559 . . . . 0.0 110.467 -178.554 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -75.3 -35.16 49.14 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.622 -0.799 . . . . 0.0 111.278 175.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 858' ' ' VAL . . . . . 0.407 ' H ' HG23 ' A' ' 858' ' ' VAL . 0.6 OUTLIER -68.65 -34.58 65.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 120.95 0.405 . . . . 0.0 110.415 178.077 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 859' ' ' ASP . . . . . 0.624 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 1.2 t70 -71.1 -30.11 66.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.455 179.36 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 860' ' ' ALA . . . . . 0.641 ' HB2' HG11 ' A' ' 830' ' ' VAL . . . -64.5 -39.15 93.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.337 176.169 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 861' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.79 -40.23 83.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.181 175.892 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -59.53 -52.95 63.38 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.952 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 7.6 p -65.06 -31.36 53.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.04 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 864' ' ' LEU . . . . . 0.732 HD21 HD11 ' A' ' 897' ' ' LEU . 0.2 OUTLIER -65.48 -32.9 74.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.905 0.383 . . . . 0.0 111.319 179.167 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 865' ' ' SER . . . . . 0.427 ' HB3' HD11 ' A' ' 893' ' ' LEU . 0.1 OUTLIER -88.59 -16.83 31.49 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.924 0.392 . . . . 0.0 111.04 -178.198 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.03 -27.81 15.43 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.794 -177.947 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -146.02 158.2 43.87 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.691 0.281 . . . . 0.0 110.811 -175.857 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -90.31 -28.27 18.87 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 176.894 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 869' ' ' ILE . . . . . 0.482 HG22 ' O ' ' A' ' 826' ' ' MET . 2.3 mt 56.93 -136.52 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.528 0.135 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 -177.537 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 870' ' ' ASP . . . . . 0.429 ' H ' HG22 ' A' ' 869' ' ' ILE . 0.3 OUTLIER -157.95 -52.42 0.07 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.11 0.481 . . . . 0.0 109.824 169.309 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 871' ' ' ILE . . . . . . . . . . . . . 7.4 mm -122.4 124.0 69.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.726 179.418 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 872' ' ' VAL . . . . . 0.491 ' O ' ' HA ' ' A' ' 899' ' ' VAL . 38.4 t -118.27 129.28 74.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.316 178.966 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 873' ' ' LEU . . . . . 0.675 HD11 HG12 ' A' ' 829' ' ' VAL . 0.7 OUTLIER -131.76 135.23 46.64 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 177.152 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 874' ' ' SER . . . . . 0.505 ' HA ' ' O ' ' A' ' 830' ' ' VAL . 0.9 OUTLIER -123.69 126.63 46.89 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.686 -177.459 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 875' ' ' ASP . . . . . 0.481 ' HA ' ' O ' ' A' ' 902' ' ' VAL . 40.5 t0 -111.21 120.14 41.28 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.41 -178.291 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 4.1 t -121.39 131.93 71.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.031 -176.573 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 877' ' ' ASN . . . . . 0.43 ' HB2' ' HE2' ' A' ' 925' ' ' LYS . 57.7 t30 -121.96 53.02 1.23 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.073 0.464 . . . . 0.0 110.863 179.049 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.323 -0.569 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.13 179.232 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.723 0 N-CA-C 110.397 -1.081 . . . . 0.0 110.397 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.2 -28.28 68.64 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 176.626 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 885' ' ' ARG . . . . . 0.474 ' O ' ' HB2' ' A' ' 889' ' ' ARG . 0.0 OUTLIER -63.82 -31.11 72.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.285 173.939 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 886' ' ' LEU . . . . . 0.453 ' O ' ' HB ' ' A' ' 890' ' ' ILE . 0.0 OUTLIER -68.32 -45.58 72.58 Favored 'General case' 0 C--O 1.226 -0.172 0 CA-C-N 116.662 -0.244 . . . . 0.0 110.523 -177.532 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.59 -43.82 92.61 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.114 0.483 . . . . 0.0 110.814 179.544 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 2.9 tm0? -63.96 -51.46 64.25 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.89 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 889' ' ' ARG . . . . . 0.474 ' HB2' ' O ' ' A' ' 885' ' ' ARG . 0.2 OUTLIER -72.51 -28.17 62.71 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.776 -0.647 . . . . 0.0 112.124 -174.611 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 890' ' ' ILE . . . . . 0.453 ' HB ' ' O ' ' A' ' 886' ' ' LEU . 0.8 OUTLIER -71.65 -38.59 67.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.707 179.273 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 891' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.18 -24.88 54.76 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.121 0.486 . . . . 0.0 109.749 176.559 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -77.3 -31.89 55.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.459 179.3 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 893' ' ' LEU . . . . . 0.427 HD11 ' HB3' ' A' ' 865' ' ' SER . 1.6 tp -73.57 -49.36 26.73 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.345 -179.728 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 133.93 63.61 0.07 OUTLIER Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.297 -0.954 . . . . 0.0 112.161 -179.343 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 895' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.38 110.22 17.33 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.94 -0.392 . . . . 0.0 109.94 175.822 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -115.92 34.04 5.18 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.292 0.568 . . . . 0.0 110.996 -178.852 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 897' ' ' LEU . . . . . 0.732 HD11 HD21 ' A' ' 864' ' ' LEU . 0.2 OUTLIER -141.52 148.93 52.36 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.925 -178.283 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -69.66 130.12 18.9 Favored 'Trans proline' 0 C--O 1.24 0.599 0 C-N-CA 122.647 2.232 . . . . 0.0 113.03 -177.398 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 899' ' ' VAL . . . . . 0.7 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 8.0 t -112.05 129.45 67.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.586 176.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 900' ' ' ILE . . . . . 0.428 ' CG2' ' HG ' ' A' ' 923' ' ' LEU . 3.0 mp -99.2 111.93 30.07 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 175.805 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 901' ' ' GLY . . . . . 0.43 ' HA3' ' SD ' ' A' ' 919' ' ' MET . . . -95.07 101.13 2.67 Favored Glycine 0 N--CA 1.442 -0.938 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.035 -177.433 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 902' ' ' VAL . . . . . 1.017 ' HB ' ' HB2' ' A' ' 923' ' ' LEU . 0.1 OUTLIER -96.21 128.17 47.65 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 178.898 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 903' ' ' THR . . . . . 0.478 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.2 OUTLIER -135.51 169.12 18.0 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.321 -176.492 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 904' ' ' ALA . . . . . 0.576 ' HB2' ' HB2' ' A' ' 925' ' ' LYS . . . -142.81 104.73 4.38 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.678 0.275 . . . . 0.0 111.307 177.354 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 63.4 t30 58.3 74.01 0.45 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.175 -0.921 . . . . 0.0 113.217 172.641 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 906' ' ' ALA . . . . . 0.618 ' HB3' ' HG3' ' A' ' 909' ' ' GLU . . . -117.76 -2.06 11.45 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 169.704 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 2.3 tp 71.76 -56.1 0.65 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 114.87 -1.059 . . . . 0.0 112.746 175.579 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 908' ' ' ALA . . . . . 0.588 ' O ' ' HB2' ' A' ' 912' ' ' GLN . . . -92.14 12.58 21.69 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -172.889 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 909' ' ' GLU . . . . . 0.618 ' HG3' ' HB3' ' A' ' 906' ' ' ALA . 0.5 OUTLIER -63.36 -36.19 82.89 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.583 0.23 . . . . 0.0 111.338 -175.192 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 910' ' ' GLU . . . . . 0.404 ' H ' ' HG3' ' A' ' 910' ' ' GLU . 0.0 OUTLIER -59.73 -61.89 2.28 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.209 -177.341 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.64 -29.31 66.75 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.088 -178.051 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 912' ' ' GLN . . . . . 0.588 ' HB2' ' O ' ' A' ' 908' ' ' ALA . 1.1 mt-30 -62.94 -45.04 94.33 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 177.55 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.61 -38.6 81.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.597 179.52 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 90.7 m -62.84 -35.25 79.31 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.956 176.002 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.47 -51.86 21.48 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.652 -179.051 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 916' ' ' GLU . . . . . 0.508 ' H ' ' HG3' ' A' ' 916' ' ' GLU . 0.0 OUTLIER -72.91 -50.31 24.45 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.672 -0.24 . . . . 0.0 111.292 -175.899 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 49.96 39.21 18.18 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.87 -174.512 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -99.11 -31.45 6.22 Favored Glycine 0 N--CA 1.445 -0.701 0 C-N-CA 120.845 -0.693 . . . . 0.0 111.975 -177.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 919' ' ' MET . . . . . 0.7 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 2.6 mtm -78.58 -94.0 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 110.533 -0.173 . . . . 0.0 110.533 179.325 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 920' ' ' ASP . . . . . 0.572 ' HB2' ' O ' ' A' ' 919' ' ' MET . 11.5 t70 157.47 -81.88 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.39 1.076 . . . . 0.0 108.871 179.479 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -97.48 173.04 7.37 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.752 -178.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 922' ' ' CYS . . . . . 0.424 ' O ' HD23 ' A' ' 923' ' ' LEU . 0.0 OUTLIER -144.18 136.76 26.86 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.943 0.401 . . . . 0.0 111.208 -178.248 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 923' ' ' LEU . . . . . 1.017 ' HB2' ' HB ' ' A' ' 902' ' ' VAL . 60.6 mt -127.25 -175.72 3.52 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.612 178.413 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 924' ' ' SER . . . . . 0.478 ' HA ' ' O ' ' A' ' 903' ' ' THR . 0.2 OUTLIER -126.31 144.17 50.9 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.362 178.3 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 925' ' ' LYS . . . . . 0.576 ' HB2' ' HB2' ' A' ' 904' ' ' ALA . 2.3 tttp -53.82 -42.96 95.44 Favored Pre-proline 0 CA--C 1.54 0.564 0 O-C-N 123.538 0.524 . . . . 0.0 112.305 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -66.91 69.99 0.52 Allowed 'Trans proline' 0 C--N 1.36 1.168 0 C-N-CA 122.067 1.845 . . . . 0.0 111.807 171.236 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 3.0 p -115.48 158.1 15.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.72 -177.323 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -109.03 161.97 14.67 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.255 177.473 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 929' ' ' LEU . . . . . 0.94 HD12 ' HG2' ' A' ' 843' ' ' GLN . 1.2 tt -61.77 -29.52 70.19 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.925 0.393 . . . . 0.0 110.295 176.963 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 930' ' ' ASP . . . . . 0.561 ' O ' ' HG2' ' A' ' 934' ' ' GLN . 17.1 t0 -62.59 -46.24 89.22 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.246 179.375 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 55.2 t -71.73 -42.23 70.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.784 -176.285 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 932' ' ' ILE . . . . . 0.512 HG22 ' HA ' ' A' ' 929' ' ' LEU . 0.0 OUTLIER -64.95 -38.74 83.55 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.038 177.956 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 933' ' ' LYS . . . . . 0.577 ' HA ' HD21 ' A' ' 847' ' ' LEU . 2.0 tmmt? -62.7 -46.13 89.58 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.328 176.634 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 934' ' ' GLN . . . . . 0.561 ' HG2' ' O ' ' A' ' 930' ' ' ASP . 14.1 mm100 -57.05 -51.13 70.51 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.906 179.145 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 5.1 m -63.13 -42.45 99.5 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.464 -178.673 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 936' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.02 -35.85 82.07 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.712 178.947 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 90.2 m -68.32 -45.28 73.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.098 178.738 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 9.4 tp -61.83 -42.87 99.57 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.166 0.508 . . . . 0.0 110.506 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -72.67 -31.85 65.39 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.935 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -62.12 -41.15 97.95 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.807 178.037 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 941' ' ' GLU . . . . . 0.552 ' HG3' ' N ' ' A' ' 942' ' ' ARG . 0.0 OUTLIER -66.51 -35.43 80.23 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.342 178.139 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 942' ' ' ARG . . . . . 0.552 ' N ' ' HG3' ' A' ' 941' ' ' GLU . 5.0 mmt85 -66.1 -48.65 70.24 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.024 0.44 . . . . 0.0 110.89 178.37 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 25.4 m -74.17 -33.23 34.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.531 -174.263 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 944' ' ' ARG . . . . . 0.507 ' HG3' ' N ' ' A' ' 945' ' ' LYS . 0.0 OUTLIER -69.92 -34.59 73.69 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 121.187 -0.205 . . . . 0.0 110.696 -179.819 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 945' ' ' LYS . . . . . 0.507 ' N ' ' HG3' ' A' ' 944' ' ' ARG . 12.8 ptpt -79.16 -31.74 44.08 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 121.158 -0.217 . . . . 0.0 111.347 -178.332 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 946' ' ' SER . . . . . 0.401 ' N ' ' HG3' ' A' ' 945' ' ' LYS . 7.7 m -74.42 -36.82 63.45 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.98 0.419 . . . . 0.0 110.508 179.489 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 947' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 947' ' ' ARG . 1.7 ttm105 -78.51 -19.51 52.82 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.722 175.871 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 27.1 t70 . . . . . 0 N--CA 1.463 0.214 0 CA-C-N 115.036 -0.984 . . . . 0.0 111.118 177.976 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 705' ' ' SER . . . . . 0.628 ' HA ' ' O ' ' A' ' 730' ' ' GLY . 0.9 OUTLIER . . . . . 0 CA--C 1.529 0.152 0 CA-C-O 121.186 0.517 . . . . 0.0 111.439 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . -171.83 -28.45 0.02 OUTLIER Glycine 0 N--CA 1.446 -0.681 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.614 -178.072 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 707' ' ' LYS . . . . . 0.501 ' HE2' ' CE2' ' A' ' 799' ' ' TYR . 0.0 OUTLIER -63.41 148.99 46.99 Favored 'General case' 0 C--N 1.334 -0.095 0 N-CA-C 109.862 -0.421 . . . . 0.0 109.862 176.595 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 708' ' ' ARG . . . . . 0.463 ' H ' ' HE3' ' A' ' 707' ' ' LYS . 4.7 mtt180 -116.53 146.86 42.32 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.125 0.488 . . . . 0.0 111.322 -177.85 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 709' ' ' CYS . . . . . 0.506 ' HB2' HD22 ' A' ' 726' ' ' LEU . 42.9 t -126.89 138.0 53.24 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.138 174.163 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 710' ' ' TRP . . . . . 0.63 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 38.9 m95 -105.49 130.83 53.48 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 120.783 0.325 . . . . 0.0 110.336 -177.335 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 711' ' ' LEU . . . . . 0.545 HD22 HG22 ' A' ' 733' ' ' VAL . 0.6 OUTLIER -136.37 137.73 40.85 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.217 0.532 . . . . 0.0 111.429 -178.412 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -126.91 53.45 1.7 Allowed 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.322 176.18 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 713' ' ' VAL . . . . . 0.987 ' HA ' ' HB2' ' A' ' 750' ' ' ASP . 15.8 t -109.13 132.76 56.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.807 -175.837 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.57 -11.81 16.21 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.583 -177.466 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -74.22 112.9 10.83 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 170.357 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 716' ' ' ALA . . . . . 0.609 ' O ' ' HB2' ' A' ' 720' ' ' GLN . . . -63.05 -44.75 94.96 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 122.73 0.412 . . . . 0.0 111.542 -172.834 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.3 -39.04 89.08 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.002 0.43 . . . . 0.0 110.709 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 718' ' ' LEU . . . . . 0.518 ' O ' ' HG ' ' A' ' 722' ' ' LEU . 2.3 tt -69.0 -51.17 42.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.596 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 719' ' ' CYS . . . . . 0.434 ' HB3' ' HB ' ' A' ' 713' ' ' VAL . 15.0 p -65.12 -42.03 94.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.548 -176.624 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 720' ' ' GLN . . . . . 0.726 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -60.95 -39.38 89.3 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.288 179.483 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.12 -53.7 55.3 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.96 0.409 . . . . 0.0 110.836 -179.623 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 722' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 718' ' ' LEU . 0.0 OUTLIER -67.4 -48.25 67.9 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.304 -178.314 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 723' ' ' GLU . . . . . 0.726 ' HG2' ' HA ' ' A' ' 720' ' ' GLN . 3.1 pt-20 -59.51 -41.13 89.2 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.669 -174.942 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 724' ' ' THR . . . . . 0.671 ' HA ' ' HG2' ' A' ' 727' ' ' GLN . 10.0 m -70.35 -36.6 74.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.688 0.28 . . . . 0.0 111.277 -179.1 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 25.1 m -66.92 -34.08 76.98 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.478 0.18 . . . . 0.0 111.336 -179.116 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 726' ' ' LEU . . . . . 0.671 HD11 HD12 ' A' ' 795' ' ' LEU . 1.1 mp -81.48 -41.67 21.4 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 121.17 -0.212 . . . . 0.0 111.301 178.161 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 727' ' ' GLN . . . . . 0.671 ' HG2' ' HA ' ' A' ' 724' ' ' THR . 0.0 OUTLIER -65.07 -21.76 66.86 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.219 0.533 . . . . 0.0 109.906 177.19 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 728' ' ' ARG . . . . . 0.468 ' HB2' ' O ' ' A' ' 724' ' ' THR . 20.2 ttp85 -60.48 -26.69 66.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.841 175.056 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -107.21 4.32 26.55 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.144 -179.588 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 730' ' ' GLY . . . . . 0.628 ' O ' ' HA ' ' A' ' 705' ' ' SER . . . 99.44 -5.82 58.97 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 121.122 -0.561 . . . . 0.0 112.436 177.902 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 731' ' ' ILE . . . . . 0.589 HG21 HD23 ' A' ' 726' ' ' LEU . 17.1 mt -75.6 113.75 14.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.116 0.484 . . . . 0.0 110.487 -177.053 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 732' ' ' VAL . . . . . . . . . . . . . 10.5 m -76.33 133.69 30.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.83 -177.395 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 733' ' ' VAL . . . . . 0.545 HG22 HD22 ' A' ' 711' ' ' LEU . 0.3 OUTLIER -97.6 138.86 21.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.351 179.42 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 4.7 m -133.98 135.31 43.38 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.254 179.082 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.33 118.82 9.22 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.425 177.016 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 736' ' ' TYR . . . . . 0.63 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 50.8 t80 -82.48 95.01 7.57 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.255 0.55 . . . . 0.0 110.556 -179.294 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.24 -70.82 0.78 Allowed 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.404 175.803 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -130.22 91.29 0.3 Allowed Glycine 0 N--CA 1.445 -0.75 0 N-CA-C 110.788 -0.925 . . . . 0.0 110.788 175.286 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.13 164.25 34.46 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.78 0.324 . . . . 0.0 111.002 -176.37 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 740' ' ' GLU . . . . . 0.523 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 1.9 mt-10 -79.28 138.49 55.92 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.771 -179.066 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 741' ' ' PRO . . . . . 0.523 ' HD3' ' HA ' ' A' ' 740' ' ' GLU . 5.0 Cg_endo -87.46 126.63 2.28 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 123.282 2.655 . . . . 0.0 112.246 177.013 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 742' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -104.65 134.62 19.57 Favored Pre-proline 0 C--N 1.323 -0.571 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.009 177.978 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 743' ' ' PRO . . . . . 1.044 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 18.7 Cg_endo -61.91 -16.88 52.4 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 123.084 2.523 . . . . 0.0 112.98 -179.564 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 56.8 mp0 -105.33 11.79 32.41 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.844 0.354 . . . . 0.0 110.839 178.044 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -111.53 159.86 17.72 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.465 -177.062 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 3.6 p -124.08 141.44 44.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.236 -174.666 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 747' ' ' LEU . . . . . 0.671 ' HB3' HG23 ' A' ' 762' ' ' VAL . 0.5 OUTLIER -117.56 141.43 48.38 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.944 179.33 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -121.75 120.92 63.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 N-CA-C 108.631 -0.878 . . . . 0.0 108.631 169.983 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 749' ' ' THR . . . . . 0.427 HG23 HD22 ' A' ' 747' ' ' LEU . 0.0 OUTLIER -119.27 150.42 40.13 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -169.575 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 750' ' ' ASP . . . . . 0.987 ' HB2' ' HA ' ' A' ' 713' ' ' VAL . 10.1 t0 -108.84 111.55 23.33 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.479 179.472 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 751' ' ' GLU . . . . . 0.972 ' HG2' HH21 ' A' ' 767' ' ' ARG . 17.1 mm-40 58.75 -151.9 0.41 Allowed 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 123.517 0.727 . . . . 0.0 111.248 -177.69 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 752' ' ' VAL . . . . . 0.552 HG22 ' H ' ' A' ' 771' ' ' GLY . 2.6 t -85.74 129.73 37.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 121.061 0.458 . . . . 0.0 111.741 -174.81 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 753' ' ' VAL . . . . . 0.403 HG21 HG22 ' A' ' 749' ' ' THR . 3.4 t -120.7 159.59 22.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.19 -0.671 . . . . 0.0 109.19 177.597 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 1.4 m -79.78 37.93 0.37 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.974 0.416 . . . . 0.0 110.934 178.103 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 3.8 mttt -159.31 -174.65 4.8 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 178.988 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 756' ' ' LYS . . . . . 0.627 ' O ' ' HB2' ' A' ' 757' ' ' TRP . 0.0 OUTLIER -140.03 -67.6 0.43 Allowed 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 172.627 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 757' ' ' TRP . . . . . 0.627 ' HB2' ' O ' ' A' ' 756' ' ' LYS . 0.7 OUTLIER 157.68 164.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 114.303 -1.317 . . . . 0.0 109.519 -175.265 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.69 49.97 1.14 Allowed 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 173.362 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 759' ' ' GLY . . . . . 1.044 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -150.14 -144.6 3.96 Favored Glycine 0 N--CA 1.442 -0.954 0 C-N-CA 120.403 -0.904 . . . . 0.0 113.654 -173.827 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 4.9 ttt85 -63.42 -61.51 2.29 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.22 -0.49 . . . . 0.0 111.652 -173.483 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -162.4 146.35 11.86 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.859 0.362 . . . . 0.0 111.068 -178.559 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 762' ' ' VAL . . . . . 0.671 HG23 ' HB3' ' A' ' 747' ' ' LEU . 4.0 p -126.57 122.96 62.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.738 174.946 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 763' ' ' VAL . . . . . 0.574 HG11 HD21 ' A' ' 791' ' ' LEU . 16.6 t -102.08 95.56 4.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.824 179.668 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 764' ' ' THR . . . . . 0.822 HG21 HG13 ' A' ' 772' ' ' ILE . 91.5 m -92.14 122.53 34.72 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.618 -179.38 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 765' ' ' PHE . . . . . 0.875 ' HZ ' ' HG ' ' A' ' 791' ' ' LEU . 3.9 m-30 -99.39 101.65 12.98 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.098 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -123.5 133.53 54.0 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.21 -177.646 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 767' ' ' ARG . . . . . 0.972 HH21 ' HG2' ' A' ' 751' ' ' GLU . 0.0 OUTLIER -140.19 -35.08 0.52 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.944 -179.048 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -84.98 -52.53 5.92 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 178.195 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -125.15 124.91 42.81 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.57 172.643 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 2.1 mt -115.39 85.34 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.161 0.505 . . . . 0.0 110.538 -177.901 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 771' ' ' GLY . . . . . 0.552 ' H ' HG22 ' A' ' 752' ' ' VAL . . . -92.35 -6.54 64.42 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.858 -0.686 . . . . 0.0 111.815 178.894 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 772' ' ' ILE . . . . . 0.822 HG13 HG21 ' A' ' 764' ' ' THR . 3.0 mm -103.52 131.3 22.19 Favored Pre-proline 0 C--N 1.323 -0.583 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.431 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 773' ' ' PRO . . . . . 0.562 ' O ' ' HB3' ' A' ' 774' ' ' LEU . 31.6 Cg_exo -60.57 -94.04 0.0 OUTLIER 'Trans proline' 0 CA--C 1.532 0.391 0 C-N-CA 123.188 2.592 . . . . 0.0 113.075 -176.725 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 774' ' ' LEU . . . . . 0.678 ' HA ' ' HB ' ' A' ' 782' ' ' VAL . 0.4 OUTLIER 167.4 -163.68 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.19 0.596 . . . . 0.0 109.913 -178.98 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 775' ' ' GLU . . . . . 0.605 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 1.4 mp0 -62.94 69.47 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.743 0.782 . . . . 0.0 112.423 175.084 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 776' ' ' LYS . . . . . 0.404 ' HE3' ' CD2' ' A' ' 774' ' ' LEU . 18.3 ptpt -132.61 -1.03 3.49 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 114.796 -1.093 . . . . 0.0 108.872 171.208 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 777' ' ' ALA . . . . . 0.457 ' HB1' ' HD2' ' A' ' 778' ' ' PRO . . . -131.62 158.36 75.58 Favored Pre-proline 0 N--CA 1.449 -0.494 0 CA-C-N 114.94 -1.027 . . . . 0.0 109.25 179.557 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 778' ' ' PRO . . . . . 0.457 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 23.0 Cg_endo -61.64 99.93 0.18 Allowed 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.58 2.187 . . . . 0.0 112.714 -178.529 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 94.23 15.62 47.09 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.883 -0.675 . . . . 0.0 113.408 175.51 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 780' ' ' GLU . . . . . 0.605 ' O ' ' HG3' ' A' ' 775' ' ' GLU . 2.7 tt0 -100.07 121.78 41.92 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 117.541 0.67 . . . . 0.0 110.322 179.251 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 781' ' ' TRP . . . . . 0.545 ' CZ3' HD11 ' A' ' 794' ' ' LEU . 12.0 m95 -129.33 124.23 33.77 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 176.853 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 782' ' ' VAL . . . . . 0.678 ' HB ' ' HA ' ' A' ' 774' ' ' LEU . 1.8 t -141.13 136.34 33.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 C-N-CA 120.696 -0.402 . . . . 0.0 111.711 -176.131 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 783' ' ' HIS . . . . . 0.444 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 1.0 OUTLIER -176.17 174.81 1.98 Allowed 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.913 168.432 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 784' ' ' SER . . . . . 0.726 ' HB3' ' HB3' ' A' ' 767' ' ' ARG . 0.7 OUTLIER -98.42 100.47 11.74 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.968 177.1 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 785' ' ' VAL . . . . . 0.755 HG12 ' H ' ' A' ' 787' ' ' ALA . 39.8 t -138.47 140.38 39.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -178.703 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -90.23 12.57 17.66 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.76 0.314 . . . . 0.0 111.138 -179.016 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 787' ' ' ALA . . . . . 0.755 ' H ' HG12 ' A' ' 785' ' ' VAL . . . 53.82 57.64 13.18 Favored Pre-proline 0 N--CA 1.467 0.381 0 CA-C-N 115.481 -0.781 . . . . 0.0 112.279 -178.782 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 788' ' ' PRO . . . . . 0.525 ' HD3' ' N ' ' A' ' 787' ' ' ALA . 24.2 Cg_exo -65.23 -57.83 0.24 Allowed 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 122.509 2.139 . . . . 0.0 112.375 178.22 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -160.73 -22.49 0.06 Allowed 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 179.041 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 790' ' ' GLU . . . . . 0.417 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 2.7 pm0 -73.09 -33.53 65.66 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 111.684 0.253 . . . . 0.0 111.684 -175.152 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 791' ' ' LEU . . . . . 0.875 ' HG ' ' HZ ' ' A' ' 765' ' ' PHE . 0.4 OUTLIER -71.07 -52.53 9.32 Favored Pre-proline 0 C--N 1.327 -0.382 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.761 -178.673 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 792' ' ' PRO . . . . . 0.443 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 9.5 Cg_endo -56.68 -30.77 85.17 Favored 'Trans proline' 0 C--N 1.356 0.949 0 C-N-CA 121.521 1.481 . . . . 0.0 111.831 175.228 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -69.7 -42.24 74.32 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.657 175.588 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 794' ' ' LEU . . . . . 0.545 HD11 ' CZ3' ' A' ' 781' ' ' TRP . 0.7 OUTLIER -60.44 -42.57 96.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.66 177.997 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 795' ' ' LEU . . . . . 0.671 HD12 HD11 ' A' ' 726' ' ' LEU . 0.3 OUTLIER -64.68 -35.36 80.77 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.988 0.423 . . . . 0.0 110.693 -179.338 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -63.67 -38.43 91.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.626 177.116 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 797' ' ' ARG . . . . . 0.509 ' HG3' ' N ' ' A' ' 798' ' ' ILE . 0.0 OUTLIER -71.55 -33.06 68.8 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.106 176.593 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 798' ' ' ILE . . . . . 0.509 ' N ' ' HG3' ' A' ' 797' ' ' ARG . 0.9 OUTLIER -61.45 -35.53 67.24 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.445 -175.739 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 799' ' ' TYR . . . . . 0.501 ' CE2' ' HE2' ' A' ' 707' ' ' LYS . 0.2 OUTLIER -104.62 28.04 7.39 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 119.829 -0.749 . . . . 0.0 112.076 176.114 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.235 0.295 0 CA-C-N 115.291 -0.868 . . . . 0.0 112.993 170.419 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 3.1 t0 . . . . . 0 C--O 1.232 0.167 0 CA-C-O 121.211 0.529 . . . . 0.0 111.249 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 3.0 tpt -112.99 92.7 4.1 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.142 0.496 . . . . 0.0 110.252 176.929 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 826' ' ' MET . . . . . . . . . . . . . 8.7 ptp -114.27 129.89 56.64 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.938 -179.066 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 827' ' ' ILE . . . . . 0.503 ' O ' ' HA ' ' A' ' 851' ' ' CYS . 1.0 OUTLIER -126.39 137.76 56.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.998 -178.584 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 828' ' ' LEU . . . . . 0.698 HD22 HD13 ' A' ' 869' ' ' ILE . 0.2 OUTLIER -107.68 143.61 35.93 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.782 0.325 . . . . 0.0 110.632 -178.504 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 829' ' ' VAL . . . . . 0.562 ' HA ' ' HB2' ' A' ' 873' ' ' LEU . 0.1 OUTLIER -128.04 119.67 51.72 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 121.315 0.579 . . . . 0.0 110.231 -179.345 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 830' ' ' VAL . . . . . 0.774 HG22 ' HB3' ' A' ' 854' ' ' ALA . 69.0 t -122.6 107.89 20.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 115.285 -0.871 . . . . 0.0 109.333 176.946 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 831' ' ' ASP . . . . . 0.545 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -118.22 153.26 34.19 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.155 0.502 . . . . 0.0 111.177 -177.611 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 832' ' ' ASP . . . . . 0.44 ' HB2' ' HA ' ' A' ' 876' ' ' VAL . 6.8 t70 -68.94 -42.4 76.78 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.778 -1.101 . . . . 0.0 112.293 -177.289 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 833' ' ' HIS . . . . . 0.489 ' HA ' ' HD2' ' A' ' 834' ' ' PRO . 0.5 OUTLIER -126.41 105.06 24.52 Favored Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 110.299 -0.259 . . . . 0.0 110.299 -173.776 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 834' ' ' PRO . . . . . 0.489 ' HD2' ' HA ' ' A' ' 833' ' ' HIS . 1.4 Cg_endo -40.75 -25.12 0.18 Allowed 'Trans proline' 0 C--N 1.353 0.803 1 C-N-CA 125.892 4.395 . . . . 0.0 116.553 -164.38 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 835' ' ' ILE . . . . . 0.443 ' O ' ' HG3' ' A' ' 838' ' ' ARG . 0.0 OUTLIER -61.01 -39.95 83.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 117.985 0.357 . . . . 0.0 111.173 -179.206 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 836' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -74.5 -41.6 60.41 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 837' ' ' ARG . . . . . 0.545 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 12.9 ttp180 -52.83 -49.93 64.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.25 177.682 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 838' ' ' ARG . . . . . 0.443 ' HG3' ' O ' ' A' ' 835' ' ' ILE . 0.0 OUTLIER -68.56 -34.61 76.13 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.94 -178.139 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 839' ' ' LEU . . . . . 0.435 HD22 ' HA ' ' A' ' 839' ' ' LEU . 0.6 OUTLIER -69.91 -49.15 54.88 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.077 -176.104 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 840' ' ' LEU . . . . . 0.479 HD11 ' CG2' ' A' ' 829' ' ' VAL . 2.6 pp -74.26 -31.44 62.55 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.405 -178.199 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -68.93 -35.21 76.53 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.941 0.401 . . . . 0.0 110.398 177.11 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 842' ' ' ASP . . . . . 0.404 ' HB2' ' O ' ' A' ' 838' ' ' ARG . 0.3 OUTLIER -63.5 -36.66 84.49 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.885 176.064 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 843' ' ' GLN . . . . . 0.734 ' HG3' HD23 ' A' ' 929' ' ' LEU . 2.5 mm-40 -68.44 -39.79 81.36 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.494 -0.775 . . . . 0.0 109.991 176.903 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 844' ' ' LEU . . . . . 0.585 ' HA ' HD12 ' A' ' 847' ' ' LEU . 0.3 OUTLIER -59.15 -43.46 92.06 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.273 176.579 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -61.92 -35.13 90.92 Favored Glycine 0 N--CA 1.451 -0.316 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.003 176.594 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 846' ' ' SER . . . . . 0.626 ' HA ' ' O ' ' A' ' 705' ' ' SER . 29.3 m -71.47 -17.26 62.37 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.792 0.33 . . . . 0.0 111.167 178.401 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 847' ' ' LEU . . . . . 0.585 HD12 ' HA ' ' A' ' 844' ' ' LEU . 44.3 mt -83.22 -18.39 39.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.374 175.312 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 88.97 30.02 15.99 Favored Glycine 0 C--N 1.33 0.213 0 C-N-CA 121.042 -0.599 . . . . 0.0 112.924 177.375 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 849' ' ' TYR . . . . . 0.424 ' HB2' HD23 ' A' ' 844' ' ' LEU . 27.1 m-85 -119.31 160.19 22.71 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 179.149 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.82 109.51 19.33 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.196 0.522 . . . . 0.0 111.085 -177.614 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 851' ' ' CYS . . . . . 0.503 ' HA ' ' O ' ' A' ' 827' ' ' ILE . 0.0 OUTLIER -93.39 151.79 19.53 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.996 179.97 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.92 109.94 13.63 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.517 173.646 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 853' ' ' THR . . . . . 0.428 HG22 ' CG ' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -94.43 124.07 38.23 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -171.189 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 854' ' ' ALA . . . . . 0.774 ' HB3' HG22 ' A' ' 830' ' ' VAL . . . -137.65 155.58 48.99 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.479 175.881 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -134.39 75.35 1.58 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 856' ' ' ASP . . . . . 0.62 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 26.8 t70 170.6 143.84 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.681 179.627 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -70.63 -37.42 67.82 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 121.038 -0.601 . . . . 0.0 113.148 -177.114 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -73.71 -31.54 32.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.846 0.355 . . . . 0.0 110.217 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 859' ' ' ASP . . . . . 0.62 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 1.0 OUTLIER -58.99 -29.21 67.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.764 177.275 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 860' ' ' ALA . . . . . 0.4 ' O ' ' HB2' ' A' ' 864' ' ' LEU . . . -63.76 -42.47 97.82 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.961 0.41 . . . . 0.0 110.495 177.018 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 861' ' ' LEU . . . . . 0.533 HD22 ' HA ' ' A' ' 861' ' ' LEU . 0.2 OUTLIER -71.14 -33.52 70.16 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.999 178.17 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -63.98 -52.23 60.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.602 179.072 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 9.4 p -69.14 -32.69 55.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.023 -177.742 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 864' ' ' LEU . . . . . 0.783 HD21 HD11 ' A' ' 897' ' ' LEU . 0.2 OUTLIER -61.3 -39.02 88.92 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.051 0.453 . . . . 0.0 110.571 177.984 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 11.0 m -82.14 -20.89 37.04 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.986 -178.49 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.8 -46.34 17.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.451 -179.607 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -150.5 138.92 20.46 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 177.729 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 18.3 m80 -86.7 88.66 7.72 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.301 0.572 . . . . 0.0 111.773 -172.845 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 869' ' ' ILE . . . . . 0.698 HD13 HD22 ' A' ' 828' ' ' LEU . 0.8 OUTLIER -69.48 154.74 8.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.301 173.22 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.03 -34.37 15.15 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -169.692 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 871' ' ' ILE . . . . . . . . . . . . . 2.2 mt -130.37 136.01 59.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 O-C-N 122.208 -0.308 . . . . 0.0 110.721 -179.165 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 872' ' ' VAL . . . . . 0.852 ' HB ' ' HB ' ' A' ' 899' ' ' VAL . 2.2 t -103.38 126.2 57.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.425 -178.092 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 873' ' ' LEU . . . . . 0.562 ' HB2' ' HA ' ' A' ' 829' ' ' VAL . 13.0 mt -104.03 99.82 9.57 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 170.904 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -106.05 96.95 6.84 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.581 0.229 . . . . 0.0 110.645 -178.723 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 875' ' ' ASP . . . . . 0.527 ' HA ' ' HB ' ' A' ' 902' ' ' VAL . 10.2 t0 -109.26 110.69 21.94 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.395 -177.245 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 876' ' ' VAL . . . . . 0.44 ' HA ' ' HB2' ' A' ' 832' ' ' ASP . 0.2 OUTLIER -108.01 155.19 8.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.22 0.533 . . . . 0.0 111.538 -175.884 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -115.63 -65.75 1.16 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.476 176.031 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 2.5 ttm . . . . . 0 CA--C 1.538 0.491 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 177.062 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 0.332 0 N-CA-C 114.005 0.362 . . . . 0.0 114.005 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 884' ' ' TYR . . . . . 0.448 ' H ' ' H ' ' A' ' 885' ' ' ARG . 0.6 OUTLIER -168.06 -8.58 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.842 0.353 . . . . 0.0 110.6 178.512 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 885' ' ' ARG . . . . . 0.448 ' H ' ' H ' ' A' ' 884' ' ' TYR . 5.8 tmm_? -63.51 -44.15 95.13 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.311 -176.141 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 886' ' ' LEU . . . . . 0.636 HD13 ' H ' ' A' ' 887' ' ' THR . 0.0 OUTLIER -68.72 -29.25 67.64 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.149 -177.796 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 887' ' ' THR . . . . . 0.636 ' H ' HD13 ' A' ' 886' ' ' LEU . 0.2 OUTLIER -72.33 -43.58 63.91 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 120.942 0.401 . . . . 0.0 110.409 176.863 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -59.53 -40.78 88.27 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.343 177.388 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.68 -34.78 62.74 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.355 -178.648 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 890' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -73.32 -36.72 49.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 120.9 -0.32 . . . . 0.0 110.904 -179.712 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 891' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -75.57 -25.26 56.91 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.969 0.414 . . . . 0.0 110.097 176.799 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -71.01 -45.41 63.99 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.209 175.514 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 4.4 tp -68.08 -45.81 72.77 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.571 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 125.49 66.41 0.18 Allowed Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.155 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 895' ' ' LEU . . . . . 0.528 ' O ' ' HG ' ' A' ' 895' ' ' LEU . 0.0 OUTLIER -55.52 121.6 9.41 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.18 0.514 . . . . 0.0 110.204 176.599 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -123.12 17.8 9.97 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.323 0.582 . . . . 0.0 111.021 -176.889 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 897' ' ' LEU . . . . . 0.783 HD11 HD21 ' A' ' 864' ' ' LEU . 0.0 OUTLIER -144.03 138.54 15.09 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.203 -177.003 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 898' ' ' PRO . . . . . 0.472 ' HD3' ' HA ' ' A' ' 897' ' ' LEU . 33.1 Cg_exo -61.43 140.78 89.59 Favored 'Trans proline' 0 C--O 1.237 0.427 0 C-N-CA 122.709 2.273 . . . . 0.0 112.191 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 899' ' ' VAL . . . . . 0.877 HG13 ' HA ' ' A' ' 919' ' ' MET . 0.2 OUTLIER -128.88 138.42 54.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.655 0.74 . . . . 0.0 110.94 -178.425 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 900' ' ' ILE . . . . . 0.608 HG23 ' HB2' ' A' ' 921' ' ' SER . 4.1 mt -91.15 114.29 28.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 115.33 -0.85 . . . . 0.0 109.905 177.675 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 901' ' ' GLY . . . . . 0.518 ' O ' ' HA ' ' A' ' 922' ' ' CYS . . . -84.52 106.66 2.94 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.266 -179.201 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 902' ' ' VAL . . . . . 0.527 ' HB ' ' HA ' ' A' ' 875' ' ' ASP . 1.1 t -110.07 140.04 30.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 903' ' ' THR . . . . . 0.417 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.0 OUTLIER -150.82 150.03 30.44 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 110.267 -0.271 . . . . 0.0 110.267 176.542 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 904' ' ' ALA . . . . . 0.527 ' HB2' ' HD2' ' A' ' 925' ' ' LYS . . . -69.79 114.54 8.08 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 169.818 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -54.7 106.45 0.21 Allowed 'General case' 0 CA--C 1.513 -0.453 0 CA-C-O 121.539 0.685 . . . . 0.0 110.64 -174.427 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 906' ' ' ALA . . . . . 0.573 ' O ' ' HB2' ' A' ' 907' ' ' LEU . . . -120.8 -81.64 0.64 Allowed 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 114.851 -1.068 . . . . 0.0 110.109 -175.464 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 907' ' ' LEU . . . . . 0.573 ' HB2' ' O ' ' A' ' 906' ' ' ALA . 0.4 OUTLIER 160.24 137.87 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.475 -1.239 . . . . 0.0 108.496 -176.692 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . 74.69 -50.72 0.67 Allowed 'General case' 0 N--CA 1.467 0.391 0 O-C-N 123.788 0.68 . . . . 0.0 111.977 175.483 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.98 -38.8 92.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.119 0.485 . . . . 0.0 111.027 179.7 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 910' ' ' GLU . . . . . 0.458 ' H ' ' HG3' ' A' ' 910' ' ' GLU . 0.5 OUTLIER -67.15 -29.12 68.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.449 0.642 . . . . 0.0 109.496 175.581 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 1.4 ttpm? -77.69 -15.94 58.83 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.315 178.393 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -75.59 -37.53 59.8 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 173.266 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.49 -40.46 87.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.672 172.582 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 70.8 m -71.54 -26.5 62.67 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.156 176.664 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.6 -44.6 70.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.643 -179.809 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -77.85 -48.11 17.25 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.059 178.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.8 25.92 3.23 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.066 0.546 . . . . 0.0 111.776 -175.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -98.62 24.02 33.82 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.156 -178.017 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 919' ' ' MET . . . . . 0.877 ' HA ' HG13 ' A' ' 899' ' ' VAL . 1.5 mpt? -112.44 -86.19 0.56 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 110.162 -0.31 . . . . 0.0 110.162 -179.396 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 920' ' ' ASP . . . . . 0.595 ' HB2' ' O ' ' A' ' 919' ' ' MET . 8.4 t70 160.38 -73.17 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.449 0 O-C-N 124.614 1.196 . . . . 0.0 109.357 175.549 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 921' ' ' SER . . . . . 0.608 ' HB2' HG23 ' A' ' 900' ' ' ILE . 0.1 OUTLIER -90.77 172.97 8.27 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.077 -173.993 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 922' ' ' CYS . . . . . 0.518 ' HA ' ' O ' ' A' ' 901' ' ' GLY . 0.1 OUTLIER -149.73 121.33 8.01 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.485 177.794 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 923' ' ' LEU . . . . . 0.402 HD12 HG13 ' A' ' 902' ' ' VAL . 0.0 OUTLIER -143.7 173.04 12.02 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.894 0.378 . . . . 0.0 110.31 175.138 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 924' ' ' SER . . . . . 0.417 ' HA ' ' O ' ' A' ' 903' ' ' THR . 1.8 m -94.52 153.29 17.97 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.436 179.255 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 925' ' ' LYS . . . . . 0.527 ' HD2' ' HB2' ' A' ' 904' ' ' ALA . 25.8 tttp -46.93 -48.99 51.42 Favored Pre-proline 0 CA--C 1.538 0.519 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -178.753 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 926' ' ' PRO . . . . . 0.421 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 50.2 Cg_endo -69.67 72.52 1.39 Allowed 'Trans proline' 0 C--N 1.355 0.901 0 C-N-CA 121.634 1.556 . . . . 0.0 112.815 177.257 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 34.2 t -79.62 119.19 28.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.428 177.684 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 928' ' ' THR . . . . . 0.466 ' O ' HG22 ' A' ' 932' ' ' ILE . 0.0 OUTLIER -72.42 156.55 38.94 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.228 179.655 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 929' ' ' LEU . . . . . 0.734 HD23 ' HG3' ' A' ' 843' ' ' GLN . 1.4 tm? -56.57 -46.05 80.97 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.631 -176.874 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -67.43 -33.09 74.44 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.372 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 54.0 t -70.08 -49.23 57.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.876 -177.86 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 932' ' ' ILE . . . . . 0.466 HG22 ' O ' ' A' ' 928' ' ' THR . 0.8 OUTLIER -61.1 -39.59 82.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 178.861 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 2.4 tmmt? -61.93 -48.79 78.85 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.894 178.43 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 -66.16 -48.22 71.48 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.487 -177.081 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 4.3 m -61.85 -44.16 97.38 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.165 -178.684 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 936' ' ' LEU . . . . . 0.462 ' HB2' ' O ' ' A' ' 932' ' ' ILE . 0.7 OUTLIER -64.59 -41.73 96.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.513 179.527 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 86.4 m -62.36 -44.43 96.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.977 0.418 . . . . 0.0 110.819 178.432 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -64.98 -44.32 89.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.406 -177.776 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 939' ' ' TYR . . . . . 0.418 ' HA ' ' HB3' ' A' ' 942' ' ' ARG . 19.5 m-85 -76.64 -28.57 56.09 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.414 -177.458 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -66.71 -41.51 87.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.899 0.381 . . . . 0.0 110.179 175.248 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 941' ' ' GLU . . . . . 0.523 ' HA ' ' HB2' ' A' ' 944' ' ' ARG . 7.4 pt-20 -75.55 -22.1 57.34 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.347 177.949 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 942' ' ' ARG . . . . . 0.418 ' HB3' ' HA ' ' A' ' 939' ' ' TYR . 0.0 OUTLIER -66.28 -48.01 71.78 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.259 175.604 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 12.7 m -74.41 -30.93 26.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.892 0.377 . . . . 0.0 110.342 178.05 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 944' ' ' ARG . . . . . 0.523 ' HB2' ' HA ' ' A' ' 941' ' ' GLU . 0.8 OUTLIER -65.83 -31.94 73.19 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.002 177.928 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -87.73 -15.35 37.31 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.692 0.282 . . . . 0.0 110.623 177.11 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 53.2 m -72.52 -45.27 60.11 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.904 0.383 . . . . 0.0 110.053 174.594 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 2.9 ttp85 -78.07 -31.68 50.37 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 174.236 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 36.5 t70 . . . . . 0 C--O 1.233 0.235 0 CA-C-N 114.751 -1.113 . . . . 0.0 111.272 179.029 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 705' ' ' SER . . . . . 0.584 ' HA ' ' HA3' ' A' ' 730' ' ' GLY . 4.6 m . . . . . 0 N--CA 1.451 -0.392 0 CA-C-O 121.449 0.642 . . . . 0.0 109.444 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . -145.42 43.94 0.9 Allowed Glycine 0 N--CA 1.447 -0.596 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.617 -176.562 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 707' ' ' LYS . . . . . 0.559 ' HE3' ' HD1' ' A' ' 799' ' ' TYR . 1.2 mmtt -133.99 143.92 48.43 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 178.201 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 708' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.06 152.82 20.53 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.246 0.546 . . . . 0.0 110.993 -177.566 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 709' ' ' CYS . . . . . 0.501 ' SG ' HD13 ' A' ' 726' ' ' LEU . 0.1 OUTLIER -131.59 112.36 12.54 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.766 175.482 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 710' ' ' TRP . . . . . 0.64 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 84.5 m95 -92.51 121.12 33.66 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.431 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 711' ' ' LEU . . . . . 0.518 HD12 ' SG ' ' A' ' 719' ' ' CYS . 2.4 pt? -128.77 131.15 47.81 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.528 0.68 . . . . 0.0 111.297 -177.02 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -127.43 66.34 1.31 Allowed 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.876 177.083 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 713' ' ' VAL . . . . . 0.815 HG13 ' HB3' ' A' ' 750' ' ' ASP . 45.9 t -113.85 130.09 68.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.109 -179.015 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 714' ' ' ARG . . . . . 0.485 ' HD2' ' OD2' ' A' ' 750' ' ' ASP . 20.6 mtt180 -81.37 -13.42 58.35 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.209 -177.536 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 715' ' ' ASN . . . . . 0.643 ' H ' HG12 ' A' ' 713' ' ' VAL . 0.6 OUTLIER -87.4 122.2 30.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.411 178.098 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -70.59 -35.65 73.14 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.74 -176.199 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.18 -54.41 47.23 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.115 0.483 . . . . 0.0 110.244 177.502 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 718' ' ' LEU . . . . . 0.494 HD21 ' CE1' ' A' ' 765' ' ' PHE . 0.8 OUTLIER -61.99 -49.38 76.29 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.763 -179.499 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 719' ' ' CYS . . . . . 0.759 ' SG ' ' HB ' ' A' ' 713' ' ' VAL . 0.7 OUTLIER -59.31 -53.08 62.3 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.205 -177.287 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 720' ' ' GLN . . . . . 0.478 ' O ' ' HG3' ' A' ' 723' ' ' GLU . 48.0 tt0 -65.28 -44.34 88.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.798 -174.962 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -56.52 -48.81 76.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.822 0.344 . . . . 0.0 110.954 -176.979 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 76.3 mt -68.35 -48.12 65.65 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.09 -178.731 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 723' ' ' GLU . . . . . 0.724 ' HB2' HG21 ' A' ' 733' ' ' VAL . 0.0 OUTLIER -62.15 -42.73 99.53 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 111.705 0.261 . . . . 0.0 111.705 -174.092 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 724' ' ' THR . . . . . . . . . . . . . 27.8 m -69.08 -37.52 78.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.837 0.351 . . . . 0.0 111.022 -179.133 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 23.8 m -67.76 -37.88 82.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.804 0.335 . . . . 0.0 111.151 178.916 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 726' ' ' LEU . . . . . 0.785 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 18.4 mt -75.15 -38.57 60.9 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.998 0.428 . . . . 0.0 111.101 -178.874 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -74.47 -4.3 35.91 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.148 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.78 -44.11 94.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.277 -0.42 . . . . 0.0 109.95 174.988 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -80.67 -68.76 0.65 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.068 175.604 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 730' ' ' GLY . . . . . 0.584 ' HA3' ' HA ' ' A' ' 705' ' ' SER . . . 172.28 26.07 0.02 OUTLIER Glycine 0 N--CA 1.442 -0.919 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.942 176.051 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 731' ' ' ILE . . . . . 0.785 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 13.5 mm -84.09 91.49 2.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 177.763 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 732' ' ' VAL . . . . . . . . . . . . . 1.8 p -67.46 120.71 15.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.601 0.715 . . . . 0.0 111.173 -176.789 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 733' ' ' VAL . . . . . 0.724 HG21 ' HB2' ' A' ' 723' ' ' GLU . 4.3 m -91.32 147.63 5.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.087 -178.028 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 734' ' ' THR . . . . . 0.445 ' HB ' ' CZ3' ' A' ' 710' ' ' TRP . 0.1 OUTLIER -143.61 138.44 29.02 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.767 178.309 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.25 110.91 1.17 Allowed 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.788 176.46 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 736' ' ' TYR . . . . . 0.64 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 46.2 t80 -80.52 93.17 6.0 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.371 0.605 . . . . 0.0 110.175 178.158 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -97.21 -30.85 12.75 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.763 177.649 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 162.64 56.78 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 111.019 -0.832 . . . . 0.0 111.019 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 739' ' ' GLN . . . . . 0.492 ' HB3' ' H ' ' A' ' 740' ' ' GLU . 15.2 mp0 -101.99 -144.95 0.35 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.91 0.386 . . . . 0.0 111.728 -172.425 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 740' ' ' GLU . . . . . 0.492 ' H ' ' HB3' ' A' ' 739' ' ' GLN . 2.3 pt-20 -106.02 125.11 33.92 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.117 -173.609 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 741' ' ' PRO . . . . . 0.556 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 73.4 Cg_endo -78.5 123.34 5.92 Favored 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 122.471 2.114 . . . . 0.0 112.267 175.487 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 742' ' ' THR . . . . . 0.605 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.2 OUTLIER -118.84 141.8 30.72 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.589 178.506 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 743' ' ' PRO . . . . . 0.605 ' HD2' HG22 ' A' ' 742' ' ' THR . 34.7 Cg_endo -65.55 -1.38 4.72 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 123.314 2.676 . . . . 0.0 113.032 179.036 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -103.34 -8.48 20.24 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.245 0.545 . . . . 0.0 110.4 177.796 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -112.75 153.1 28.3 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.744 -171.006 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 746' ' ' VAL . . . . . 0.48 ' HA ' ' O ' ' A' ' 761' ' ' ALA . 8.3 m -116.94 147.92 20.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.817 178.353 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 747' ' ' LEU . . . . . 0.434 HD23 ' HA ' ' A' ' 747' ' ' LEU . 0.0 OUTLIER -107.86 104.61 14.12 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.372 179.933 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -99.49 111.89 30.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 177.875 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 14.0 p -124.09 156.22 36.98 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.896 0.379 . . . . 0.0 111.418 -175.326 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 750' ' ' ASP . . . . . 0.815 ' HB3' HG13 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -109.16 130.77 55.48 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 168.464 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 751' ' ' GLU . . . . . 0.43 ' HG3' ' N ' ' A' ' 752' ' ' VAL . 4.4 tp10 72.86 153.25 0.13 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.188 -167.76 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 752' ' ' VAL . . . . . 0.847 HG22 ' HB ' ' A' ' 772' ' ' ILE . 1.4 t -70.82 123.5 25.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.63 -178.401 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 11.1 m -101.32 155.09 4.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.563 -179.372 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -83.24 75.15 9.97 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.061 178.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -154.24 127.3 8.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.066 0.46 . . . . 0.0 111.568 -175.91 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.96 81.2 4.59 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 169.915 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 757' ' ' TRP . . . . . 0.556 ' CH2' ' HA ' ' A' ' 741' ' ' PRO . 70.7 t-105 -68.24 100.64 1.06 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.759 -177.649 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.39 49.15 0.99 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.38 0.61 . . . . 0.0 109.805 178.659 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 759' ' ' GLY . . . . . 0.45 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -104.13 -131.34 7.15 Favored Glycine 0 N--CA 1.444 -0.768 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.396 178.827 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 2.9 ttm-85 -79.83 -50.41 10.56 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.102 177.128 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 761' ' ' ALA . . . . . 0.48 ' O ' ' HA ' ' A' ' 746' ' ' VAL . . . -166.93 157.87 12.07 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.256 179.065 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 762' ' ' VAL . . . . . 0.544 HG13 ' HA ' ' A' ' 780' ' ' GLU . 1.4 p -133.91 122.8 43.16 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 176.604 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 763' ' ' VAL . . . . . 0.489 HG11 HD21 ' A' ' 791' ' ' LEU . 41.8 t -114.71 115.11 48.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.291 -0.413 . . . . 0.0 109.904 -178.284 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 764' ' ' THR . . . . . 0.586 HG22 ' HB2' ' A' ' 766' ' ' CYS . 34.2 m -112.2 119.09 37.17 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.246 0.546 . . . . 0.0 111.321 -178.321 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 765' ' ' PHE . . . . . 0.612 ' HA ' ' O ' ' A' ' 783' ' ' HIS . 91.3 m-85 -84.06 98.0 9.62 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.372 175.163 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 766' ' ' CYS . . . . . 0.586 ' HB2' HG22 ' A' ' 764' ' ' THR . 1.7 t -140.04 141.35 36.27 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -172.807 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 767' ' ' ARG . . . . . 0.505 ' HE ' ' HB3' ' A' ' 767' ' ' ARG . 0.0 OUTLIER -104.29 -31.03 9.76 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.026 174.654 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 768' ' ' ARG . . . . . 0.407 HH11 ' HD2' ' A' ' 768' ' ' ARG . 0.0 OUTLIER -83.92 -50.86 7.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.194 177.401 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 769' ' ' HIS . . . . . 0.572 ' HA ' ' CG2' ' A' ' 752' ' ' VAL . 12.3 p-80 46.93 88.22 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.331 1.052 . . . . 0.0 113.037 177.484 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 6.1 mt -78.05 -74.21 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.919 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 771' ' ' GLY . . . . . 0.679 ' H ' HG11 ' A' ' 752' ' ' VAL . . . -111.85 7.91 27.62 Favored Glycine 0 C--N 1.332 0.317 0 C-N-CA 120.485 -0.864 . . . . 0.0 114.375 -170.929 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 772' ' ' ILE . . . . . 0.847 ' HB ' HG22 ' A' ' 752' ' ' VAL . 43.2 mm -105.0 115.58 62.16 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 117.647 0.724 . . . . 0.0 110.397 176.307 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 773' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -90.63 -170.41 0.38 Allowed 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 123.769 2.98 . . . . 0.0 112.465 176.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 774' ' ' LEU . . . . . 0.459 ' HA ' HG22 ' A' ' 782' ' ' VAL . 1.0 OUTLIER -95.32 -158.22 0.63 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.509 178.041 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 775' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 0.3 OUTLIER -66.49 61.92 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -179.085 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -121.56 22.15 10.71 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 167.859 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 777' ' ' ALA . . . . . 0.851 ' HB1' ' HD2' ' A' ' 778' ' ' PRO . . . -148.47 176.31 2.3 Favored Pre-proline 0 N--CA 1.451 -0.399 0 CA-C-N 113.611 -1.632 . . . . 0.0 108.794 -175.39 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 778' ' ' PRO . . . . . 0.851 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 51.8 Cg_endo -68.65 61.96 1.2 Allowed 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 122.702 2.268 . . . . 0.0 114.176 -178.807 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 102.02 22.26 10.2 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.611 -0.804 . . . . 0.0 113.764 173.208 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 780' ' ' GLU . . . . . 0.584 ' HB2' ' HB3' ' A' ' 777' ' ' ALA . 0.3 OUTLIER -79.57 125.28 29.39 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 117.111 0.456 . . . . 0.0 110.564 178.213 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 20.3 m95 -130.12 115.62 17.32 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.65 0.262 . . . . 0.0 110.429 179.0 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 782' ' ' VAL . . . . . 0.459 HG22 ' HA ' ' A' ' 774' ' ' LEU . 0.1 OUTLIER -103.04 136.02 37.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 110.176 -0.305 . . . . 0.0 110.176 175.263 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 783' ' ' HIS . . . . . 0.612 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.2 OUTLIER -152.1 132.93 14.11 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.725 0.298 . . . . 0.0 110.827 179.202 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -99.44 100.24 11.26 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.982 0.42 . . . . 0.0 110.176 174.121 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -164.56 178.92 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.764 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -111.51 28.95 8.27 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.94 0.4 . . . . 0.0 110.187 175.106 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 57.82 70.54 1.26 Allowed Pre-proline 0 N--CA 1.465 0.285 0 CA-C-N 115.32 -0.855 . . . . 0.0 111.278 -178.532 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 788' ' ' PRO . . . . . 0.458 ' HB2' ' H ' ' A' ' 789' ' ' HIS . 5.3 Cg_exo -77.09 -96.34 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.724 2.283 . . . . 0.0 112.438 -178.34 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 789' ' ' HIS . . . . . 0.458 ' H ' ' HB2' ' A' ' 788' ' ' PRO . 0.1 OUTLIER -124.11 2.94 8.62 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.964 0.411 . . . . 0.0 111.717 -178.319 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 790' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -104.38 -46.66 4.33 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.669 -175.073 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 791' ' ' LEU . . . . . 0.588 ' HG ' ' CZ ' ' A' ' 765' ' ' PHE . 0.4 OUTLIER -62.91 -51.23 72.73 Favored Pre-proline 0 C--N 1.327 -0.382 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -178.803 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 792' ' ' PRO . . . . . 0.427 ' HD3' ' HB3' ' A' ' 791' ' ' LEU . 24.5 Cg_exo -60.95 -30.59 90.22 Favored 'Trans proline' 0 C--N 1.354 0.836 0 C-N-CA 121.445 1.43 . . . . 0.0 111.626 179.747 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -68.98 -45.49 70.5 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.413 176.716 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 794' ' ' LEU . . . . . 0.444 HD22 ' HA ' ' A' ' 794' ' ' LEU . 0.2 OUTLIER -63.78 -36.58 84.36 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.687 179.437 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 795' ' ' LEU . . . . . 0.443 HD22 ' HA ' ' A' ' 795' ' ' LEU . 0.4 OUTLIER -63.56 -47.61 80.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.771 179.622 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -66.14 -33.6 76.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.105 179.196 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 1.5 ttt-85 -71.05 -37.12 72.53 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.889 179.611 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -69.53 -31.45 49.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.827 -178.987 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 799' ' ' TYR . . . . . 0.559 ' HD1' ' HE3' ' A' ' 707' ' ' LYS . 17.3 m-85 -85.39 -0.43 54.82 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.578 178.958 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 47.7 mt . . . . . 0 N--CA 1.463 0.216 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.337 178.438 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.16 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 825' ' ' MET . . . . . 0.543 ' O ' ' HB2' ' A' ' 850' ' ' GLN . 0.1 OUTLIER -127.83 106.66 9.27 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.979 -176.767 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 826' ' ' MET . . . . . 0.489 ' HG2' ' H ' ' A' ' 826' ' ' MET . 0.0 OUTLIER -97.84 108.86 21.66 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.301 0.572 . . . . 0.0 111.3 -177.042 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 827' ' ' ILE . . . . . 0.49 HG23 ' HB ' ' A' ' 871' ' ' ILE . 9.6 mm -107.52 136.13 43.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.312 175.755 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 828' ' ' LEU . . . . . 0.607 HD23 HG13 ' A' ' 872' ' ' VAL . 46.2 tp -106.17 122.61 46.56 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.994 0.425 . . . . 0.0 110.541 -176.599 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 829' ' ' VAL . . . . . 0.632 ' HB ' ' HD2' ' A' ' 837' ' ' ARG . 0.8 OUTLIER -113.38 111.55 36.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.19 -179.361 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 830' ' ' VAL . . . . . 0.621 HG22 ' HB3' ' A' ' 854' ' ' ALA . 12.7 t -117.37 129.27 74.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.335 -179.435 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 831' ' ' ASP . . . . . 0.752 ' HB2' ' NE ' ' A' ' 837' ' ' ARG . 9.1 t0 -134.61 142.54 46.94 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 173.028 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 832' ' ' ASP . . . . . 0.425 ' HB2' ' HB2' ' A' ' 878' ' ' MET . 4.8 p-10 -65.98 -15.1 62.71 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.132 0.492 . . . . 0.0 110.432 174.108 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 833' ' ' HIS . . . . . 0.408 ' HA ' ' HD2' ' A' ' 834' ' ' PRO . 22.1 m170 -117.41 104.99 49.21 Favored Pre-proline 0 C--O 1.234 0.268 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.486 171.246 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 834' ' ' PRO . . . . . 0.408 ' HD2' ' HA ' ' A' ' 833' ' ' HIS . 19.7 Cg_endo -57.67 -35.77 98.7 Favored 'Trans proline' 0 CA--C 1.532 0.392 0 C-N-CA 123.184 2.589 . . . . 0.0 113.799 -173.388 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 835' ' ' ILE . . . . . 0.519 ' O ' ' HG3' ' A' ' 838' ' ' ARG . 0.0 OUTLIER -59.55 -44.38 93.0 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-O 121.006 0.432 . . . . 0.0 111.199 -177.737 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 836' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -65.41 -40.09 92.95 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.248 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 837' ' ' ARG . . . . . 0.752 ' NE ' ' HB2' ' A' ' 831' ' ' ASP . 0.0 OUTLIER -64.97 -46.99 79.21 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.675 -177.028 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 838' ' ' ARG . . . . . 0.519 ' HG3' ' O ' ' A' ' 835' ' ' ILE . 0.3 OUTLIER -65.87 -29.13 69.53 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.839 0.352 . . . . 0.0 110.962 -179.28 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 8.5 mt -66.41 -52.56 45.31 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.944 -179.39 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 840' ' ' LEU . . . . . 0.462 HD11 ' HD3' ' A' ' 837' ' ' ARG . 1.2 pp -72.68 -26.66 61.7 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.588 179.247 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -65.58 -33.28 75.55 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.008 0.433 . . . . 0.0 110.202 174.898 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -63.14 -43.5 98.2 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.045 175.53 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 843' ' ' GLN . . . . . . . . . . . . . 45.2 mm-40 -64.29 -39.73 94.52 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.387 176.565 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 844' ' ' LEU . . . . . 0.598 HD13 ' HB2' ' A' ' 849' ' ' TYR . 0.0 OUTLIER -61.15 -34.96 75.86 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.578 176.575 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -62.41 -39.0 97.22 Favored Glycine 0 N--CA 1.445 -0.72 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.003 176.465 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -70.32 -23.25 62.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.92 0.391 . . . . 0.0 110.985 176.514 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 847' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' A' ' 847' ' ' LEU . 5.4 mt -78.81 -21.47 47.69 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.885 0.374 . . . . 0.0 111.127 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 102.21 12.15 34.55 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.662 -0.78 . . . . 0.0 113.545 174.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 849' ' ' TYR . . . . . 0.598 ' HB2' HD13 ' A' ' 844' ' ' LEU . 66.6 m-85 -104.68 138.4 41.04 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.958 0.379 . . . . 0.0 109.986 178.658 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 850' ' ' GLN . . . . . 0.543 ' HB2' ' O ' ' A' ' 825' ' ' MET . 4.7 mp0 -73.03 121.08 19.57 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 179.275 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 851' ' ' CYS . . . . . 0.471 ' SG ' ' HB3' ' A' ' 844' ' ' LEU . 0.0 OUTLIER -108.13 126.83 53.23 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 120.988 0.423 . . . . 0.0 111.607 -173.884 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 852' ' ' LYS . . . . . 0.422 ' O ' HD12 ' A' ' 828' ' ' LEU . 0.0 OUTLIER -106.36 111.76 24.48 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 174.797 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 853' ' ' THR . . . . . 0.468 ' HA ' HG23 ' A' ' 829' ' ' VAL . 0.9 OUTLIER -91.18 124.58 35.5 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 120.93 0.395 . . . . 0.0 111.451 -174.632 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 854' ' ' ALA . . . . . 0.621 ' HB3' HG22 ' A' ' 830' ' ' VAL . . . -130.11 142.28 50.61 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.961 -179.681 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 855' ' ' ASN . . . . . 0.56 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 20.2 t30 -124.22 74.99 1.34 Allowed 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 177.026 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 856' ' ' ASP . . . . . 0.743 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 12.0 t70 166.14 147.37 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.036 177.043 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -71.9 -41.91 54.13 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.566 178.911 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 2.0 t -73.7 -34.7 41.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.077 0.465 . . . . 0.0 110.598 -178.363 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 859' ' ' ASP . . . . . 0.743 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 1.1 t0 -64.27 -27.74 69.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.939 -178.867 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -62.14 -38.39 88.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.139 0.495 . . . . 0.0 110.352 176.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 861' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.14 -33.01 63.39 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.93 176.933 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -60.56 -53.76 53.64 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.858 178.884 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 10.7 p -66.01 -32.21 57.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.769 0.318 . . . . 0.0 110.945 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 864' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.99 -40.46 97.82 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.565 176.578 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 7.4 m -74.31 -27.28 60.64 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.862 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 866' ' ' LYS . . . . . 0.536 ' HA ' ' HD2' ' A' ' 866' ' ' LYS . 1.3 tptm -69.79 -55.85 8.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.716 179.532 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 867' ' ' ASN . . . . . 0.482 ' HB3' ' H ' ' A' ' 868' ' ' HIS . 6.0 t30 -119.15 -105.5 0.39 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.905 178.904 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 868' ' ' HIS . . . . . 0.482 ' H ' ' HB3' ' A' ' 867' ' ' ASN . 0.1 OUTLIER 178.93 155.54 0.45 Allowed 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 178.571 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 869' ' ' ILE . . . . . 0.452 HG12 ' HB2' ' A' ' 828' ' ' LEU . 0.7 OUTLIER -143.25 147.98 19.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 -179.794 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.69 -49.98 5.13 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.694 0.283 . . . . 0.0 111.356 -178.998 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 871' ' ' ILE . . . . . 0.49 ' HB ' HG23 ' A' ' 827' ' ' ILE . 18.7 mm -111.54 123.98 67.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.272 -178.373 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 872' ' ' VAL . . . . . 0.607 HG13 HD23 ' A' ' 828' ' ' LEU . 1.8 t -109.52 125.92 66.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.217 -179.086 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 873' ' ' LEU . . . . . 0.698 HD11 HD12 ' A' ' 936' ' ' LEU . 47.3 mt -111.49 100.83 9.32 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 173.456 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 5.7 m -105.77 101.49 11.0 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.939 0.4 . . . . 0.0 111.22 -176.206 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 875' ' ' ASP . . . . . 0.673 ' OD1' ' HG2' ' A' ' 925' ' ' LYS . 0.6 OUTLIER -92.62 106.6 18.55 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.383 -179.517 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -115.45 111.99 37.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.314 0.578 . . . . 0.0 112.134 -172.25 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -119.65 -44.59 2.54 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.664 172.044 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 878' ' ' MET . . . . . 0.425 ' HB2' ' HB2' ' A' ' 832' ' ' ASP . 4.4 tpp . . . . . 0 CA--C 1.537 0.443 0 CA-C-N 115.559 -0.746 . . . . 0.0 112.699 -178.844 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 0.273 0 N-CA-C 112.047 -0.421 . . . . 0.0 112.047 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -137.22 -40.91 0.58 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -68.47 -47.33 67.39 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.677 -179.017 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 886' ' ' LEU . . . . . 0.647 ' HG ' ' N ' ' A' ' 887' ' ' THR . 0.0 OUTLIER -65.55 -43.55 89.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.646 -0.252 . . . . 0.0 110.384 -179.495 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 887' ' ' THR . . . . . 0.647 ' N ' ' HG ' ' A' ' 886' ' ' LEU . 0.0 OUTLIER -62.52 -44.89 95.25 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.218 0.532 . . . . 0.0 110.662 -179.483 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 888' ' ' GLN . . . . . 0.79 ' HA ' ' HD3' ' A' ' 891' ' ' ARG . 15.9 tt0 -63.47 -41.31 98.61 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.624 177.842 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -67.27 -41.66 85.13 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.192 0.441 . . . . 0.0 112.192 -175.185 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 890' ' ' ILE . . . . . 0.614 HG13 ' O ' ' A' ' 886' ' ' LEU . 22.2 mt -68.54 -42.63 83.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.881 -179.478 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 891' ' ' ARG . . . . . 0.79 ' HD3' ' HA ' ' A' ' 888' ' ' GLN . 0.7 OUTLIER -68.92 -23.93 64.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.032 0.444 . . . . 0.0 110.216 177.262 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 -71.18 -42.14 69.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.367 176.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 893' ' ' LEU . . . . . 0.493 HD22 ' HA ' ' A' ' 893' ' ' LEU . 0.2 OUTLIER -71.26 -32.8 69.14 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.183 179.071 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 115.66 87.5 1.41 Allowed Glycine 0 N--CA 1.441 -1.017 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.747 178.554 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 895' ' ' LEU . . . . . 0.524 HD12 HG22 ' A' ' 890' ' ' ILE . 0.3 OUTLIER -63.74 109.27 1.66 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.125 0.488 . . . . 0.0 110.602 177.781 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -120.77 16.95 11.9 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.805 0.812 . . . . 0.0 109.469 176.284 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 897' ' ' LEU . . . . . 0.463 HD12 HG21 ' A' ' 872' ' ' VAL . 0.0 OUTLIER -139.06 123.88 11.63 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 114.801 -1.09 . . . . 0.0 109.283 -176.665 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 898' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 897' ' ' LEU . 35.5 Cg_exo -59.28 121.41 9.86 Favored 'Trans proline' 0 C--O 1.238 0.494 0 C-N-CA 122.888 2.392 . . . . 0.0 112.305 -177.69 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 899' ' ' VAL . . . . . 0.558 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 26.5 t -98.36 108.68 22.45 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 CA-C-O 121.257 0.551 . . . . 0.0 110.639 -179.603 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 900' ' ' ILE . . . . . 0.421 HG23 ' HB2' ' A' ' 921' ' ' SER . 2.5 mt -84.41 92.42 3.11 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 175.445 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 901' ' ' GLY . . . . . 0.711 ' HA3' ' SD ' ' A' ' 919' ' ' MET . . . -83.4 122.41 5.77 Favored Glycine 0 N--CA 1.441 -1.026 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.075 -176.093 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 902' ' ' VAL . . . . . 0.682 ' HB ' ' HB2' ' A' ' 923' ' ' LEU . 0.2 OUTLIER -111.57 117.09 54.28 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 178.459 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 903' ' ' THR . . . . . 0.651 ' HB ' ' HB2' ' A' ' 906' ' ' ALA . 0.0 OUTLIER -107.64 148.88 28.77 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.917 -172.271 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 904' ' ' ALA . . . . . 0.66 ' HB2' ' HG3' ' A' ' 925' ' ' LYS . . . -90.51 134.51 34.31 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.494 175.538 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 53.69 43.26 31.34 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.298 179.627 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 906' ' ' ALA . . . . . 0.651 ' HB2' ' HB ' ' A' ' 903' ' ' THR . . . -92.25 93.76 8.82 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.059 177.245 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -52.33 -49.11 64.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.254 -178.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -127.06 88.56 2.83 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.103 176.564 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 909' ' ' GLU . . . . . 0.7 ' HB3' ' HB2' ' A' ' 922' ' ' CYS . 10.7 mt-10 -57.85 -34.97 70.28 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.179 -176.865 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 910' ' ' GLU . . . . . 0.529 ' H ' ' HG3' ' A' ' 910' ' ' GLU . 0.0 OUTLIER -58.78 -57.03 14.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.998 178.638 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 8.0 tttt -65.52 -27.93 68.82 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.197 179.334 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -62.91 -44.96 94.67 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 176.022 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 913' ' ' ARG . . . . . 0.508 ' HD2' ' O ' ' A' ' 913' ' ' ARG . 0.0 OUTLIER -65.63 -37.9 87.86 Favored 'General case' 0 C--O 1.225 -0.201 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.053 175.999 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 19.0 m -58.66 -37.16 75.39 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.871 0.367 . . . . 0.0 110.937 177.885 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.84 -51.23 42.69 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.755 -178.206 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 916' ' ' GLU . . . . . 0.446 ' OE2' ' HD3' ' A' ' 913' ' ' ARG . 0.0 OUTLIER -77.11 -42.64 37.18 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 111.627 0.232 . . . . 0.0 111.627 -175.219 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 1.4 m 53.06 52.15 14.35 Favored 'General case' 0 C--O 1.235 0.32 0 O-C-N 123.464 0.478 . . . . 0.0 112.149 -178.616 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -139.66 -32.8 0.17 Allowed Glycine 0 CA--C 1.523 0.578 0 C-N-CA 120.51 -0.853 . . . . 0.0 113.745 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 919' ' ' MET . . . . . 0.711 ' SD ' ' HA3' ' A' ' 901' ' ' GLY . 20.2 mtt -76.58 -93.54 0.03 OUTLIER 'General case' 0 C--O 1.238 0.488 0 CA-C-N 117.311 0.556 . . . . 0.0 112.171 -174.311 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 920' ' ' ASP . . . . . 0.52 ' HB2' ' O ' ' A' ' 919' ' ' MET . 45.0 t0 162.29 -73.16 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.191 0.996 . . . . 0.0 109.643 176.705 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 921' ' ' SER . . . . . 0.421 ' HB2' HG23 ' A' ' 900' ' ' ILE . 0.0 OUTLIER -105.91 172.02 7.03 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.054 -179.765 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 922' ' ' CYS . . . . . 0.7 ' HB2' ' HB3' ' A' ' 909' ' ' GLU . 0.8 OUTLIER -140.42 136.78 33.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.292 0.568 . . . . 0.0 111.881 -178.278 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 923' ' ' LEU . . . . . 0.682 ' HB2' ' HB ' ' A' ' 902' ' ' VAL . 0.3 OUTLIER -133.73 178.21 7.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.192 177.158 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -104.18 143.1 33.39 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.268 178.594 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 925' ' ' LYS . . . . . 0.673 ' HG2' ' OD1' ' A' ' 875' ' ' ASP . 0.0 OUTLIER -48.63 -43.5 63.11 Favored Pre-proline 0 N--CA 1.475 0.823 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -176.034 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 926' ' ' PRO . . . . . 0.514 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 37.7 Cg_endo -66.71 68.44 0.51 Allowed 'Trans proline' 0 C--N 1.356 0.929 0 C-N-CA 121.885 1.723 . . . . 0.0 112.998 175.441 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 927' ' ' VAL . . . . . 0.704 HG13 ' HB ' ' A' ' 931' ' ' VAL . 42.3 t -87.8 110.67 21.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.038 0.447 . . . . 0.0 110.425 177.225 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.36 167.49 20.16 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.29 176.074 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 929' ' ' LEU . . . . . 0.438 ' HA ' HG23 ' A' ' 932' ' ' ILE . 0.7 OUTLIER -54.62 -38.66 67.09 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.69 0.281 . . . . 0.0 111.604 -177.975 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -68.72 -23.35 64.34 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.854 0.359 . . . . 0.0 110.747 -177.651 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 931' ' ' VAL . . . . . 0.704 ' HB ' HG13 ' A' ' 927' ' ' VAL . 18.4 t -78.13 -41.57 26.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.418 179.062 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 932' ' ' ILE . . . . . 0.438 HG23 ' HA ' ' A' ' 929' ' ' LEU . 0.0 OUTLIER -66.64 -37.16 78.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 177.277 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -60.7 -49.05 79.08 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.439 -179.503 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 934' ' ' GLN . . . . . 0.453 ' HG3' ' H ' ' A' ' 935' ' ' THR . 0.3 OUTLIER -71.74 -48.96 43.45 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -175.941 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 935' ' ' THR . . . . . 0.453 ' H ' ' HG3' ' A' ' 934' ' ' GLN . 1.6 m -66.73 -43.4 84.32 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 111.828 0.307 . . . . 0.0 111.828 -174.363 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 936' ' ' LEU . . . . . 0.698 HD12 HD11 ' A' ' 873' ' ' LEU . 0.3 OUTLIER -66.23 -49.92 65.6 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.636 0.255 . . . . 0.0 110.812 -179.577 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 95.0 m -62.2 -46.06 90.61 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.25 -178.676 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 938' ' ' LEU . . . . . 0.466 ' O ' ' HB3' ' A' ' 942' ' ' ARG . 29.3 tp -62.82 -47.77 81.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.182 -178.46 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -69.26 -40.73 77.67 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.613 -0.267 . . . . 0.0 111.171 -177.097 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -66.36 -40.98 90.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.737 0.303 . . . . 0.0 111.006 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 941' ' ' GLU . . . . . 0.584 ' O ' ' HG3' ' A' ' 944' ' ' ARG . 0.0 OUTLIER -69.99 -33.8 72.51 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.87 0.366 . . . . 0.0 110.216 178.473 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 942' ' ' ARG . . . . . 0.466 ' HB3' ' O ' ' A' ' 938' ' ' LEU . 0.0 OUTLIER -66.84 -37.7 84.98 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.446 -178.511 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 943' ' ' VAL . . . . . 0.461 ' N ' ' HG3' ' A' ' 942' ' ' ARG . 17.1 m -78.08 -33.8 18.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.646 -0.422 . . . . 0.0 110.954 -177.496 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 944' ' ' ARG . . . . . 0.584 ' HG3' ' O ' ' A' ' 941' ' ' GLU . 0.2 OUTLIER -73.56 -21.63 60.3 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.32 177.42 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 16.0 mmtp -67.32 -52.4 40.79 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-O 121.33 0.586 . . . . 0.0 109.885 171.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 50.3 m -63.5 -44.32 94.67 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.123 -0.944 . . . . 0.0 111.428 -177.897 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -68.38 -60.94 2.07 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.77 -0.196 . . . . 0.0 110.51 178.297 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 6.7 t70 . . . . . 0 N--CA 1.472 0.647 0 C-N-CA 123.724 0.81 . . . . 0.0 112.79 175.624 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 705' ' ' SER . . . . . 0.474 ' HA ' ' C ' ' A' ' 730' ' ' GLY . 0.8 OUTLIER . . . . . 0 N--CA 1.455 -0.203 0 CA-C-O 120.63 0.252 . . . . 0.0 111.012 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 108.51 -36.13 4.54 Favored Glycine 0 CA--C 1.52 0.355 0 C-N-CA 120.384 -0.912 . . . . 0.0 114.037 171.343 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 707' ' ' LYS . . . . . 0.403 ' NZ ' ' HB3' ' A' ' 744' ' ' GLU . 7.2 mmmt -75.4 155.61 36.23 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 117.011 0.406 . . . . 0.0 111.624 -174.832 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 708' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -97.63 149.32 22.38 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.875 178.585 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -134.88 131.7 37.65 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 177.454 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 710' ' ' TRP . . . . . 0.471 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 70.4 m95 -105.06 124.72 50.01 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.901 0.382 . . . . 0.0 110.679 -177.715 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 711' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -120.51 138.97 53.55 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.198 0.523 . . . . 0.0 111.046 -179.257 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -124.6 67.39 1.09 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.125 176.002 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 713' ' ' VAL . . . . . 0.754 HG13 ' HB3' ' A' ' 750' ' ' ASP . 41.4 t -122.39 122.44 66.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.277 -177.617 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 714' ' ' ARG . . . . . 0.48 HH11 ' HB2' ' A' ' 714' ' ' ARG . 0.1 OUTLIER -86.74 -25.29 24.79 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 176.271 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -67.63 104.53 1.63 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.274 178.271 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 716' ' ' ALA . . . . . 0.652 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -60.45 -43.25 97.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.065 -0.516 . . . . 0.0 112.0 -173.071 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.02 -39.64 95.36 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.193 0.521 . . . . 0.0 110.524 179.538 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.04 -49.57 27.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.155 -178.032 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 719' ' ' CYS . . . . . 0.739 ' HB3' ' HB ' ' A' ' 713' ' ' VAL . 28.4 p -64.79 -40.59 95.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.556 -177.928 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 720' ' ' GLN . . . . . 0.554 ' HB2' ' O ' ' A' ' 716' ' ' ALA . 0.0 OUTLIER -63.23 -40.39 97.31 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.382 -179.543 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -57.68 -48.76 78.63 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.958 0.409 . . . . 0.0 110.47 178.842 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 722' ' ' LEU . . . . . 0.469 ' O ' ' HG ' ' A' ' 726' ' ' LEU . 6.4 mt -67.66 -48.19 67.34 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.58 -178.342 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 723' ' ' GLU . . . . . 0.885 ' HA ' HG11 ' A' ' 733' ' ' VAL . 0.0 OUTLIER -62.57 -43.97 97.5 Favored 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 111.579 0.214 . . . . 0.0 111.579 -174.126 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 724' ' ' THR . . . . . 0.512 ' O ' ' HB3' ' A' ' 728' ' ' ARG . 28.1 m -64.83 -39.26 93.29 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.715 0.293 . . . . 0.0 110.811 -179.613 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 44.0 m -65.38 -32.57 74.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.783 0.325 . . . . 0.0 111.388 179.679 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 726' ' ' LEU . . . . . 0.675 HD22 HD12 ' A' ' 731' ' ' ILE . 24.9 mt -81.95 -47.9 12.14 Favored 'General case' 0 C--N 1.322 -0.626 0 O-C-N 122.208 -0.307 . . . . 0.0 110.921 -178.418 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 727' ' ' GLN . . . . . 0.456 ' HG2' ' HA ' ' A' ' 724' ' ' THR . 3.1 pt20 -67.92 -25.08 65.3 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.527 -177.283 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 728' ' ' ARG . . . . . 0.512 ' HB3' ' O ' ' A' ' 724' ' ' THR . 0.0 OUTLIER -64.03 -31.37 72.54 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 121.114 0.483 . . . . 0.0 110.304 178.303 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -85.67 -51.01 6.75 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.378 179.047 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 730' ' ' GLY . . . . . 0.474 ' C ' ' HA ' ' A' ' 705' ' ' SER . . . 154.32 -6.29 0.33 Allowed Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.508 -0.853 . . . . 0.0 112.689 178.448 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 731' ' ' ILE . . . . . 0.675 HD12 HD22 ' A' ' 726' ' ' LEU . 0.2 OUTLIER -75.3 114.08 14.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 176.604 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 732' ' ' VAL . . . . . . . . . . . . . 2.1 p -74.58 113.96 13.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 121.719 0.771 . . . . 0.0 110.78 -176.377 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 733' ' ' VAL . . . . . 0.885 HG11 ' HA ' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -85.94 136.88 21.92 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.861 -179.21 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -145.36 137.7 25.79 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.483 177.953 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -61.47 124.86 21.81 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 173.81 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 736' ' ' TYR . . . . . 0.471 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 47.2 t80 -55.71 -47.05 77.49 Favored 'General case' 0 C--O 1.232 0.17 0 O-C-N 123.242 0.339 . . . . 0.0 110.278 -179.259 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 54.61 -108.78 0.45 Allowed 'General case' 0 CA--C 1.53 0.183 0 O-C-N 123.728 0.643 . . . . 0.0 110.431 177.354 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -129.62 37.67 2.13 Favored Glycine 0 N--CA 1.445 -0.743 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 176.564 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -84.19 -172.48 4.18 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.002 0.43 . . . . 0.0 111.31 -177.482 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.61 126.89 54.59 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.977 -178.888 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 741' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -71.61 123.46 9.46 Favored 'Trans proline' 0 N--CA 1.462 -0.345 0 C-N-CA 122.612 2.208 . . . . 0.0 111.876 175.14 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 742' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.47 134.93 19.49 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-O 120.699 0.285 . . . . 0.0 111.066 179.691 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 743' ' ' PRO . . . . . 0.514 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 57.3 Cg_endo -71.15 3.72 3.27 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 123.102 2.535 . . . . 0.0 112.464 179.419 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 744' ' ' GLU . . . . . 0.403 ' HB3' ' NZ ' ' A' ' 707' ' ' LYS . 2.2 mm-40 -109.95 -12.29 14.57 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.714 178.792 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 85.2 m-20 -114.47 165.44 12.74 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.722 -172.106 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 746' ' ' VAL . . . . . 0.617 HG21 HD21 ' A' ' 795' ' ' LEU . 18.8 m -117.1 148.43 19.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.965 -175.334 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 747' ' ' LEU . . . . . 0.515 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 0.3 OUTLIER -104.72 113.27 26.75 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.91 175.764 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 3.7 mt -97.45 113.53 32.16 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 175.19 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -114.77 164.74 13.65 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.576 -170.089 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 750' ' ' ASP . . . . . 0.754 ' HB3' HG13 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -125.62 123.35 38.81 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 168.548 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 751' ' ' GLU . . . . . 0.877 ' HG2' HH21 ' A' ' 767' ' ' ARG . 0.0 OUTLIER 61.95 176.84 0.13 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.681 -172.8 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 752' ' ' VAL . . . . . 0.527 HG23 ' HB ' ' A' ' 772' ' ' ILE . 2.6 p -69.86 131.76 33.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.402 -176.182 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 4.4 p -120.41 164.69 16.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.161 179.36 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.2 50.29 1.91 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.879 0.371 . . . . 0.0 111.023 -179.531 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -152.71 132.17 12.95 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.149 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 6.2 tptp -89.97 -18.76 25.44 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.886 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 757' ' ' TRP . . . . . 0.515 ' CD2' ' HB2' ' A' ' 747' ' ' LEU . 73.7 t-105 67.37 96.98 0.06 Allowed 'General case' 0 C--O 1.234 0.248 0 C-N-CA 123.237 0.615 . . . . 0.0 111.928 176.558 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 32.3 tp60 -86.84 58.15 4.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.445 0.641 . . . . 0.0 109.789 173.915 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 759' ' ' GLY . . . . . 0.514 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -119.25 -147.29 8.06 Favored Glycine 0 N--CA 1.443 -0.834 0 CA-C-N 115.696 -0.684 . . . . 0.0 112.016 -179.075 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 5.3 ttm180 -77.01 -59.74 2.65 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.204 0.526 . . . . 0.0 109.922 177.807 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -152.88 155.12 36.44 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.0 -179.154 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 2.7 p -128.07 128.53 68.94 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 177.046 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 763' ' ' VAL . . . . . 0.551 HG13 ' HB2' ' A' ' 781' ' ' TRP . 0.1 OUTLIER -118.09 102.94 13.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.48 -178.945 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 764' ' ' THR . . . . . 0.481 ' HB ' HG23 ' A' ' 782' ' ' VAL . 91.0 m -100.66 124.45 46.27 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.798 -0.637 . . . . 0.0 112.022 -174.693 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 765' ' ' PHE . . . . . 0.562 ' HA ' ' O ' ' A' ' 783' ' ' HIS . 34.5 m-85 -79.79 78.49 6.37 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.539 173.345 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 766' ' ' CYS . . . . . 0.472 ' SG ' HG21 ' A' ' 772' ' ' ILE . 0.0 OUTLIER -106.93 133.24 51.88 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.327 -172.195 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 767' ' ' ARG . . . . . 0.877 HH21 ' HG2' ' A' ' 751' ' ' GLU . 0.0 OUTLIER -111.0 -24.62 10.25 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 174.06 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -103.41 -71.33 0.73 Allowed 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.084 175.584 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 769' ' ' HIS . . . . . 0.59 ' HB2' HG22 ' A' ' 772' ' ' ILE . 0.0 OUTLIER 66.6 129.0 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 122.112 0.958 . . . . 0.0 112.377 179.735 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 770' ' ' ILE . . . . . 0.445 HD12 HG11 ' A' ' 752' ' ' VAL . 6.4 mt -128.66 -79.96 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.021 -0.991 . . . . 0.0 109.681 176.05 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -82.69 -21.2 60.19 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.932 -0.651 . . . . 0.0 111.846 177.327 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 772' ' ' ILE . . . . . 0.59 HG22 ' HB2' ' A' ' 769' ' ' HIS . 0.3 OUTLIER -67.45 141.91 95.99 Favored Pre-proline 0 C--O 1.237 0.405 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 176.395 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 773' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -91.05 -143.41 0.02 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.098 0 C-N-CA 123.156 2.57 . . . . 0.0 113.22 -174.04 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 774' ' ' LEU . . . . . 0.547 ' HA ' ' HB ' ' A' ' 782' ' ' VAL . 0.4 OUTLIER -176.24 -172.26 0.47 Allowed 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 -177.729 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 775' ' ' GLU . . . . . 0.552 ' HA ' ' O ' ' A' ' 780' ' ' GLU . 0.6 OUTLIER -65.81 52.73 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 113.021 0.748 . . . . 0.0 113.021 175.745 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.3 -21.55 23.11 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 169.624 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 777' ' ' ALA . . . . . 0.449 ' HB1' ' HD2' ' A' ' 778' ' ' PRO . . . -133.03 157.68 77.75 Favored Pre-proline 0 N--CA 1.449 -0.482 0 CA-C-N 114.382 -1.281 . . . . 0.0 108.443 174.82 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 778' ' ' PRO . . . . . 0.449 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 49.3 Cg_endo -68.58 -4.3 12.81 Favored 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 122.552 2.168 . . . . 0.0 114.089 -173.921 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . -112.58 -4.0 25.16 Favored Glycine 0 N--CA 1.453 -0.167 0 C-N-CA 120.575 -0.821 . . . . 0.0 112.358 -176.76 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 780' ' ' GLU . . . . . 0.552 ' O ' ' HA ' ' A' ' 775' ' ' GLU . 6.7 mt-10 -118.86 125.45 49.55 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 -179.167 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 781' ' ' TRP . . . . . 0.551 ' HB2' HG13 ' A' ' 763' ' ' VAL . 15.2 m95 -130.25 147.16 51.94 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 -177.717 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 782' ' ' VAL . . . . . 0.547 ' HB ' ' HA ' ' A' ' 774' ' ' LEU . 0.4 OUTLIER -142.69 145.94 22.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-O 120.848 0.356 . . . . 0.0 110.5 179.46 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 783' ' ' HIS . . . . . 0.562 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 2.1 t-160 -157.5 135.96 11.24 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.975 178.278 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -98.21 100.85 12.18 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.404 175.832 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 785' ' ' VAL . . . . . 0.488 ' HB ' ' HD3' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -163.21 -172.9 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 179.937 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -117.66 39.28 3.37 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.639 177.995 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 787' ' ' ALA . . . . . 0.424 ' N ' ' HD3' ' A' ' 788' ' ' PRO . . . 57.87 61.94 5.46 Favored Pre-proline 0 N--CA 1.463 0.213 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.632 -179.186 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 788' ' ' PRO . . . . . 0.488 ' HD3' ' HB ' ' A' ' 785' ' ' VAL . 19.3 Cg_exo -66.93 -65.51 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.433 2.089 . . . . 0.0 111.979 -177.448 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -171.63 -16.61 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 178.17 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 790' ' ' GLU . . . . . . . . . . . . . 6.3 pm0 -76.15 -35.46 59.19 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 121.006 -0.278 . . . . 0.0 111.407 -173.775 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 791' ' ' LEU . . . . . 0.52 HD22 ' CE2' ' A' ' 765' ' ' PHE . 0.2 OUTLIER -73.31 -50.18 6.47 Favored Pre-proline 0 CA--C 1.533 0.308 0 CA-C-O 119.489 -0.291 . . . . 0.0 111.77 -179.128 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 792' ' ' PRO . . . . . 0.477 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 11.0 Cg_endo -57.37 -32.87 95.12 Favored 'Trans proline' 0 C--N 1.357 1.024 0 C-N-CA 121.7 1.6 . . . . 0.0 112.212 175.216 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -70.93 -44.27 66.5 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.952 0.406 . . . . 0.0 110.678 177.198 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -61.9 -40.47 95.56 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.506 178.452 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 795' ' ' LEU . . . . . 0.617 HD21 HG21 ' A' ' 746' ' ' VAL . 0.0 OUTLIER -65.13 -34.7 79.01 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.119 -179.453 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -61.4 -41.73 97.6 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.255 0.55 . . . . 0.0 110.021 176.769 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 797' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 797' ' ' ARG . 2.7 ttt-85 -71.28 -32.37 68.59 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.734 178.614 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 2.8 mt -66.22 -45.75 89.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.826 179.628 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -75.17 -43.55 51.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.149 -176.902 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 4.9 mt . . . . . 0 C--O 1.236 0.366 0 O-C-N 123.644 0.59 . . . . 0.0 111.534 179.022 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 25.6 t0 . . . . . 0 N--CA 1.456 -0.14 0 CA-C-O 121.076 0.465 . . . . 0.0 110.884 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -107.6 135.34 49.22 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.404 175.292 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 826' ' ' MET . . . . . 0.653 ' HG3' ' HA ' ' A' ' 869' ' ' ILE . 0.4 OUTLIER -115.76 124.11 49.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.277 0.56 . . . . 0.0 111.587 -173.684 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 827' ' ' ILE . . . . . 0.4 HG23 ' HB ' ' A' ' 871' ' ' ILE . 3.1 mm -117.34 138.77 46.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.086 178.516 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 828' ' ' LEU . . . . . 0.661 ' HB2' HG21 ' A' ' 869' ' ' ILE . 0.5 OUTLIER -105.21 122.39 45.82 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.727 0.299 . . . . 0.0 110.728 179.309 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -104.31 100.82 11.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.993 176.19 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 830' ' ' VAL . . . . . 0.432 HG22 HD22 ' A' ' 828' ' ' LEU . 5.1 t -109.04 112.2 39.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.304 -179.38 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 831' ' ' ASP . . . . . 0.748 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 11.5 t0 -121.58 142.94 49.61 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 178.778 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -78.75 -21.01 48.6 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.699 -178.765 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 15.7 m80 -114.31 109.85 48.49 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.132 177.91 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -51.13 -38.57 60.69 Favored 'Trans proline' 0 CA--C 1.531 0.368 0 C-N-CA 123.766 2.978 . . . . 0.0 114.668 -173.85 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -64.19 -38.99 83.92 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-O 121.223 0.535 . . . . 0.0 110.678 -179.275 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 836' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -73.57 -37.83 65.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.613 178.41 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 837' ' ' ARG . . . . . 0.748 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 16.2 ttp180 -55.83 -44.34 77.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.448 176.579 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 7.1 ttm180 -59.18 -41.78 89.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.789 178.237 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 1.7 tp -58.88 -52.6 65.02 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.744 -179.723 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 840' ' ' LEU . . . . . 0.489 HD11 ' HA ' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -72.99 -30.44 63.8 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 120.79 -0.364 . . . . 0.0 111.597 -177.476 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -66.44 -37.55 85.43 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.097 0.475 . . . . 0.0 110.702 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -67.9 -41.04 83.33 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.301 178.042 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 843' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -62.74 -50.8 69.63 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.679 178.459 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 844' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.48 -35.78 74.75 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.993 178.038 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -62.97 -35.01 91.49 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.058 177.247 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 4.2 m -76.64 -26.81 55.3 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.873 0.368 . . . . 0.0 110.521 178.768 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 847' ' ' LEU . . . . . 0.611 HD21 ' HG2' ' A' ' 933' ' ' LYS . 3.6 mp -63.13 -33.68 75.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.013 177.503 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 97.59 26.91 9.49 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.692 -0.765 . . . . 0.0 112.918 176.438 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 849' ' ' TYR . . . . . 0.449 ' HE2' HD23 ' A' ' 847' ' ' LEU . 38.9 m-85 -112.09 155.77 23.32 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 176.863 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -69.08 118.0 11.43 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 178.783 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -107.3 126.19 52.12 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.16 0.505 . . . . 0.0 111.399 -173.986 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -111.0 140.44 45.53 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 171.633 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -118.31 144.05 46.14 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 120.559 -0.456 . . . . 0.0 111.643 -174.013 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 854' ' ' ALA . . . . . . . . . . . . . . . -149.21 150.55 32.8 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.157 178.024 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 855' ' ' ASN . . . . . 0.543 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 13.6 t-20 -133.84 74.97 1.57 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.399 175.572 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 856' ' ' ASP . . . . . 0.668 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 4.1 t70 165.53 170.44 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.118 -0.946 . . . . 0.0 108.836 -178.302 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -92.73 -47.29 3.22 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.865 -0.683 . . . . 0.0 111.922 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 858' ' ' VAL . . . . . 0.424 HG22 ' H ' ' A' ' 858' ' ' VAL . 0.0 OUTLIER -71.67 -31.1 40.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.984 0.421 . . . . 0.0 110.661 -178.955 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 859' ' ' ASP . . . . . 0.668 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 0.3 OUTLIER -64.23 -35.4 80.68 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.007 -179.53 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -68.34 -33.64 74.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.181 0.515 . . . . 0.0 110.49 178.65 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 861' ' ' LEU . . . . . 0.595 HD21 ' HG ' ' A' ' 893' ' ' LEU . 15.3 tp -73.59 -32.37 64.07 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.596 179.056 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 -62.82 -47.12 84.8 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.816 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.81 -31.27 50.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 C-N-CA 120.861 -0.336 . . . . 0.0 110.61 177.915 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 864' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.84 -34.84 75.19 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 120.704 0.288 . . . . 0.0 111.138 179.118 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.89 -33.41 34.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.929 0.395 . . . . 0.0 110.482 179.426 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.14 -46.15 78.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.525 179.613 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -144.39 129.33 18.45 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 176.855 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 10.0 t-80 -70.7 88.36 0.71 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.8 0.333 . . . . 0.0 111.291 -177.335 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 869' ' ' ILE . . . . . 0.661 HG21 ' HB2' ' A' ' 828' ' ' LEU . 1.4 mp -65.43 139.91 20.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.524 174.101 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 35.6 m-20 -73.91 -60.34 2.3 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.066 -172.711 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 871' ' ' ILE . . . . . 0.533 HD12 ' HB3' ' A' ' 939' ' ' TYR . 8.0 mm -117.43 128.61 74.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.223 -178.482 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 872' ' ' VAL . . . . . 0.401 HG22 ' HB2' ' A' ' 828' ' ' LEU . 48.1 t -115.33 125.72 72.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.34 179.324 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 873' ' ' LEU . . . . . 0.665 HD22 HD12 ' A' ' 900' ' ' ILE . 0.1 OUTLIER -109.13 121.73 45.77 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 178.956 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -106.78 96.49 6.48 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.033 178.202 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 875' ' ' ASP . . . . . 0.581 ' HA ' HG13 ' A' ' 902' ' ' VAL . 22.1 t0 -97.89 110.29 22.89 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.719 179.388 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -121.89 132.1 71.64 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.41 -173.591 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -99.52 12.2 37.09 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.773 0.797 . . . . 0.0 108.879 171.421 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 6.0 ttm . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 114.68 -1.146 . . . . 0.0 110.27 179.228 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.603 0 N-CA-C 111.368 -0.693 . . . . 0.0 111.368 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -84.43 -32.43 24.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.519 0.676 . . . . 0.0 109.425 -178.246 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.55 -32.77 63.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.796 178.019 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 4.1 tp -67.06 -51.52 53.56 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.753 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -45.26 92.79 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.213 -178.557 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 888' ' ' GLN . . . . . 0.558 ' HA ' ' HD3' ' A' ' 891' ' ' ARG . 7.7 tp-100 -56.98 -42.6 80.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.164 0.506 . . . . 0.0 110.737 178.609 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.97 -38.65 66.62 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.077 -178.613 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 890' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -69.98 -37.13 71.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.726 0.298 . . . . 0.0 111.203 -176.682 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 891' ' ' ARG . . . . . 0.558 ' HD3' ' HA ' ' A' ' 888' ' ' GLN . 1.9 ptm180 -74.15 -28.7 61.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.824 0.345 . . . . 0.0 110.613 178.005 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -78.07 -27.99 48.74 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.075 0.464 . . . . 0.0 110.752 178.852 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 893' ' ' LEU . . . . . 0.595 ' HG ' HD21 ' A' ' 861' ' ' LEU . 1.8 mm? -80.59 -11.34 59.66 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.239 179.448 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 86.28 56.93 2.19 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.294 178.271 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 895' ' ' LEU . . . . . 0.512 ' O ' ' HG ' ' A' ' 895' ' ' LEU . 0.2 OUTLIER -57.72 135.16 56.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.111 0.481 . . . . 0.0 110.577 178.471 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -141.01 49.47 1.66 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.305 0.574 . . . . 0.0 110.637 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 897' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -157.79 151.73 19.74 Favored Pre-proline 0 C--N 1.32 -0.698 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.704 -177.274 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_exo -73.18 112.93 3.64 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 122.454 2.103 . . . . 0.0 111.496 177.821 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 899' ' ' VAL . . . . . 0.791 HG13 ' HA ' ' A' ' 919' ' ' MET . 0.2 OUTLIER -115.41 130.79 69.4 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 CA-C-O 121.5 0.667 . . . . 0.0 110.126 176.746 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 900' ' ' ILE . . . . . 0.665 HD12 HD22 ' A' ' 873' ' ' LEU . 21.2 mt -96.34 117.0 39.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.719 -176.145 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 901' ' ' GLY . . . . . 0.554 ' HA3' ' HD3' ' A' ' 913' ' ' ARG . . . -92.7 105.82 3.34 Favored Glycine 0 N--CA 1.444 -0.811 0 C-N-CA 120.621 -0.799 . . . . 0.0 111.989 177.785 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 902' ' ' VAL . . . . . 0.836 ' HB ' HD12 ' A' ' 923' ' ' LEU . 0.1 OUTLIER -113.83 126.18 71.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 177.49 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 903' ' ' THR . . . . . 0.442 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.4 OUTLIER -143.87 165.23 28.3 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.679 -0.237 . . . . 0.0 110.398 -175.026 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 904' ' ' ALA . . . . . 0.417 ' HB2' ' CB ' ' A' ' 925' ' ' LYS . . . -119.44 103.12 9.17 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.968 0.414 . . . . 0.0 111.722 -178.464 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 52.22 56.23 8.03 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.064 -0.971 . . . . 0.0 112.856 171.81 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 906' ' ' ALA . . . . . 0.76 ' HB3' ' HB3' ' A' ' 909' ' ' GLU . . . -95.75 46.91 1.1 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.073 0.463 . . . . 0.0 110.123 174.676 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 907' ' ' LEU . . . . . 0.492 ' HB3' ' H ' ' A' ' 908' ' ' ALA . 0.1 OUTLIER 64.94 -108.71 0.18 Allowed 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.115 -178.998 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 908' ' ' ALA . . . . . 0.492 ' H ' ' HB3' ' A' ' 907' ' ' LEU . . . -98.53 33.56 2.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.96 0.409 . . . . 0.0 110.682 -177.829 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 909' ' ' GLU . . . . . 0.76 ' HB3' ' HB3' ' A' ' 906' ' ' ALA . 0.0 OUTLIER -52.1 -47.15 65.39 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.42 -0.809 . . . . 0.0 112.314 -176.625 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 910' ' ' GLU . . . . . 0.68 ' HA ' ' NH1' ' A' ' 913' ' ' ARG . 1.5 pt-20 -64.82 -37.46 87.68 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.978 -176.668 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.39 -42.34 71.84 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.872 0.368 . . . . 0.0 110.269 178.773 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -61.81 -40.59 95.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.706 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 913' ' ' ARG . . . . . 0.87 ' HD2' ' HB2' ' A' ' 922' ' ' CYS . 3.0 mtm105 -59.81 -45.54 92.03 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.756 178.128 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 80.7 m -64.73 -44.9 88.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.6 178.799 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.83 -43.51 94.54 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.308 -179.535 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.52 -43.21 81.37 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.569 179.536 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 51.67 33.84 11.67 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.139 -175.687 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -106.08 24.66 25.92 Favored Glycine 0 N--CA 1.447 -0.568 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.715 178.397 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 919' ' ' MET . . . . . 0.791 ' HA ' HG13 ' A' ' 899' ' ' VAL . 2.1 mtt -132.2 -94.89 0.35 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 110.328 -0.249 . . . . 0.0 110.328 -177.923 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 920' ' ' ASP . . . . . 0.427 ' H ' ' HB3' ' A' ' 919' ' ' MET . 9.6 t70 166.36 -64.77 0.0 OUTLIER 'General case' 0 CA--C 1.518 -0.279 0 O-C-N 124.205 0.941 . . . . 0.0 109.175 175.433 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 921' ' ' SER . . . . . 0.599 ' HB2' HG23 ' A' ' 900' ' ' ILE . 0.0 OUTLIER -115.08 165.81 12.5 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.799 -177.459 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 922' ' ' CYS . . . . . 0.87 ' HB2' ' HD2' ' A' ' 913' ' ' ARG . 0.0 OUTLIER -147.37 135.12 21.11 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.332 -179.683 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 923' ' ' LEU . . . . . 0.836 HD12 ' HB ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -155.98 -175.8 5.62 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 178.37 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 924' ' ' SER . . . . . 0.716 ' HB2' ' HD2' ' A' ' 926' ' ' PRO . 0.0 OUTLIER -106.29 154.68 20.41 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.916 -178.839 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 925' ' ' LYS . . . . . 0.45 ' HB3' ' HD3' ' A' ' 926' ' ' PRO . 8.4 tttp -52.92 -43.33 93.86 Favored Pre-proline 0 N--CA 1.47 0.531 0 N-CA-C 112.762 0.652 . . . . 0.0 112.762 179.4 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 926' ' ' PRO . . . . . 0.716 ' HD2' ' HB2' ' A' ' 924' ' ' SER . 23.2 Cg_exo -66.5 75.33 0.38 Allowed 'Trans proline' 0 C--N 1.357 0.997 0 C-N-CA 121.983 1.788 . . . . 0.0 111.798 172.474 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -107.09 152.98 8.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.188 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 928' ' ' THR . . . . . 0.408 ' O ' HG22 ' A' ' 932' ' ' ILE . 0.0 OUTLIER -95.06 149.56 21.13 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.913 179.854 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 929' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.93 -37.78 69.4 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.652 -179.029 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.92 -27.21 65.55 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.82 -178.993 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 931' ' ' VAL . . . . . 0.523 ' O ' ' HG2' ' A' ' 934' ' ' GLN . 93.2 t -75.94 -51.34 20.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.863 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 932' ' ' ILE . . . . . 0.408 HG22 ' O ' ' A' ' 928' ' ' THR . 0.0 OUTLIER -58.52 -37.06 62.4 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-O 121.056 0.455 . . . . 0.0 109.826 178.403 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 933' ' ' LYS . . . . . 0.611 ' HG2' HD21 ' A' ' 847' ' ' LEU . 0.0 OUTLIER -65.37 -47.43 76.43 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.288 -179.978 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 934' ' ' GLN . . . . . 0.554 ' O ' ' HB2' ' A' ' 938' ' ' LEU . 10.2 pt20 -63.72 -41.96 98.0 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.406 -177.049 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 1.3 m -69.44 -39.33 77.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.612 0.244 . . . . 0.0 110.732 -179.449 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 936' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.89 -54.8 29.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.618 179.595 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 74.6 m -60.6 -41.86 95.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.575 -179.076 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 938' ' ' LEU . . . . . 0.554 ' HB2' ' O ' ' A' ' 934' ' ' GLN . 0.1 OUTLIER -68.01 -40.16 83.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.732 0.301 . . . . 0.0 111.416 -178.156 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 939' ' ' TYR . . . . . 0.579 ' HA ' ' HB3' ' A' ' 942' ' ' ARG . 1.6 m-85 -77.19 -27.21 53.5 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.93 -0.308 . . . . 0.0 111.101 -178.087 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -64.28 -43.61 94.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.007 0.432 . . . . 0.0 110.254 174.828 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 941' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -73.73 -21.99 60.04 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.333 177.575 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 942' ' ' ARG . . . . . 0.579 ' HB3' ' HA ' ' A' ' 939' ' ' TYR . 0.0 OUTLIER -67.57 -47.55 69.46 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.266 177.234 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 943' ' ' VAL . . . . . 0.402 ' N ' ' HG3' ' A' ' 942' ' ' ARG . 10.1 m -74.11 -33.07 34.45 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 CA-C-O 120.946 0.403 . . . . 0.0 110.155 178.854 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 19.1 ttt85 -58.56 -48.1 82.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.517 176.472 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.03 -19.33 60.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.199 -179.873 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 71.4 m -71.9 -21.95 61.56 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.09 0.472 . . . . 0.0 109.903 175.722 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.63 -30.21 14.45 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.311 174.489 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.027 -175.787 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 705' ' ' SER . . . . . 0.55 ' HA ' ' O ' ' A' ' 730' ' ' GLY . 1.5 m . . . . . 0 CA--C 1.531 0.234 0 CA-C-O 121.27 0.557 . . . . 0.0 111.495 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 170.49 -23.98 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.345 -0.931 . . . . 0.0 112.597 -178.05 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 1.4 mptt -75.16 135.75 41.08 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 -179.778 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 708' ' ' ARG . . . . . 0.654 ' HG2' HG23 ' A' ' 732' ' ' VAL . 0.0 OUTLIER -100.24 155.13 17.94 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.054 0.454 . . . . 0.0 111.612 -174.445 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 709' ' ' CYS . . . . . 0.455 ' SG ' HD13 ' A' ' 726' ' ' LEU . 0.0 OUTLIER -136.47 127.17 27.21 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.812 176.698 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 710' ' ' TRP . . . . . 0.652 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 90.2 m95 -107.07 117.45 34.09 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 177.113 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 711' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -120.27 123.02 42.17 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.233 0.54 . . . . 0.0 111.191 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -121.27 68.92 0.9 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.368 176.595 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 713' ' ' VAL . . . . . 0.618 HG11 ' HB3' ' A' ' 718' ' ' LEU . 55.3 t -117.84 127.98 75.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.182 -178.216 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 714' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 714' ' ' ARG . 3.3 mtt85 -73.53 -35.45 65.56 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.942 0.401 . . . . 0.0 110.667 178.757 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 41.2 t-20 -63.36 112.53 2.76 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.375 177.252 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 716' ' ' ALA . . . . . 0.65 ' O ' ' HB2' ' A' ' 720' ' ' GLN . . . -66.71 -38.1 86.04 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.328 -175.006 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.83 -38.28 83.02 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.935 0.398 . . . . 0.0 110.092 178.662 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 718' ' ' LEU . . . . . 0.646 HD21 ' HD2' ' A' ' 765' ' ' PHE . 0.9 OUTLIER -67.95 -50.22 57.14 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.663 179.908 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 719' ' ' CYS . . . . . 0.581 ' HB3' ' HB ' ' A' ' 713' ' ' VAL . 21.8 p -67.35 -38.46 84.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.65 -177.887 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 720' ' ' GLN . . . . . 0.702 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -63.96 -39.14 93.46 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.176 177.574 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -57.3 -55.17 38.23 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.704 -179.588 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.87 -48.35 77.04 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.952 -179.42 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 723' ' ' GLU . . . . . 0.8 ' HA ' HG11 ' A' ' 733' ' ' VAL . 2.9 pt-20 -60.39 -43.41 96.68 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.67 -174.154 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 724' ' ' THR . . . . . 0.556 ' N ' ' HG3' ' A' ' 723' ' ' GLU . 14.6 m -71.8 -38.55 70.23 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.841 0.353 . . . . 0.0 111.166 -177.846 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 725' ' ' SER . . . . . 0.425 ' O ' ' HG2' ' A' ' 728' ' ' ARG . 37.5 m -69.03 -36.42 77.73 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.877 0.37 . . . . 0.0 111.299 -179.083 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 726' ' ' LEU . . . . . 0.48 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 11.1 mt -82.06 -42.86 18.66 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.869 -176.655 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 727' ' ' GLN . . . . . 0.433 ' HA ' ' O ' ' A' ' 731' ' ' ILE . 8.5 pt20 -62.43 -29.76 70.74 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.57 0.224 . . . . 0.0 111.392 -176.387 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 728' ' ' ARG . . . . . 0.425 ' HG2' ' O ' ' A' ' 725' ' ' SER . 11.7 ptt180 -69.51 -17.83 63.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.956 0.408 . . . . 0.0 111.128 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 1.4 m -99.35 -1.82 37.87 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.094 -178.123 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 730' ' ' GLY . . . . . 0.55 ' O ' ' HA ' ' A' ' 705' ' ' SER . . . 100.31 14.68 32.34 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.35 -0.929 . . . . 0.0 112.578 179.237 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 731' ' ' ILE . . . . . 0.48 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 32.0 mm -90.57 129.07 41.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 176.438 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 732' ' ' VAL . . . . . 0.654 HG23 ' HG2' ' A' ' 708' ' ' ARG . 0.2 OUTLIER -85.78 94.33 4.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 121.981 0.896 . . . . 0.0 110.428 -178.784 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 733' ' ' VAL . . . . . 0.8 HG11 ' HA ' ' A' ' 723' ' ' GLU . 0.1 OUTLIER -83.22 122.8 38.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 114.595 -1.184 . . . . 0.0 111.08 -177.398 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.66 147.91 52.39 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.717 -179.66 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 3.9 m -77.46 119.27 20.82 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.032 0.444 . . . . 0.0 110.766 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 736' ' ' TYR . . . . . 0.652 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 86.0 t80 -81.84 114.58 20.55 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.616 -178.551 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -109.33 -42.59 4.33 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.075 177.313 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 176.97 47.76 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.432 0 N-CA-C 111.208 -0.757 . . . . 0.0 111.208 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 13.3 mp0 -91.79 -176.31 4.42 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.528 -0.336 . . . . 0.0 110.863 -174.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 740' ' ' GLU . . . . . 0.504 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 0.0 OUTLIER -97.78 131.77 26.21 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.455 179.897 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 741' ' ' PRO . . . . . 0.677 ' HG2' ' HB2' ' A' ' 758' ' ' GLN . 6.5 Cg_endo -87.25 127.54 2.49 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 123.348 2.699 . . . . 0.0 113.313 -175.519 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 742' ' ' THR . . . . . 0.817 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.2 OUTLIER -90.92 148.59 38.5 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 172.392 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 743' ' ' PRO . . . . . 0.817 ' HD2' HG22 ' A' ' 742' ' ' THR . 23.8 Cg_endo -61.77 5.01 0.23 Allowed 'Trans proline' 0 N--CA 1.48 0.687 0 C-N-CA 123.208 2.605 . . . . 0.0 113.931 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 744' ' ' GLU . . . . . 0.407 ' HA ' ' HB2' ' A' ' 760' ' ' ARG . 2.1 mt-10 -118.03 -2.57 11.23 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.772 0.32 . . . . 0.0 110.424 175.595 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 745' ' ' ASP . . . . . 0.451 ' HB3' ' HD1' ' A' ' 710' ' ' TRP . 87.1 m-20 -89.38 149.09 23.15 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.746 -176.149 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 746' ' ' VAL . . . . . 0.529 HG11 HD11 ' A' ' 795' ' ' LEU . 2.8 p -120.51 137.25 54.92 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.3 178.458 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 747' ' ' LEU . . . . . 0.414 ' HG ' ' CZ3' ' A' ' 757' ' ' TRP . 0.0 OUTLIER -106.01 100.01 9.57 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.874 0.369 . . . . 0.0 110.903 -179.748 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 12.0 mt -93.78 106.83 18.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 173.783 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 749' ' ' THR . . . . . 0.654 HG21 ' HB ' ' A' ' 753' ' ' VAL . 6.0 t -128.98 160.38 32.9 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 110.113 -0.328 . . . . 0.0 110.113 -177.275 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 750' ' ' ASP . . . . . 0.584 ' HB3' HG13 ' A' ' 713' ' ' VAL . 1.5 p-10 -105.51 145.86 30.34 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.02 0.438 . . . . 0.0 111.171 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 751' ' ' GLU . . . . . 0.509 ' HA ' ' HA ' ' A' ' 766' ' ' CYS . 22.5 mm-40 63.91 -157.06 0.31 Allowed 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.366 -178.656 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 752' ' ' VAL . . . . . 0.578 HG22 ' H ' ' A' ' 771' ' ' GLY . 62.1 t -75.68 127.16 37.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 120.992 0.425 . . . . 0.0 111.287 -176.295 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 753' ' ' VAL . . . . . 0.654 ' HB ' HG21 ' A' ' 749' ' ' THR . 8.6 p -102.12 142.74 15.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.823 175.437 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -94.37 39.84 1.09 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.906 0.384 . . . . 0.0 111.236 -178.266 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.02 148.24 18.67 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.223 178.684 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 6.4 mmtm -97.2 10.51 39.26 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.826 179.092 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 757' ' ' TRP . . . . . 0.597 ' CH2' ' HB3' ' A' ' 741' ' ' PRO . 4.5 t-105 69.61 153.96 0.11 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.419 -0.81 . . . . 0.0 112.123 177.255 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 758' ' ' GLN . . . . . 0.677 ' HB2' ' HG2' ' A' ' 741' ' ' PRO . 4.9 mp0 -135.22 47.96 2.29 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.797 178.249 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 759' ' ' GLY . . . . . 0.55 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -146.1 -140.86 3.54 Favored Glycine 0 N--CA 1.443 -0.87 0 C-N-CA 120.409 -0.901 . . . . 0.0 113.1 -175.481 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 760' ' ' ARG . . . . . 0.407 ' HB2' ' HA ' ' A' ' 744' ' ' GLU . 0.2 OUTLIER -74.31 -59.97 2.48 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 111.597 0.221 . . . . 0.0 111.597 -178.226 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 761' ' ' ALA . . . . . 0.47 ' O ' ' HA ' ' A' ' 746' ' ' VAL . . . -156.99 157.85 35.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.738 -176.235 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 3.2 p -126.59 131.81 70.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.139 177.643 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 763' ' ' VAL . . . . . 0.577 HG11 HD11 ' A' ' 791' ' ' LEU . 92.2 t -111.37 96.66 4.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 178.487 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 764' ' ' THR . . . . . 0.763 HG21 HG13 ' A' ' 772' ' ' ILE . 0.2 OUTLIER -86.39 92.67 8.9 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.083 -178.593 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 765' ' ' PHE . . . . . 0.741 ' CZ ' ' HG ' ' A' ' 791' ' ' LEU . 0.2 OUTLIER -84.23 83.63 7.9 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.207 179.085 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 766' ' ' CYS . . . . . 0.54 ' HB2' HG12 ' A' ' 770' ' ' ILE . 0.0 OUTLIER -94.54 132.85 38.8 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 -175.049 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 5.1 mmm-85 -88.86 -56.15 3.41 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.913 -171.348 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.28 -34.16 2.96 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.271 -176.33 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -108.75 106.59 16.68 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.291 0.567 . . . . 0.0 110.402 -179.425 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 770' ' ' ILE . . . . . 0.54 HG12 ' HB2' ' A' ' 766' ' ' CYS . 24.2 mt -107.26 87.39 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.467 178.377 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 771' ' ' GLY . . . . . 0.578 ' H ' HG22 ' A' ' 752' ' ' VAL . . . -95.28 6.71 68.78 Favored Glycine 0 N--CA 1.454 -0.156 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.693 177.873 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 772' ' ' ILE . . . . . 0.763 HG13 HG21 ' A' ' 764' ' ' THR . 41.9 mm -104.06 141.79 23.26 Favored Pre-proline 0 C--N 1.32 -0.686 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 178.945 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 773' ' ' PRO . . . . . 0.668 ' O ' ' HB3' ' A' ' 774' ' ' LEU . 50.7 Cg_exo -53.39 -96.83 0.0 OUTLIER 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 123.135 2.557 . . . . 0.0 113.37 178.657 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 774' ' ' LEU . . . . . 0.698 ' HA ' HG13 ' A' ' 782' ' ' VAL . 0.3 OUTLIER 153.05 -161.85 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.462 1.105 . . . . 0.0 109.477 -177.365 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 775' ' ' GLU . . . . . 0.486 ' HA ' ' O ' ' A' ' 780' ' ' GLU . 0.8 OUTLIER -62.65 54.05 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.911 0.884 . . . . 0.0 113.335 177.266 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 776' ' ' LYS . . . . . 0.569 ' HD3' ' HB3' ' A' ' 773' ' ' PRO . 0.1 OUTLIER -118.75 0.41 11.44 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 170.122 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 777' ' ' ALA . . . . . 0.419 ' HB3' ' HB2' ' A' ' 780' ' ' GLU . . . -126.93 150.87 72.96 Favored Pre-proline 0 C--N 1.324 -0.526 0 CA-C-N 114.615 -1.175 . . . . 0.0 109.114 176.123 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_endo -62.14 100.32 0.21 Allowed 'Trans proline' 0 CA--C 1.529 0.232 0 C-N-CA 122.617 2.212 . . . . 0.0 112.626 -178.658 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 96.48 20.11 25.78 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.832 -0.699 . . . . 0.0 113.004 177.475 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 780' ' ' GLU . . . . . 0.486 ' O ' ' HA ' ' A' ' 775' ' ' GLU . 0.1 OUTLIER -109.59 125.06 52.16 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 179.808 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 35.5 m95 -142.66 106.78 4.73 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.853 -0.158 . . . . 0.0 111.152 -175.563 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 782' ' ' VAL . . . . . 0.698 HG13 ' HA ' ' A' ' 774' ' ' LEU . 3.6 m -102.19 156.43 4.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 C-N-CA 120.781 -0.367 . . . . 0.0 110.156 175.19 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 783' ' ' HIS . . . . . 0.43 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.1 OUTLIER -176.36 150.16 0.88 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.61 177.415 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 3.1 m -104.96 100.21 9.82 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.935 0.397 . . . . 0.0 110.533 173.586 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 785' ' ' VAL . . . . . 0.415 HG23 ' CE1' ' A' ' 765' ' ' PHE . 0.1 OUTLIER -159.45 164.55 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 178.239 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -103.56 40.36 1.43 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.997 179.094 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 49.39 64.09 9.18 Favored Pre-proline 0 N--CA 1.469 0.487 0 CA-C-N 115.26 -0.882 . . . . 0.0 112.705 177.379 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 788' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -68.59 -70.37 0.02 OUTLIER 'Trans proline' 0 CA--C 1.533 0.455 0 C-N-CA 122.254 1.969 . . . . 0.0 112.545 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 2.2 p-80 -153.32 -30.82 0.13 Allowed 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -178.487 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 790' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -71.18 -34.28 70.77 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 111.747 0.277 . . . . 0.0 111.747 -174.258 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 791' ' ' LEU . . . . . 0.741 ' HG ' ' CZ ' ' A' ' 765' ' ' PHE . 0.7 OUTLIER -65.46 -55.62 23.68 Favored Pre-proline 0 C--N 1.327 -0.382 0 C-N-CA 120.986 -0.286 . . . . 0.0 111.272 -178.922 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 792' ' ' PRO . . . . . 0.404 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 11.7 Cg_endo -58.55 -26.71 79.79 Favored 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 121.585 1.523 . . . . 0.0 111.871 175.955 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -68.09 -45.69 73.07 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.892 176.479 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 794' ' ' LEU . . . . . 0.506 HD22 ' HA ' ' A' ' 794' ' ' LEU . 0.2 OUTLIER -65.63 -36.89 85.0 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 176.797 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 795' ' ' LEU . . . . . 0.529 HD11 HG11 ' A' ' 746' ' ' VAL . 0.6 OUTLIER -63.04 -44.26 96.36 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.865 179.158 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -63.69 -31.73 72.99 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.148 0.499 . . . . 0.0 110.727 177.053 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.24 -47.18 65.46 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.674 178.69 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 798' ' ' ILE . . . . . 0.437 HG22 ' O ' ' A' ' 795' ' ' LEU . 0.9 OUTLIER -70.1 -16.94 20.58 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.589 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.308 -177.562 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 799' ' ' TYR . . . . . 0.43 ' HD1' ' HA ' ' A' ' 799' ' ' TYR . 2.4 m-30 -78.53 -8.32 58.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.282 175.188 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 34.1 mt . . . . . 0 C--O 1.231 0.126 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.532 177.206 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.938 0.399 . . . . 0.0 110.513 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 825' ' ' MET . . . . . 0.524 ' O ' ' HB3' ' A' ' 849' ' ' TYR . 0.5 OUTLIER -92.29 127.76 37.89 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 -178.501 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 826' ' ' MET . . . . . 0.6 ' HG3' ' HA ' ' A' ' 869' ' ' ILE . 5.0 ptp -125.61 131.02 52.76 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.121 0.486 . . . . 0.0 111.383 -176.763 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 827' ' ' ILE . . . . . . . . . . . . . 10.3 mm -120.71 128.91 76.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.075 176.972 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 828' ' ' LEU . . . . . 0.7 ' HB3' HD13 ' A' ' 869' ' ' ILE . 0.1 OUTLIER -106.36 134.75 49.01 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.259 0.552 . . . . 0.0 110.768 -178.063 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 829' ' ' VAL . . . . . 0.413 HG23 ' HA ' ' A' ' 853' ' ' THR . 0.0 OUTLIER -112.33 111.73 37.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.509 -177.373 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 830' ' ' VAL . . . . . 0.619 ' HA ' ' O ' ' A' ' 854' ' ' ALA . 48.7 t -112.17 100.59 11.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.316 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 831' ' ' ASP . . . . . 0.746 ' HB2' ' HB3' ' A' ' 875' ' ' ASP . 0.1 OUTLIER -121.26 137.55 54.64 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.935 0.398 . . . . 0.0 110.505 -178.27 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 832' ' ' ASP . . . . . 0.462 ' O ' ' HD3' ' A' ' 834' ' ' PRO . 7.2 t70 -74.24 -37.7 63.73 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.854 -176.181 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -108.49 93.1 11.04 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.28 -174.531 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 834' ' ' PRO . . . . . 0.462 ' HD3' ' O ' ' A' ' 832' ' ' ASP . 98.1 Cg_exo -45.62 -25.34 2.33 Favored 'Trans proline' 0 N--CA 1.482 0.849 0 C-N-CA 125.14 3.893 . . . . 0.0 116.374 -164.0 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 1.2 pp -58.25 -40.49 77.87 Favored 'Isoleucine or valine' 0 C--O 1.239 0.524 0 CA-C-O 121.242 0.544 . . . . 0.0 110.758 179.524 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 836' ' ' ASN . . . . . 0.529 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 2.2 t30 -74.53 -39.82 62.12 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.903 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 837' ' ' ARG . . . . . 0.557 ' HB2' ' OD2' ' A' ' 831' ' ' ASP . 6.7 ttp-105 -53.43 -39.96 64.8 Favored 'General case' 0 CA--C 1.518 -0.281 0 O-C-N 123.338 0.399 . . . . 0.0 110.542 175.856 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 838' ' ' ARG . . . . . 0.433 HH11 ' HG2' ' A' ' 838' ' ' ARG . 0.0 OUTLIER -59.39 -44.0 92.84 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 176.297 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 839' ' ' LEU . . . . . 0.432 ' N ' ' HG3' ' A' ' 838' ' ' ARG . 0.7 OUTLIER -69.04 -45.22 70.98 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.971 -0.559 . . . . 0.0 112.098 -175.279 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 840' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 836' ' ' ASN . 0.0 OUTLIER -67.59 -37.37 82.47 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.183 177.629 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -67.22 -24.25 65.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.005 0.431 . . . . 0.0 110.444 178.517 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.08 -57.76 8.66 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.052 176.011 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 843' ' ' GLN . . . . . 1.03 ' HG2' HD23 ' A' ' 929' ' ' LEU . 4.4 mp0 -68.1 -42.03 80.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.095 -177.654 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 844' ' ' LEU . . . . . 0.434 ' HB2' ' O ' ' A' ' 840' ' ' LEU . 0.0 OUTLIER -66.04 -32.76 74.42 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.11 0.481 . . . . 0.0 110.743 179.263 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -65.46 -38.41 94.8 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.933 -0.651 . . . . 0.0 111.874 178.766 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -70.98 -44.38 66.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.618 0.247 . . . . 0.0 111.099 179.09 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -161.23 78.65 0.58 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.065 0.459 . . . . 0.0 111.39 178.971 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . -147.8 32.5 1.31 Allowed Glycine 0 N--CA 1.445 -0.753 0 C-N-CA 120.673 -0.775 . . . . 0.0 111.786 176.96 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 849' ' ' TYR . . . . . 0.524 ' HB3' ' O ' ' A' ' 825' ' ' MET . 70.0 m-85 62.89 -156.9 0.33 Allowed 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 -178.895 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -77.24 108.81 10.62 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.866 0.365 . . . . 0.0 110.298 179.211 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -96.6 134.3 40.0 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.256 -176.228 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.43 122.44 36.69 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.069 177.095 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 853' ' ' THR . . . . . 0.433 HG22 ' HG2' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -92.94 137.25 32.53 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -175.668 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 854' ' ' ALA . . . . . 0.619 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -150.65 161.66 42.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.952 176.258 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 855' ' ' ASN . . . . . 0.452 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 16.1 p-10 -147.29 74.83 1.35 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.271 0.558 . . . . 0.0 111.647 -179.813 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 856' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' A' ' 855' ' ' ASN . 7.3 t0 172.86 147.9 0.05 Allowed 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 114.999 -1.0 . . . . 0.0 109.613 175.127 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -74.06 -35.31 53.88 Favored Glycine 0 N--CA 1.443 -0.861 0 C-N-CA 120.949 -0.643 . . . . 0.0 111.685 179.515 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 858' ' ' VAL . . . . . 0.427 HG22 ' OD1' ' A' ' 856' ' ' ASP . 19.4 m -73.09 -31.37 34.77 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 CA-C-O 120.899 0.38 . . . . 0.0 110.645 -179.749 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 859' ' ' ASP . . . . . 0.41 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 2.2 t70 -70.55 -38.52 74.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.051 179.003 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 860' ' ' ALA . . . . . 0.615 ' O ' ' HG ' ' A' ' 864' ' ' LEU . . . -61.33 -42.44 98.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.12 176.278 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 861' ' ' LEU . . . . . 0.47 HD23 HD12 ' A' ' 864' ' ' LEU . 1.3 mt -60.13 -41.63 93.06 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.719 177.604 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -63.88 -39.89 95.25 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.793 179.913 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 863' ' ' VAL . . . . . 0.586 HG11 HD13 ' A' ' 828' ' ' LEU . 0.3 OUTLIER -66.14 -33.9 66.63 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.764 -177.997 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 864' ' ' LEU . . . . . 0.615 ' HG ' ' O ' ' A' ' 860' ' ' ALA . 4.9 mt -69.85 -35.06 74.43 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.048 0.451 . . . . 0.0 110.109 176.27 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 4.1 m -81.5 -6.63 59.15 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.074 -178.646 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 17.2 mtpt -99.99 -45.59 5.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.729 176.009 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 867' ' ' ASN . . . . . 0.433 ' HB3' ' H ' ' A' ' 868' ' ' HIS . 22.9 t-20 -124.68 -112.16 0.3 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.518 -178.66 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 868' ' ' HIS . . . . . 0.433 ' H ' ' HB3' ' A' ' 867' ' ' ASN . 11.5 t60 -161.68 -67.27 0.06 Allowed 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 179.237 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 869' ' ' ILE . . . . . 0.7 HD13 ' HB3' ' A' ' 828' ' ' LEU . 35.7 mt 66.07 147.42 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 O-C-N 123.846 0.716 . . . . 0.0 110.468 -175.828 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -96.69 -36.42 10.69 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.251 -0.58 . . . . 0.0 112.421 -171.495 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 871' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -136.51 133.88 49.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.908 0.385 . . . . 0.0 110.837 -178.366 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 872' ' ' VAL . . . . . 0.581 HG13 HD21 ' A' ' 828' ' ' LEU . 12.0 t -101.81 124.83 55.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.444 177.67 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 873' ' ' LEU . . . . . 0.492 HD11 HD11 ' A' ' 936' ' ' LEU . 45.5 mt -104.85 100.06 9.68 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 174.616 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -95.52 96.31 8.98 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.626 -178.252 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 875' ' ' ASP . . . . . 0.746 ' HB3' ' HB2' ' A' ' 831' ' ' ASP . 25.0 t0 -93.19 106.91 18.81 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.988 -177.842 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 876' ' ' VAL . . . . . 0.581 ' HB ' HG23 ' A' ' 903' ' ' THR . 21.6 t -108.61 135.77 46.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.091 -170.662 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 877' ' ' ASN . . . . . 0.843 ' HB2' ' HE3' ' A' ' 925' ' ' LYS . 10.9 t-20 -163.6 80.37 0.44 Allowed 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.7 176.205 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.583 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.81 178.598 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.283 0 N-CA-C 111.58 -0.608 . . . . 0.0 111.58 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 884' ' ' TYR . . . . . 0.417 ' O ' ' HB2' ' A' ' 888' ' ' GLN . 54.6 t80 -158.99 -54.99 0.06 Allowed 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 -179.752 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 885' ' ' ARG . . . . . 0.742 ' O ' ' HB2' ' A' ' 889' ' ' ARG . 0.0 OUTLIER -58.39 -50.73 72.64 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.409 -179.486 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.43 -52.61 17.57 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.815 -176.435 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -60.87 -48.36 82.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 0.0 112.141 -174.878 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 888' ' ' GLN . . . . . 0.502 ' O ' ' HB2' ' A' ' 892' ' ' GLN . 3.8 mm-40 -68.68 -45.22 72.26 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.956 -0.297 . . . . 0.0 110.745 -178.124 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 889' ' ' ARG . . . . . 0.742 ' HB2' ' O ' ' A' ' 885' ' ' ARG . 0.0 OUTLIER -61.38 -48.09 82.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.595 0.236 . . . . 0.0 111.223 -177.724 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 890' ' ' ILE . . . . . 0.644 HG12 HD13 ' A' ' 895' ' ' LEU . 0.7 OUTLIER -62.71 -42.69 97.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.25 -175.94 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 891' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.45 -28.53 59.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.652 0.263 . . . . 0.0 111.04 -178.84 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 892' ' ' GLN . . . . . 0.502 ' HB2' ' O ' ' A' ' 888' ' ' GLN . 0.0 OUTLIER -70.15 -36.05 74.46 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.046 179.312 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -83.58 -3.58 57.81 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.889 -176.536 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 109.32 30.76 3.48 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.122 -1.037 . . . . 0.0 114.313 172.708 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 895' ' ' LEU . . . . . 0.644 HD13 HG12 ' A' ' 890' ' ' ILE . 0.2 OUTLIER -66.79 112.03 4.03 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 117.393 0.596 . . . . 0.0 109.524 172.837 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 8.4 t -130.16 59.67 1.63 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 122.08 0.943 . . . . 0.0 110.537 -177.939 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 897' ' ' LEU . . . . . 0.406 HD21 HD22 ' A' ' 864' ' ' LEU . 1.0 OUTLIER -156.07 151.73 22.18 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.655 178.454 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -58.03 116.39 3.2 Favored 'Trans proline' 0 C--O 1.235 0.327 0 C-N-CA 122.956 2.437 . . . . 0.0 113.117 -176.216 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 899' ' ' VAL . . . . . 0.509 HG13 ' HB ' ' A' ' 872' ' ' VAL . 16.2 t -103.38 124.91 57.89 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.634 177.037 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 900' ' ' ILE . . . . . 0.668 HG23 ' HB2' ' A' ' 921' ' ' SER . 8.7 mt -104.74 102.03 13.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 177.06 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 901' ' ' GLY . . . . . 0.489 ' O ' ' HA ' ' A' ' 922' ' ' CYS . . . -83.5 112.73 3.59 Favored Glycine 0 N--CA 1.444 -0.799 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.0 -178.998 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 902' ' ' VAL . . . . . 0.868 ' HB ' HD12 ' A' ' 923' ' ' LEU . 0.2 OUTLIER -104.23 114.55 44.15 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.915 0 N-CA-C 109.268 -0.642 . . . . 0.0 109.268 178.311 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 903' ' ' THR . . . . . 0.581 HG23 ' HB ' ' A' ' 876' ' ' VAL . 0.1 OUTLIER -119.86 152.76 36.84 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.546 -176.347 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -76.14 103.84 6.38 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.749 -179.213 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 57.88 79.07 0.21 Allowed 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.751 178.649 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 906' ' ' ALA . . . . . 0.497 ' HB3' ' HG3' ' A' ' 909' ' ' GLU . . . -85.16 -11.92 53.95 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.744 179.161 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 907' ' ' LEU . . . . . 0.417 ' HB2' ' O ' ' A' ' 906' ' ' ALA . 1.5 mt 73.86 -54.25 0.68 Allowed 'General case' 0 N--CA 1.471 0.599 0 O-C-N 124.048 0.842 . . . . 0.0 111.27 176.631 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -132.85 72.3 1.49 Allowed 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 177.006 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 909' ' ' GLU . . . . . 0.497 ' HG3' ' HB3' ' A' ' 906' ' ' ALA . 1.8 mp0 -46.61 -52.46 13.56 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.377 -0.828 . . . . 0.0 112.304 -176.028 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 910' ' ' GLU . . . . . 0.446 ' O ' ' HB3' ' A' ' 913' ' ' ARG . 1.0 OUTLIER -56.77 -46.44 81.49 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 120.946 0.403 . . . . 0.0 111.575 -179.136 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -66.53 -37.32 84.77 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.23 0.538 . . . . 0.0 110.692 -178.135 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -63.3 -31.29 72.4 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.039 177.23 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 913' ' ' ARG . . . . . 0.663 ' HB2' ' SG ' ' A' ' 922' ' ' CYS . 13.6 ttp180 -67.12 -38.88 86.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.444 177.536 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 13.3 m -63.45 -27.94 69.63 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.037 0.446 . . . . 0.0 110.32 176.831 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.02 -49.68 42.34 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.641 177.31 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 916' ' ' GLU . . . . . 0.445 ' HG3' ' H ' ' A' ' 916' ' ' GLU . 0.0 OUTLIER -74.18 -50.28 19.93 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 121.106 -0.237 . . . . 0.0 111.266 -176.535 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 50.38 40.95 24.03 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.802 -175.575 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -136.9 -29.38 0.3 Allowed Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.572 -0.823 . . . . 0.0 113.483 -176.837 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 919' ' ' MET . . . . . 0.584 ' O ' ' HB2' ' A' ' 920' ' ' ASP . 0.3 OUTLIER -84.23 -87.53 0.11 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 117.183 0.491 . . . . 0.0 110.826 -176.763 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 920' ' ' ASP . . . . . 0.584 ' HB2' ' O ' ' A' ' 919' ' ' MET . 25.6 t70 164.32 -53.15 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.533 0.733 . . . . 0.0 110.39 176.081 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 921' ' ' SER . . . . . 0.668 ' HB2' HG23 ' A' ' 900' ' ' ILE . 1.0 OUTLIER -134.81 171.06 14.91 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.871 179.819 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 922' ' ' CYS . . . . . 0.663 ' SG ' ' HB2' ' A' ' 913' ' ' ARG . 0.4 OUTLIER -149.59 145.43 26.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.815 0.34 . . . . 0.0 111.372 -178.213 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 923' ' ' LEU . . . . . 0.868 HD12 ' HB ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -145.82 -176.86 5.31 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.933 175.654 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 924' ' ' SER . . . . . 0.54 ' HB3' ' HD2' ' A' ' 926' ' ' PRO . 4.1 m -103.55 144.55 31.27 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.802 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 925' ' ' LYS . . . . . 0.843 ' HE3' ' HB2' ' A' ' 877' ' ' ASN . 12.9 tttm -54.44 -45.85 99.25 Favored Pre-proline 0 CA--C 1.539 0.547 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 -179.154 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 926' ' ' PRO . . . . . 0.54 ' HD2' ' HB3' ' A' ' 924' ' ' SER . 14.8 Cg_exo -69.93 71.96 1.57 Allowed 'Trans proline' 0 C--N 1.356 0.953 0 C-N-CA 121.851 1.701 . . . . 0.0 111.923 175.157 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 10.0 p -95.04 140.75 16.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.992 -178.655 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -92.56 159.56 15.43 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.857 179.182 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 929' ' ' LEU . . . . . 1.03 HD23 ' HG2' ' A' ' 843' ' ' GLN . 1.3 tm? -52.69 -43.26 65.48 Favored 'General case' 0 N--CA 1.464 0.271 0 O-C-N 123.468 0.48 . . . . 0.0 111.027 179.269 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.39 -37.71 88.47 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.97 0.414 . . . . 0.0 110.659 -177.282 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 44.2 t -75.6 -47.14 34.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.147 -176.959 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 932' ' ' ILE . . . . . 0.419 ' O ' ' HB2' ' A' ' 936' ' ' LEU . 0.0 OUTLIER -63.59 -40.1 87.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 121.148 -0.221 . . . . 0.0 110.702 -179.329 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 1.8 tmmt? -62.96 -48.47 78.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.066 0.46 . . . . 0.0 110.33 177.829 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -62.34 -49.35 75.92 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.379 -177.603 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 4.7 m -63.87 -44.8 92.0 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.386 -177.776 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 936' ' ' LEU . . . . . 0.492 HD11 HD11 ' A' ' 873' ' ' LEU . 0.1 OUTLIER -63.9 -47.64 79.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.558 -179.045 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 55.0 m -63.27 -45.95 89.09 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.308 -179.458 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 938' ' ' LEU . . . . . 0.473 ' O ' ' HB2' ' A' ' 942' ' ' ARG . 0.4 OUTLIER -64.01 -43.19 96.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.254 -178.372 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -73.89 -32.57 63.64 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 121.084 -0.246 . . . . 0.0 111.082 -177.304 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -69.54 -45.99 67.5 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.806 0.336 . . . . 0.0 110.678 177.653 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 941' ' ' GLU . . . . . 0.438 ' HA ' ' HB2' ' A' ' 944' ' ' ARG . 1.7 pt-20 -70.42 -23.78 62.8 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.833 0.349 . . . . 0.0 110.463 178.524 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 942' ' ' ARG . . . . . 0.473 ' HB2' ' O ' ' A' ' 938' ' ' LEU . 0.4 OUTLIER -66.13 -48.47 70.73 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.724 178.722 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 2.8 m -72.69 -30.44 33.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.046 0.45 . . . . 0.0 110.043 178.785 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 944' ' ' ARG . . . . . 0.438 ' HB2' ' HA ' ' A' ' 941' ' ' GLU . 0.9 OUTLIER -62.68 -48.74 77.96 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.981 177.37 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -74.48 -16.13 60.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.769 0.318 . . . . 0.0 111.26 -179.562 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 63.4 m -79.29 -26.78 42.26 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.15 0.5 . . . . 0.0 109.971 174.088 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 1.6 mpp_? -82.63 -38.49 23.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.647 175.729 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.325 -0.495 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.856 177.764 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 705' ' ' SER . . . . . 0.477 ' HA ' ' O ' ' A' ' 730' ' ' GLY . 3.7 m . . . . . 0 CA--C 1.538 0.493 0 CA-C-O 121.029 0.442 . . . . 0.0 111.827 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 67.68 15.72 66.87 Favored Glycine 0 CA--C 1.52 0.346 0 CA-C-N 116.142 -0.481 . . . . 0.0 113.603 175.025 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 707' ' ' LYS . . . . . 0.536 ' HB2' HD12 ' A' ' 731' ' ' ILE . 10.0 mmmt -118.88 148.34 43.01 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 708' ' ' ARG . . . . . 0.401 ' HG2' HG13 ' A' ' 732' ' ' VAL . 0.5 OUTLIER -109.38 122.96 48.52 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.058 0.456 . . . . 0.0 110.863 -176.9 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -101.86 113.79 27.29 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 175.507 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 710' ' ' TRP . . . . . 0.456 ' O ' HD23 ' A' ' 747' ' ' LEU . 87.8 m95 -89.91 115.38 27.17 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -178.851 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 711' ' ' LEU . . . . . 0.497 HD11 ' HB2' ' A' ' 719' ' ' CYS . 0.0 OUTLIER -114.87 125.48 53.7 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.75 -172.158 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -126.29 43.37 3.11 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.191 177.256 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 713' ' ' VAL . . . . . 0.764 ' HA ' ' CB ' ' A' ' 750' ' ' ASP . 25.2 t -98.82 133.76 40.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.63 -0.713 . . . . 0.0 110.652 -178.053 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -98.3 -34.04 10.84 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.639 -176.647 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -69.96 122.52 19.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.436 178.819 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 716' ' ' ALA . . . . . 0.732 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -64.18 -37.59 88.02 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.087 -0.506 . . . . 0.0 112.066 -173.404 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 717' ' ' SER . . . . . 0.431 ' O ' ' HB2' ' A' ' 721' ' ' PHE . 1.7 m -63.09 -45.61 91.27 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.116 0.484 . . . . 0.0 110.24 179.126 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 718' ' ' LEU . . . . . 0.644 ' HB3' HG11 ' A' ' 713' ' ' VAL . 0.4 OUTLIER -68.93 -49.74 55.47 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.514 -0.767 . . . . 0.0 111.566 -179.534 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 719' ' ' CYS . . . . . 0.732 ' SG ' ' HA ' ' A' ' 716' ' ' ALA . 30.5 p -67.13 -51.02 59.17 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.212 -174.675 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 720' ' ' GLN . . . . . 0.419 ' HA ' ' CG ' ' A' ' 723' ' ' GLU . 4.6 tp60 -60.24 -39.23 86.0 Favored 'General case' 0 C--N 1.332 -0.163 0 O-C-N 122.997 0.185 . . . . 0.0 111.37 -178.21 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 721' ' ' PHE . . . . . 0.431 ' HB2' ' O ' ' A' ' 717' ' ' SER . 10.6 t80 -55.87 -55.8 28.19 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.021 0.438 . . . . 0.0 110.433 179.755 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 722' ' ' LEU . . . . . 0.635 HD13 HG21 ' A' ' 748' ' ' ILE . 20.5 mt -68.42 -46.54 69.62 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.427 -176.918 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 723' ' ' GLU . . . . . 0.419 ' CG ' ' HA ' ' A' ' 720' ' ' GLN . 0.0 OUTLIER -64.66 -44.23 91.07 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.549 0.203 . . . . 0.0 111.549 -173.892 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 724' ' ' THR . . . . . 0.64 ' O ' ' HG3' ' A' ' 728' ' ' ARG . 55.4 m -67.36 -36.76 82.04 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.769 0.318 . . . . 0.0 110.804 -179.189 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 24.5 m -70.67 -49.08 51.08 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.737 0.304 . . . . 0.0 111.467 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 726' ' ' LEU . . . . . . . . . . . . . 9.6 mt -68.6 -37.09 79.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.649 -175.032 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.61 -18.96 65.71 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.044 0.45 . . . . 0.0 110.88 -179.707 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 728' ' ' ARG . . . . . 0.64 ' HG3' ' O ' ' A' ' 724' ' ' THR . 8.9 mtm180 -74.69 -11.25 60.13 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.013 0.435 . . . . 0.0 110.74 178.297 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -103.7 8.02 37.34 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.045 0.45 . . . . 0.0 110.803 178.959 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 730' ' ' GLY . . . . . 0.477 ' O ' ' HA ' ' A' ' 705' ' ' SER . . . 89.86 13.17 61.24 Favored Glycine 0 C--N 1.329 0.169 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.784 179.006 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 731' ' ' ILE . . . . . 0.536 HD12 ' HB2' ' A' ' 707' ' ' LYS . 15.2 mm -90.35 128.94 41.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 O-C-N 122.791 -0.24 . . . . 0.0 110.475 179.686 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 732' ' ' VAL . . . . . 0.401 HG13 ' HG2' ' A' ' 708' ' ' ARG . 1.4 p -90.01 115.81 30.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.201 0.524 . . . . 0.0 110.566 -179.604 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 733' ' ' VAL . . . . . . . . . . . . . 10.1 t -86.81 137.14 21.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.195 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -141.48 137.34 32.04 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.827 0.346 . . . . 0.0 110.948 -177.845 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.72 116.6 7.82 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.632 178.548 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -85.4 80.01 9.27 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.401 0.619 . . . . 0.0 110.873 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 737' ' ' GLU . . . . . 0.462 ' HG3' ' H ' ' A' ' 737' ' ' GLU . 0.0 OUTLIER -79.01 -29.41 43.65 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.065 176.26 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 146.77 67.49 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.57 178.845 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 739' ' ' GLN . . . . . 0.451 ' HB2' ' H ' ' A' ' 740' ' ' GLU . 0.1 OUTLIER -112.99 -119.96 0.3 Allowed 'General case' 0 C--N 1.329 -0.312 0 O-C-N 122.879 -0.189 . . . . 0.0 110.817 179.304 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 740' ' ' GLU . . . . . 0.496 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 17.2 mm-40 -112.5 134.14 21.67 Favored Pre-proline 0 C--N 1.326 -0.432 0 CA-C-O 120.659 0.266 . . . . 0.0 111.045 -177.065 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 741' ' ' PRO . . . . . 0.496 ' HD3' ' HA ' ' A' ' 740' ' ' GLU . 4.5 Cg_endo -88.0 125.81 1.98 Allowed 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 123.434 2.756 . . . . 0.0 111.98 175.607 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 742' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -95.71 125.17 50.14 Favored Pre-proline 0 N--CA 1.449 -0.525 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.377 176.777 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 743' ' ' PRO . . . . . 0.675 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 34.0 Cg_endo -64.28 -9.41 19.79 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.834 2.356 . . . . 0.0 112.465 -179.314 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -104.85 -6.96 19.74 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.055 -179.902 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -117.13 167.28 11.32 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.519 -173.364 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 746' ' ' VAL . . . . . 0.652 HG21 HD11 ' A' ' 795' ' ' LEU . 33.0 m -118.91 148.21 21.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.352 0.596 . . . . 0.0 112.417 -171.454 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 747' ' ' LEU . . . . . 0.456 HD23 ' O ' ' A' ' 710' ' ' TRP . 0.3 OUTLIER -107.89 115.14 29.59 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.481 175.141 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 748' ' ' ILE . . . . . 0.635 HG21 HD13 ' A' ' 722' ' ' LEU . 19.3 mt -98.86 107.55 20.67 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 172.92 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 749' ' ' THR . . . . . 0.501 HG21 ' HB ' ' A' ' 753' ' ' VAL . 0.0 OUTLIER -102.68 160.55 14.48 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.319 -0.855 . . . . 0.0 112.192 -170.388 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 750' ' ' ASP . . . . . 0.764 ' CB ' ' HA ' ' A' ' 713' ' ' VAL . 36.7 t0 -124.14 121.61 35.59 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 171.426 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 64.84 -165.77 0.23 Allowed 'General case' 0 C--N 1.327 -0.385 0 O-C-N 123.785 0.678 . . . . 0.0 110.715 -174.288 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 752' ' ' VAL . . . . . 0.929 HG21 ' HB ' ' A' ' 770' ' ' ILE . 42.0 t -82.46 122.4 37.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.06 0.457 . . . . 0.0 111.317 -175.164 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 753' ' ' VAL . . . . . 0.501 ' HB ' HG21 ' A' ' 749' ' ' THR . 8.7 p -93.21 -7.16 10.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.269 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 54.72 51.24 14.17 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.388 -178.666 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.72 167.87 28.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.713 178.196 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -101.77 -29.47 11.86 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 123.108 0.255 . . . . 0.0 110.987 -179.686 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 757' ' ' TRP . . . . . 0.526 ' CD1' ' HB ' ' A' ' 762' ' ' VAL . 68.9 t-105 65.03 94.01 0.06 Allowed 'General case' 0 N--CA 1.464 0.271 0 O-C-N 123.794 0.684 . . . . 0.0 111.007 -179.724 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.81 64.58 8.13 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.255 0.55 . . . . 0.0 110.326 177.447 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 759' ' ' GLY . . . . . 0.675 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -123.44 -151.82 8.33 Favored Glycine 0 N--CA 1.446 -0.644 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.457 178.885 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.14 -51.01 19.49 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.993 0.425 . . . . 0.0 110.051 178.563 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -162.39 151.17 15.03 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.377 178.841 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 762' ' ' VAL . . . . . 0.526 ' HB ' ' CD1' ' A' ' 757' ' ' TRP . 2.7 p -128.15 117.04 44.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.606 176.754 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 1.6 t -109.49 104.19 16.69 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.693 -178.2 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 764' ' ' THR . . . . . 0.622 ' HB ' HG12 ' A' ' 782' ' ' VAL . 90.4 m -95.43 121.44 37.12 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.951 -175.132 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 765' ' ' PHE . . . . . 0.852 ' HE1' HG23 ' A' ' 785' ' ' VAL . 5.6 m-85 -91.13 89.3 7.31 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.334 173.629 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -110.61 133.54 53.22 Favored 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.57 -175.593 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.79 61.06 4.08 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.98 0.419 . . . . 0.0 110.053 179.565 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 768' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 768' ' ' ARG . 3.3 mtm180 57.39 29.9 17.69 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.868 178.648 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -96.17 118.66 33.19 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.114 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 770' ' ' ILE . . . . . 0.929 ' HB ' HG21 ' A' ' 752' ' ' VAL . 53.6 mt 71.31 -70.01 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 O-C-N 123.76 0.662 . . . . 0.0 111.477 178.123 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . 126.73 96.93 0.99 Allowed Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 120.504 -0.855 . . . . 0.0 113.248 178.524 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 772' ' ' ILE . . . . . 0.736 HG12 HG22 ' A' ' 752' ' ' VAL . 39.2 mm -104.42 129.28 25.33 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 171.49 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 773' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -75.12 170.91 19.35 Favored 'Trans proline' 0 CA--C 1.53 0.279 0 C-N-CA 122.578 2.186 . . . . 0.0 113.184 -178.311 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 774' ' ' LEU . . . . . 0.578 ' O ' ' HB3' ' A' ' 780' ' ' GLU . 0.7 OUTLIER -101.93 -148.88 0.38 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.459 -178.706 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 775' ' ' GLU . . . . . 0.495 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 1.7 mp0 -65.38 60.56 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -179.688 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -102.01 -16.06 16.59 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 170.75 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -132.26 149.25 72.67 Favored Pre-proline 0 N--CA 1.449 -0.514 0 CA-C-N 114.188 -1.369 . . . . 0.0 108.423 175.349 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -60.67 100.41 0.16 Allowed 'Trans proline' 0 C--O 1.232 0.206 0 C-N-CA 122.572 2.181 . . . . 0.0 112.956 -176.695 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 123.05 -17.28 8.09 Favored Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.693 -0.765 . . . . 0.0 113.109 175.52 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 780' ' ' GLU . . . . . 0.578 ' HB3' ' O ' ' A' ' 774' ' ' LEU . 1.1 tt0 -81.07 126.29 31.26 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 117.13 0.465 . . . . 0.0 111.418 -175.9 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 32.3 m95 -138.68 143.07 39.0 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 176.645 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 782' ' ' VAL . . . . . 0.622 HG12 ' HB ' ' A' ' 764' ' ' THR . 1.2 m -143.93 155.35 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-O 121.121 0.486 . . . . 0.0 111.633 178.015 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 783' ' ' HIS . . . . . 0.485 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 1.4 t-160 -161.52 139.98 9.54 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.565 174.167 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -105.4 99.36 8.97 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 175.623 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 785' ' ' VAL . . . . . 0.852 HG23 ' HE1' ' A' ' 765' ' ' PHE . 0.0 OUTLIER -171.29 -160.98 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.953 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 786' ' ' ALA . . . . . 0.447 ' H ' ' HB ' ' A' ' 785' ' ' VAL . . . -133.33 68.15 1.51 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.796 -0.184 . . . . 0.0 110.659 177.713 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 50.2 67.95 3.9 Favored Pre-proline 0 N--CA 1.468 0.447 0 CA-C-N 115.878 -0.601 . . . . 0.0 112.011 178.095 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 788' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -87.36 46.77 1.41 Allowed 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 122.595 2.197 . . . . 0.0 112.947 -174.336 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 71.21 -32.26 0.24 Allowed 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.415 0.686 . . . . 0.0 112.85 175.726 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 790' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -71.19 -37.92 72.13 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -175.78 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 791' ' ' LEU . . . . . 0.715 HD22 ' HE2' ' A' ' 765' ' ' PHE . 0.2 OUTLIER -71.12 -48.3 13.58 Favored Pre-proline 0 C--N 1.327 -0.372 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -176.362 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 792' ' ' PRO . . . . . 0.466 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 2.9 Cg_endo -53.65 -33.08 67.75 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 121.373 1.382 . . . . 0.0 112.119 173.855 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -66.79 -44.65 80.74 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 120.909 0.385 . . . . 0.0 110.464 175.829 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -59.75 -44.36 93.86 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.292 177.155 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 795' ' ' LEU . . . . . 0.652 HD11 HG21 ' A' ' 746' ' ' VAL . 0.2 OUTLIER -59.84 -47.36 86.04 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.096 -179.282 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -62.13 -45.06 95.14 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.097 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.02 -24.63 62.4 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.352 -178.008 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -77.62 -28.65 15.96 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 CA-C-O 120.732 0.301 . . . . 0.0 111.116 -179.135 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 799' ' ' TYR . . . . . 0.462 ' HD1' ' HA ' ' A' ' 799' ' ' TYR . 0.2 OUTLIER -81.45 -16.96 50.42 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.445 178.488 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 1.8 mt . . . . . 0 C--O 1.235 0.292 0 CA-C-N 115.426 -0.807 . . . . 0.0 111.92 174.894 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 31.8 t70 . . . . . 0 N--CA 1.461 0.094 0 CA-C-O 120.779 0.324 . . . . 0.0 111.576 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.32 103.53 12.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.743 0.306 . . . . 0.0 111.049 -176.462 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 826' ' ' MET . . . . . 0.43 ' SD ' ' HA ' ' A' ' 869' ' ' ILE . 0.0 OUTLIER -100.55 117.08 33.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.495 178.949 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 827' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -113.66 120.14 62.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.93 178.811 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 828' ' ' LEU . . . . . 0.808 ' HB3' HG22 ' A' ' 872' ' ' VAL . 2.2 tm? -95.55 129.72 42.64 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 -179.03 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 829' ' ' VAL . . . . . 0.611 ' HB ' ' CZ ' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -123.44 124.22 69.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 120.725 0.298 . . . . 0.0 110.667 179.329 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 830' ' ' VAL . . . . . 0.553 HG13 ' HA ' ' A' ' 874' ' ' SER . 2.2 p -122.25 105.29 16.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.993 0.425 . . . . 0.0 111.338 -176.799 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 831' ' ' ASP . . . . . 0.693 ' HA ' ' O ' ' A' ' 875' ' ' ASP . 4.7 t0 -110.11 155.42 21.93 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.276 0.56 . . . . 0.0 111.415 -175.541 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -93.24 -21.45 19.61 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.031 -0.986 . . . . 0.0 109.496 175.184 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 10.9 m170 -110.75 118.1 49.21 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.837 -179.025 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -61.2 -40.5 49.86 Favored 'Trans proline' 0 C--O 1.234 0.313 0 C-N-CA 122.892 2.394 . . . . 0.0 112.66 -178.125 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -61.04 -40.92 87.26 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.421 178.925 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 836' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -66.46 -46.1 77.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.638 178.282 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 837' ' ' ARG . . . . . 0.697 HH21 HD11 ' A' ' 840' ' ' LEU . 0.0 OUTLIER -52.06 -53.3 43.86 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.653 179.926 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 838' ' ' ARG . . . . . 0.487 ' HG3' ' N ' ' A' ' 839' ' ' LEU . 0.0 OUTLIER -64.24 -42.46 96.52 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.728 0.299 . . . . 0.0 111.37 -175.728 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 839' ' ' LEU . . . . . 0.487 ' N ' ' HG3' ' A' ' 838' ' ' ARG . 0.2 OUTLIER -76.3 -49.02 18.06 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -171.347 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 840' ' ' LEU . . . . . 0.697 HD11 HH21 ' A' ' 837' ' ' ARG . 1.7 pp -75.15 -30.04 60.64 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.387 -0.525 . . . . 0.0 111.168 -176.624 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -71.87 -25.26 61.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.822 0.344 . . . . 0.0 110.24 175.493 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -63.59 -44.66 93.37 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 172.972 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 843' ' ' GLN . . . . . 0.452 ' HG2' HD23 ' A' ' 929' ' ' LEU . 1.4 mt-30 -62.7 -38.3 89.88 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.286 176.397 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 844' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.81 -34.91 76.78 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.229 0.538 . . . . 0.0 110.416 175.12 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -68.45 -31.77 74.44 Favored Glycine 0 N--CA 1.446 -0.644 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.993 176.37 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -68.65 -24.85 64.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.939 0.4 . . . . 0.0 110.413 177.088 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 847' ' ' LEU . . . . . 0.513 HD22 HD22 ' A' ' 936' ' ' LEU . 0.2 OUTLIER -68.29 -38.38 81.61 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.442 174.995 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 92.0 55.66 1.71 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.742 -0.742 . . . . 0.0 113.094 175.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 849' ' ' TYR . . . . . 0.402 ' HE2' HD23 ' A' ' 847' ' ' LEU . 92.8 m-85 -136.14 164.18 28.62 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 177.396 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 850' ' ' GLN . . . . . 0.406 ' O ' ' HA ' ' A' ' 826' ' ' MET . 0.0 OUTLIER -80.65 108.34 14.22 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 -179.45 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -112.16 148.37 34.15 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.634 -176.122 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 852' ' ' LYS . . . . . 0.405 ' HB3' HD23 ' A' ' 828' ' ' LEU . 0.0 OUTLIER -121.51 116.83 25.41 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 175.007 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 32.8 p -92.68 128.62 38.61 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.836 -178.532 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 854' ' ' ALA . . . . . 0.507 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -137.35 132.35 33.45 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.367 176.796 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -112.21 73.7 0.83 Allowed 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 172.235 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 856' ' ' ASP . . . . . 0.645 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 2.1 t0 -173.56 126.82 0.41 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.074 -0.966 . . . . 0.0 109.689 -170.929 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -71.86 -61.87 3.61 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.197 -177.707 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 858' ' ' VAL . . . . . 0.449 HG22 ' H ' ' A' ' 858' ' ' VAL . 0.0 OUTLIER -59.23 -31.51 46.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 111.933 0.346 . . . . 0.0 111.933 -178.43 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 859' ' ' ASP . . . . . 0.645 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 0.2 OUTLIER -68.91 -20.85 64.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.578 0.227 . . . . 0.0 111.364 -178.049 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 860' ' ' ALA . . . . . 0.457 ' O ' ' HB2' ' A' ' 864' ' ' LEU . . . -64.77 -36.27 83.78 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.975 0.417 . . . . 0.0 110.078 176.165 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 861' ' ' LEU . . . . . . . . . . . . . 1.3 mt -71.56 -37.22 71.1 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.706 175.582 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 36.4 t-20 -56.18 -53.16 60.46 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 114.98 -1.009 . . . . 0.0 111.034 179.636 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 8.3 p -72.79 -32.71 41.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.49 -178.054 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 864' ' ' LEU . . . . . 0.457 ' HB2' ' O ' ' A' ' 860' ' ' ALA . 0.2 OUTLIER -62.71 -45.87 90.75 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.024 0.44 . . . . 0.0 110.857 -179.956 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 1.4 m -80.2 -20.05 45.61 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.015 -178.035 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -74.09 -52.14 13.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.072 0.463 . . . . 0.0 110.58 178.104 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -109.84 -88.22 0.5 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.02 -179.659 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 868' ' ' HIS . . . . . 0.506 ' O ' ' HB ' ' A' ' 869' ' ' ILE . 0.2 OUTLIER 172.73 -64.87 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 O-C-N 123.267 0.355 . . . . 0.0 110.662 -179.409 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 869' ' ' ILE . . . . . 0.776 HG12 ' HB2' ' A' ' 828' ' ' LEU . 1.7 mp 71.89 142.66 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 O-C-N 123.783 0.677 . . . . 0.0 110.496 -175.368 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -87.01 -42.66 12.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.883 0.373 . . . . 0.0 111.323 -176.118 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 871' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -141.07 136.16 33.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.158 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 872' ' ' VAL . . . . . 0.808 HG22 ' HB3' ' A' ' 828' ' ' LEU . 3.2 t -115.1 131.57 66.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.725 -178.728 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 873' ' ' LEU . . . . . 0.489 HD12 HG13 ' A' ' 829' ' ' VAL . 1.9 mt -113.35 118.84 35.69 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 173.635 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 874' ' ' SER . . . . . 0.553 ' HA ' HG13 ' A' ' 830' ' ' VAL . 72.1 p -105.56 97.02 6.91 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.046 0.45 . . . . 0.0 110.282 -178.726 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 875' ' ' ASP . . . . . 0.693 ' O ' ' HA ' ' A' ' 831' ' ' ASP . 0.0 OUTLIER -87.9 105.8 17.67 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.841 -179.317 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 876' ' ' VAL . . . . . 0.673 HG22 ' H ' ' A' ' 878' ' ' MET . 5.1 p -127.19 143.11 41.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-O 121.226 0.536 . . . . 0.0 111.14 -176.203 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -98.12 -0.41 44.43 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.599 179.205 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 878' ' ' MET . . . . . 0.673 ' H ' HG22 ' A' ' 876' ' ' VAL . 2.2 tpp . . . . . 0 C--N 1.326 -0.442 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.516 -179.692 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.232 0 CA-C-O 120.482 -0.066 . . . . 0.0 113.039 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 1.7 p90 -63.52 -22.11 66.71 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.982 0.42 . . . . 0.0 111.541 -174.836 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 885' ' ' ARG . . . . . 0.435 ' H ' ' HG3' ' A' ' 885' ' ' ARG . 0.2 OUTLIER -66.27 -31.8 72.83 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.865 0.364 . . . . 0.0 110.139 176.594 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -69.39 -49.59 53.89 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 178.618 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.57 -39.62 94.26 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.072 0.463 . . . . 0.0 110.935 179.797 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 888' ' ' GLN . . . . . 0.788 ' HA ' ' HD3' ' A' ' 891' ' ' ARG . 1.4 tp-100 -61.01 -45.51 94.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.972 175.23 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.34 -42.95 96.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.777 179.564 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 890' ' ' ILE . . . . . 0.507 HG22 ' HB3' ' A' ' 895' ' ' LEU . 11.4 mm -58.69 -52.3 61.59 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.024 179.657 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 891' ' ' ARG . . . . . 0.788 ' HD3' ' HA ' ' A' ' 888' ' ' GLN . 0.4 OUTLIER -68.38 -30.09 68.94 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.42 -178.153 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -74.23 -34.85 63.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.594 -177.996 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.16 -46.73 32.29 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.838 177.608 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 133.23 89.01 0.38 Allowed Glycine 0 N--CA 1.443 -0.89 0 C-N-CA 120.638 -0.792 . . . . 0.0 112.42 179.534 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 895' ' ' LEU . . . . . 0.507 ' HB3' HG22 ' A' ' 890' ' ' ILE . 0.0 OUTLIER -77.93 150.26 34.06 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.041 0.448 . . . . 0.0 110.783 177.918 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -135.54 13.74 3.46 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.985 -178.569 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 897' ' ' LEU . . . . . 0.721 HD11 HG23 ' A' ' 872' ' ' VAL . 1.7 pt? -149.03 154.41 39.48 Favored Pre-proline 0 C--N 1.32 -0.706 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.409 -173.609 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 898' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 897' ' ' LEU . 18.4 Cg_exo -67.2 122.57 9.87 Favored 'Trans proline' 0 C--O 1.238 0.517 0 C-N-CA 122.873 2.382 . . . . 0.0 112.153 178.346 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 899' ' ' VAL . . . . . 0.828 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 18.9 t -103.19 108.3 24.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 121.266 0.555 . . . . 0.0 110.451 178.048 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 900' ' ' ILE . . . . . 0.481 ' O ' ' HA ' ' A' ' 873' ' ' LEU . 8.1 mt -96.15 102.84 14.0 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.717 178.355 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -89.94 124.71 7.55 Favored Glycine 0 N--CA 1.44 -1.049 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.475 -176.739 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 902' ' ' VAL . . . . . 0.635 ' HB ' HD12 ' A' ' 923' ' ' LEU . 0.1 OUTLIER -103.33 106.84 20.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 174.438 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 903' ' ' THR . . . . . 0.424 HG22 HG12 ' A' ' 876' ' ' VAL . 17.8 p -108.53 144.63 35.94 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.063 -173.447 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 904' ' ' ALA . . . . . 0.494 ' HA ' ' HB2' ' A' ' 925' ' ' LYS . . . -74.59 103.26 4.83 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.789 -0.364 . . . . 0.0 110.586 177.95 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 42.34 73.33 0.14 Allowed 'General case' 0 N--CA 1.468 0.44 0 O-C-N 124.225 0.953 . . . . 0.0 112.854 176.428 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -81.2 -14.08 57.92 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.244 177.839 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 51.8 mt 74.29 -60.44 0.52 Allowed 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.501 179.135 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -107.64 54.97 0.65 Allowed 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 175.085 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -44.71 -46.74 10.52 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.506 -0.77 . . . . 0.0 112.287 -177.09 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 910' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -44.97 95.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.809 0.338 . . . . 0.0 111.413 -177.829 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.82 -38.26 79.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.012 0.434 . . . . 0.0 110.462 -178.847 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 912' ' ' GLN . . . . . 0.648 ' O ' ' HG2' ' A' ' 916' ' ' GLU . 1.7 tt0 -60.81 -45.91 92.59 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.0 176.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -57.76 -35.27 70.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.305 178.523 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 61.7 m -68.72 -35.64 77.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.475 177.811 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 915' ' ' LEU . . . . . 0.488 ' HA ' HD22 ' A' ' 915' ' ' LEU . 0.3 OUTLIER -70.17 -32.69 70.75 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.055 0.455 . . . . 0.0 110.424 177.769 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 916' ' ' GLU . . . . . 0.648 ' HG2' ' O ' ' A' ' 912' ' ' GLN . 53.3 mm-40 -67.9 -38.72 83.32 Favored 'General case' 0 C--O 1.226 -0.178 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.651 176.844 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 50.06 24.66 1.45 Allowed 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.379 0.671 . . . . 0.0 112.755 176.55 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 918' ' ' GLY . . . . . 0.46 ' HA3' ' HB3' ' A' ' 891' ' ' ARG . . . -147.49 25.94 1.52 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.143 -177.502 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 919' ' ' MET . . . . . 0.828 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 2.1 mtt -118.18 -116.89 0.32 Allowed 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.614 0.245 . . . . 0.0 110.671 -175.234 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 920' ' ' ASP . . . . . 0.519 ' H ' ' HB3' ' A' ' 919' ' ' MET . 3.6 t70 175.56 -59.36 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.261 177.017 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 37.6 m -136.6 157.81 45.91 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.876 178.222 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 922' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -132.12 142.58 49.55 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.688 0.28 . . . . 0.0 111.031 -177.343 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 923' ' ' LEU . . . . . 0.635 HD12 ' HB ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -145.14 170.35 16.4 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 174.362 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 17.3 m -93.33 153.87 18.3 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 120.636 0.255 . . . . 0.0 111.13 -178.173 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 925' ' ' LYS . . . . . 0.588 ' HE3' ' HB3' ' A' ' 875' ' ' ASP . 0.0 OUTLIER -50.02 -49.2 76.34 Favored Pre-proline 0 CA--C 1.538 0.513 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 -178.64 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 926' ' ' PRO . . . . . 0.498 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 16.0 Cg_endo -58.15 103.03 0.14 Allowed 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 121.984 1.789 . . . . 0.0 111.714 174.558 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -125.73 154.72 34.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.709 -175.169 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 928' ' ' THR . . . . . 0.44 ' H ' HG12 ' A' ' 931' ' ' VAL . 0.8 OUTLIER -115.03 161.32 18.51 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.129 177.676 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 929' ' ' LEU . . . . . 0.452 HD23 ' HG2' ' A' ' 843' ' ' GLN . 0.6 OUTLIER -61.74 -42.24 98.71 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.849 0.357 . . . . 0.0 110.418 178.877 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -60.21 -50.01 75.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.275 -179.542 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 931' ' ' VAL . . . . . 0.44 HG12 ' H ' ' A' ' 928' ' ' THR . 1.4 p -71.65 -30.46 38.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-O 120.516 0.198 . . . . 0.0 111.254 -177.592 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 932' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -70.48 -38.42 73.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 177.723 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 933' ' ' LYS . . . . . 0.511 ' HA ' HD21 ' A' ' 847' ' ' LEU . 1.5 tmtm? -67.82 -42.16 81.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.02 176.163 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -48.96 79.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.929 179.383 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 11.9 m -63.72 -43.95 95.02 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.333 -179.239 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 936' ' ' LEU . . . . . 0.513 HD22 HD22 ' A' ' 847' ' ' LEU . 0.0 OUTLIER -62.22 -56.83 14.76 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.773 179.995 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 25.5 m -59.04 -48.23 82.35 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.708 -178.542 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.02 -45.97 86.04 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.353 -175.283 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 939' ' ' TYR . . . . . 0.451 ' HA ' ' HB3' ' A' ' 942' ' ' ARG . 0.6 OUTLIER -80.81 -31.48 35.59 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.696 -0.402 . . . . 0.0 111.524 -176.647 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -61.26 -43.75 98.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.94 0.4 . . . . 0.0 110.451 176.407 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 941' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.45 -34.59 70.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.341 177.736 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 942' ' ' ARG . . . . . 0.451 ' HB3' ' HA ' ' A' ' 939' ' ' TYR . 6.8 ttt85 -65.08 -48.06 75.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.979 -177.906 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 26.9 m -71.27 -30.76 41.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.799 0.333 . . . . 0.0 110.558 -178.412 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 19.5 mtp85 -71.38 -37.5 71.58 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.819 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.15 -23.95 35.31 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.683 0.278 . . . . 0.0 111.135 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 57.1 m -76.24 -28.54 57.18 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.192 0.52 . . . . 0.0 110.281 175.576 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 1.7 mtp180 -84.94 -19.52 32.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.571 173.144 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 27.7 t0 . . . . . 0 CA--C 1.521 -0.165 0 CA-C-N 114.587 -1.188 . . . . 0.0 110.843 -177.759 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 705' ' ' SER . . . . . 0.505 ' HA ' ' HA3' ' A' ' 730' ' ' GLY . 2.6 m . . . . . 0 CA--C 1.533 0.325 0 CA-C-O 121.135 0.493 . . . . 0.0 111.846 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 100.1 -23.09 37.29 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.872 -0.68 . . . . 0.0 113.098 174.788 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 17.4 mmtt -82.3 153.0 26.06 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 122.803 -0.234 . . . . 0.0 110.438 -179.7 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 708' ' ' ARG . . . . . 0.487 ' HG2' HG13 ' A' ' 732' ' ' VAL . 0.0 OUTLIER -103.38 159.42 15.58 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.871 0.367 . . . . 0.0 110.863 -176.828 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 709' ' ' CYS . . . . . 0.495 ' HB2' HG22 ' A' ' 731' ' ' ILE . 0.0 OUTLIER -142.44 119.54 11.4 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.635 175.049 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 710' ' ' TRP . . . . . . . . . . . . . 86.5 m95 -98.21 123.57 42.35 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.894 0.378 . . . . 0.0 110.047 -179.712 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 711' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 711' ' ' LEU . 0.6 OUTLIER -119.99 123.33 43.22 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 121.527 0.679 . . . . 0.0 110.899 -179.164 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -105.82 32.73 4.16 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.111 175.364 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 713' ' ' VAL . . . . . 0.766 HG13 ' HB2' ' A' ' 750' ' ' ASP . 4.0 t -79.53 102.28 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.894 179.173 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 714' ' ' ARG . . . . . 0.537 ' H ' ' HB3' ' A' ' 750' ' ' ASP . 2.9 mtp180 -73.35 -18.28 61.2 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.682 -178.904 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -77.36 111.1 12.67 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.591 -0.732 . . . . 0.0 109.789 176.355 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 716' ' ' ALA . . . . . 0.572 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -63.61 -37.85 88.9 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.769 0.285 . . . . 0.0 111.769 -173.579 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.89 -47.31 75.27 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.008 0.432 . . . . 0.0 110.372 179.64 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 718' ' ' LEU . . . . . 0.49 HD11 ' HA ' ' A' ' 786' ' ' ALA . 0.2 OUTLIER -69.22 -43.54 73.88 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.198 179.229 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 719' ' ' CYS . . . . . 0.572 ' SG ' ' HA ' ' A' ' 716' ' ' ALA . 2.5 p -65.5 -46.54 79.28 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.094 -176.263 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 720' ' ' GLN . . . . . 0.407 ' N ' ' SG ' ' A' ' 719' ' ' CYS . 2.0 tt0 -61.66 -43.32 99.07 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 121.041 -0.263 . . . . 0.0 110.692 -179.73 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -59.53 -57.65 12.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.029 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 9.5 mt -56.73 -46.1 81.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.078 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 723' ' ' GLU . . . . . 0.546 ' HA ' HG11 ' A' ' 733' ' ' VAL . 0.0 OUTLIER -59.85 -40.42 88.48 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.861 -177.264 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 724' ' ' THR . . . . . 0.418 ' HA ' ' HG2' ' A' ' 727' ' ' GLN . 9.6 m -67.55 -43.28 81.07 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.793 0.33 . . . . 0.0 111.071 -179.223 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 48.7 m -64.2 -32.92 74.69 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.657 -179.239 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 726' ' ' LEU . . . . . . . . . . . . . 3.5 mt -82.15 -45.79 14.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.576 -178.432 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 727' ' ' GLN . . . . . 0.418 ' HG2' ' HA ' ' A' ' 724' ' ' THR . 13.8 pt20 -64.95 -22.23 66.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.698 0.285 . . . . 0.0 111.343 -177.43 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 1.7 ptt-85 -65.61 -21.88 66.62 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.109 0.481 . . . . 0.0 110.629 177.186 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 3.2 m -100.98 16.13 26.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.15 0.5 . . . . 0.0 110.727 178.904 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 730' ' ' GLY . . . . . 0.505 ' HA3' ' HA ' ' A' ' 705' ' ' SER . . . 83.74 14.88 71.93 Favored Glycine 0 N--CA 1.449 -0.451 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.921 176.333 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 731' ' ' ILE . . . . . 0.495 HG22 ' HB2' ' A' ' 709' ' ' CYS . 8.0 mm -95.37 105.28 16.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-O 120.841 0.353 . . . . 0.0 110.114 179.491 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 732' ' ' VAL . . . . . 0.487 HG13 ' HG2' ' A' ' 708' ' ' ARG . 1.1 p -69.07 110.14 2.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.684 0.754 . . . . 0.0 110.555 -177.061 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 733' ' ' VAL . . . . . 0.546 HG11 ' HA ' ' A' ' 723' ' ' GLU . 0.1 OUTLIER -87.47 134.63 27.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.755 -178.138 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -138.72 139.15 38.27 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.555 -178.656 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 1.9 m -69.12 123.49 21.24 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.641 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 33.1 t80 -84.66 101.75 12.41 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.886 -178.375 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.2 -50.46 4.13 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.841 176.951 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -169.6 42.9 0.21 Allowed Glycine 0 N--CA 1.447 -0.592 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.352 178.892 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 13.9 mp0 -86.39 175.1 8.58 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.731 0.301 . . . . 0.0 110.871 -177.331 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.38 146.16 50.04 Favored Pre-proline 0 C--N 1.325 -0.496 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.001 -176.508 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 741' ' ' PRO . . . . . 0.535 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 85.3 Cg_endo -83.82 146.91 11.92 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 122.809 2.339 . . . . 0.0 112.731 178.365 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 742' ' ' THR . . . . . 0.694 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.2 OUTLIER -133.18 141.91 42.49 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.407 178.538 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 743' ' ' PRO . . . . . 0.694 ' HD2' HG22 ' A' ' 742' ' ' THR . 38.2 Cg_endo -66.57 -9.23 23.53 Favored 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 123.025 2.483 . . . . 0.0 113.447 -178.649 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -107.21 -3.55 19.69 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.963 0.411 . . . . 0.0 110.456 176.928 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -102.36 144.12 31.25 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.847 -174.221 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 3.4 p -114.9 139.49 40.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.44 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 747' ' ' LEU . . . . . 0.504 HD12 ' HB2' ' A' ' 757' ' ' TRP . 0.1 OUTLIER -104.17 110.7 23.0 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.28 177.893 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -97.26 107.53 20.12 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 176.388 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 749' ' ' THR . . . . . 0.401 HG21 HG11 ' A' ' 753' ' ' VAL . 17.6 p -104.56 148.57 26.35 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.001 0.429 . . . . 0.0 111.735 -172.715 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 750' ' ' ASP . . . . . 0.766 ' HB2' HG13 ' A' ' 713' ' ' VAL . 2.9 t70 -96.52 108.78 21.41 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 170.389 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 751' ' ' GLU . . . . . 0.476 ' HB3' ' H ' ' A' ' 752' ' ' VAL . 18.2 mm-40 62.93 -147.3 0.36 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.238 -174.757 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 752' ' ' VAL . . . . . 0.476 ' H ' ' HB3' ' A' ' 751' ' ' GLU . 2.1 t -79.86 133.78 28.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.758 -174.367 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 753' ' ' VAL . . . . . 0.401 HG11 HG21 ' A' ' 749' ' ' THR . 11.3 p -117.97 141.32 37.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.417 178.291 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.67 53.31 2.72 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.225 -178.804 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -157.85 131.76 8.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.422 -179.193 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 756' ' ' LYS . . . . . 0.487 ' HA ' ' HD2' ' A' ' 756' ' ' LYS . 0.1 OUTLIER -91.01 81.9 5.61 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.229 0.537 . . . . 0.0 110.114 177.869 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 757' ' ' TRP . . . . . 0.535 ' CH2' ' HA ' ' A' ' 741' ' ' PRO . 64.3 t-105 -65.24 124.57 22.53 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.604 178.304 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -131.49 62.56 1.62 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.206 0.527 . . . . 0.0 110.227 176.394 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 759' ' ' GLY . . . . . . . . . . . . . . . -109.8 -118.98 4.07 Favored Glycine 0 N--CA 1.444 -0.783 0 C-N-CA 120.786 -0.721 . . . . 0.0 111.565 178.397 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -78.45 -49.66 13.05 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.078 0.466 . . . . 0.0 110.102 177.145 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -168.16 164.64 13.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.533 179.425 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 2.5 p -141.1 126.66 19.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.453 175.195 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 763' ' ' VAL . . . . . 0.408 HG11 HD13 ' A' ' 791' ' ' LEU . 3.6 t -119.52 114.7 45.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.631 -176.308 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 764' ' ' THR . . . . . . . . . . . . . 23.7 m -95.45 113.29 24.93 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.226 -179.114 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 765' ' ' PHE . . . . . 0.443 ' HA ' ' O ' ' A' ' 783' ' ' HIS . 30.4 m-85 -84.85 109.3 18.0 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 174.998 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 766' ' ' CYS . . . . . 0.564 ' O ' ' HA ' ' A' ' 784' ' ' SER . 0.0 OUTLIER -96.48 153.9 17.58 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.911 -174.075 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 11.9 ptt85 -140.39 -37.98 0.45 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.123 176.231 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.26 34.52 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -179.313 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 769' ' ' HIS . . . . . 0.438 ' HB2' ' CD ' ' A' ' 751' ' ' GLU . 0.1 OUTLIER -135.65 -71.41 0.47 Allowed 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 110.089 -0.337 . . . . 0.0 110.089 174.016 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 3.9 mt 64.09 101.19 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.403 176.264 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 771' ' ' GLY . . . . . 0.452 ' N ' HG22 ' A' ' 752' ' ' VAL . . . -125.13 -4.92 6.95 Favored Glycine 0 N--CA 1.451 -0.306 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.014 176.731 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 772' ' ' ILE . . . . . 0.434 HG23 ' HD2' ' A' ' 773' ' ' PRO . 1.1 mp -104.33 146.45 32.62 Favored Pre-proline 0 C--N 1.325 -0.461 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 178.266 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 773' ' ' PRO . . . . . 0.519 ' HB2' ' H ' ' A' ' 774' ' ' LEU . 32.8 Cg_exo -60.01 -100.77 0.0 OUTLIER 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.932 2.421 . . . . 0.0 112.627 179.387 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 774' ' ' LEU . . . . . 0.877 ' HA ' HG13 ' A' ' 782' ' ' VAL . 0.4 OUTLIER 172.49 -167.52 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -179.582 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 775' ' ' GLU . . . . . 0.671 ' HG3' ' HA ' ' A' ' 781' ' ' TRP . 1.5 mp0 -61.42 69.24 0.01 OUTLIER 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.824 0.821 . . . . 0.0 112.393 173.455 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.04 6.02 2.36 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 114.573 -1.194 . . . . 0.0 108.771 173.441 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 777' ' ' ALA . . . . . 0.626 ' HB3' ' HB2' ' A' ' 780' ' ' GLU . . . -127.72 162.49 48.97 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-N 114.745 -1.116 . . . . 0.0 109.409 -179.625 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 778' ' ' PRO . . . . . 0.557 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 55.6 Cg_endo -68.99 66.67 1.31 Allowed 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 122.977 2.451 . . . . 0.0 113.474 -177.196 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 118.48 31.23 1.54 Allowed Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.631 178.038 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 780' ' ' GLU . . . . . 0.626 ' HB2' ' HB3' ' A' ' 777' ' ' ALA . 1.4 tt0 -115.29 129.04 56.5 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 178.445 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 781' ' ' TRP . . . . . 0.671 ' HA ' ' HG3' ' A' ' 775' ' ' GLU . 26.6 m95 -134.3 144.58 48.4 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 -179.356 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 782' ' ' VAL . . . . . 0.877 HG13 ' HA ' ' A' ' 774' ' ' LEU . 10.7 m -134.55 151.76 32.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 120.834 0.35 . . . . 0.0 110.63 172.613 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 783' ' ' HIS . . . . . 0.443 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.3 OUTLIER -162.98 121.88 2.12 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.664 176.362 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 784' ' ' SER . . . . . 0.564 ' HA ' ' O ' ' A' ' 766' ' ' CYS . 0.3 OUTLIER -88.65 100.91 13.47 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.582 177.274 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 785' ' ' VAL . . . . . 0.893 HG13 ' H ' ' A' ' 787' ' ' ALA . 2.0 p 178.55 170.34 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.158 -0.473 . . . . 0.0 109.893 -173.501 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 786' ' ' ALA . . . . . 0.49 ' HA ' HD11 ' A' ' 718' ' ' LEU . . . -103.59 32.23 3.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.575 0.226 . . . . 0.0 111.265 179.83 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 787' ' ' ALA . . . . . 0.893 ' H ' HG13 ' A' ' 785' ' ' VAL . . . 57.2 70.45 1.36 Allowed Pre-proline 0 N--CA 1.468 0.43 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.145 177.906 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 788' ' ' PRO . . . . . 0.615 ' HD2' ' OE1' ' A' ' 790' ' ' GLU . 24.2 Cg_exo -63.29 -50.15 3.9 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.727 2.284 . . . . 0.0 112.534 -178.213 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 6.5 p-80 -177.12 -29.5 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -178.01 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 790' ' ' GLU . . . . . 0.615 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -74.22 -50.38 19.37 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 111.833 0.308 . . . . 0.0 111.833 -171.105 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 791' ' ' LEU . . . . . 0.487 ' N ' ' HD2' ' A' ' 792' ' ' PRO . 0.2 OUTLIER -65.4 -47.47 69.44 Favored Pre-proline 0 CA--C 1.538 0.503 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -176.81 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 792' ' ' PRO . . . . . 0.487 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 9.2 Cg_endo -58.35 -32.01 95.15 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 121.254 1.302 . . . . 0.0 112.03 174.013 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -70.45 -37.0 74.26 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 120.83 0.347 . . . . 0.0 110.749 177.222 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 794' ' ' LEU . . . . . 0.413 HD13 ' HG2' ' A' ' 797' ' ' ARG . 0.1 OUTLIER -61.51 -42.26 98.55 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.021 176.016 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 795' ' ' LEU . . . . . 0.438 HD22 ' HA ' ' A' ' 795' ' ' LEU . 0.1 OUTLIER -59.66 -42.56 93.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.395 178.354 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -64.76 -37.64 88.27 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.002 178.478 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 797' ' ' ARG . . . . . 0.413 ' HG2' HD13 ' A' ' 794' ' ' LEU . 0.0 OUTLIER -70.3 -26.5 63.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.393 179.075 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -69.12 -36.45 73.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.35 0.595 . . . . 0.0 109.915 177.137 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -77.34 -18.53 57.35 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.195 177.27 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 800' ' ' LEU . . . . . 0.506 HD12 ' HA ' ' A' ' 800' ' ' LEU . 2.9 tp . . . . . 0 N--CA 1.465 0.296 0 C-N-CA 124.244 1.018 . . . . 0.0 112.904 175.455 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 12.1 t0 . . . . . 0 N--CA 1.453 -0.315 0 CA-C-O 121.084 0.469 . . . . 0.0 110.353 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 17.5 ttm -109.8 108.25 18.51 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.734 178.582 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 826' ' ' MET . . . . . 0.404 ' O ' HG23 ' A' ' 869' ' ' ILE . 0.5 OUTLIER -95.72 108.79 21.13 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.19 0.519 . . . . 0.0 110.139 -179.346 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 827' ' ' ILE . . . . . . . . . . . . . 1.6 mt -110.32 125.65 67.57 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.299 179.112 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 828' ' ' LEU . . . . . 0.519 HD23 ' HB3' ' A' ' 852' ' ' LYS . 1.7 tm? -94.9 123.09 38.17 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.859 -178.126 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -117.93 118.03 56.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.05 0.452 . . . . 0.0 110.651 179.704 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 830' ' ' VAL . . . . . 0.817 HG23 ' HA ' ' A' ' 874' ' ' SER . 0.0 OUTLIER -119.52 84.92 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.498 178.497 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 831' ' ' ASP . . . . . 0.918 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 27.1 t0 -95.28 120.62 35.82 Favored 'General case' 0 CA--C 1.515 -0.39 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 -179.685 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 832' ' ' ASP . . . . . 0.474 ' OD2' ' HB2' ' A' ' 877' ' ' ASN . 0.0 OUTLIER -52.69 -27.49 17.68 Favored 'General case' 0 CA--C 1.537 0.466 0 O-C-N 123.482 0.489 . . . . 0.0 112.187 -177.582 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 833' ' ' HIS . . . . . 0.441 ' HA ' ' HD2' ' A' ' 834' ' ' PRO . 0.5 OUTLIER -98.43 109.56 53.09 Favored Pre-proline 0 C--N 1.325 -0.471 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 -177.99 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 834' ' ' PRO . . . . . 0.441 ' HD2' ' HA ' ' A' ' 833' ' ' HIS . 9.5 Cg_endo -51.59 -44.18 45.77 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 123.443 2.762 . . . . 0.0 113.445 -175.819 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 835' ' ' ILE . . . . . 0.47 ' HA ' HD13 ' A' ' 835' ' ' ILE . 0.2 OUTLIER -68.32 -39.17 80.56 Favored 'Isoleucine or valine' 0 C--O 1.237 0.415 0 CA-C-O 120.754 0.311 . . . . 0.0 110.972 -177.222 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 836' ' ' ASN . . . . . 0.565 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 1.2 t-20 -73.55 -39.83 64.42 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 179.618 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 837' ' ' ARG . . . . . 0.918 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 1.5 ttt180 -53.85 -42.62 68.74 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.171 176.473 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.56 -43.52 89.6 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.839 178.841 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.38 -48.17 71.0 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.143 -172.834 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 840' ' ' LEU . . . . . 0.565 ' HG ' ' O ' ' A' ' 836' ' ' ASN . 0.3 OUTLIER -74.38 -27.27 60.58 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.502 -0.479 . . . . 0.0 111.016 -179.072 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -68.88 -29.9 68.29 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.138 0.494 . . . . 0.0 109.848 175.364 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -64.77 -42.55 95.02 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.729 174.842 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 843' ' ' GLN . . . . . 0.584 ' HG2' HD23 ' A' ' 929' ' ' LEU . 41.5 mt-30 -62.75 -45.49 92.47 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.267 175.859 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 844' ' ' LEU . . . . . 0.613 HD12 HD11 ' A' ' 932' ' ' ILE . 0.1 OUTLIER -58.24 -46.16 86.43 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.244 179.008 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -64.15 -39.75 97.43 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 121.09 -0.576 . . . . 0.0 112.365 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 5.8 m -67.26 -23.44 65.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.884 0.373 . . . . 0.0 110.959 179.101 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 81.4 mt -75.13 -21.43 58.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.927 0.394 . . . . 0.0 110.455 177.445 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 106.62 3.7 37.28 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.618 177.494 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 849' ' ' TYR . . . . . 0.584 ' HB2' HD23 ' A' ' 844' ' ' LEU . 39.2 m-85 -95.55 140.4 30.45 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.936 0.398 . . . . 0.0 110.753 -178.305 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 5.3 mp0 -76.43 115.66 16.38 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.066 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 851' ' ' CYS . . . . . 0.471 ' HB3' HD22 ' A' ' 844' ' ' LEU . 0.0 OUTLIER -107.97 135.51 49.23 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.774 -175.32 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 852' ' ' LYS . . . . . 0.519 ' HB3' HD23 ' A' ' 828' ' ' LEU . 0.0 OUTLIER -107.17 110.74 22.89 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 173.463 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 853' ' ' THR . . . . . 0.616 HG22 ' HG3' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -90.69 121.55 32.69 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.991 -0.55 . . . . 0.0 112.479 -171.563 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 854' ' ' ALA . . . . . 0.462 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -147.97 171.27 16.07 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.062 174.688 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 13.9 p-10 -144.95 75.8 1.46 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.754 0.788 . . . . 0.0 111.258 178.142 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 856' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -171.41 136.1 0.98 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.49 177.323 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -66.69 -41.44 93.83 Favored Glycine 0 N--CA 1.448 -0.512 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.895 -178.633 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 858' ' ' VAL . . . . . 0.404 ' H ' HG23 ' A' ' 858' ' ' VAL . 1.5 t -74.29 -36.24 42.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.645 0.26 . . . . 0.0 111.285 -177.418 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -63.18 -23.95 67.66 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.847 0.356 . . . . 0.0 111.196 -179.194 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -61.82 -35.61 78.73 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.151 0.5 . . . . 0.0 110.347 176.007 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 861' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.05 -35.8 61.87 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.478 177.074 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -63.01 -49.32 75.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.528 179.106 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 6.5 p -66.13 -31.3 53.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.941 178.862 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 864' ' ' LEU . . . . . 0.662 ' HG ' HD11 ' A' ' 895' ' ' LEU . 0.7 OUTLIER -59.55 -40.77 88.37 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.061 0.458 . . . . 0.0 110.327 175.041 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 1.5 m -79.27 -30.22 42.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.99 -179.135 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.44 -60.53 2.37 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.309 0.576 . . . . 0.0 110.773 178.489 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 867' ' ' ASN . . . . . 0.452 ' HB3' ' H ' ' A' ' 868' ' ' HIS . 1.4 t-20 -104.95 -119.44 0.22 Allowed 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 177.914 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 868' ' ' HIS . . . . . 0.452 ' H ' ' HB3' ' A' ' 867' ' ' ASN . 0.1 OUTLIER -163.8 -45.58 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 110.499 -0.186 . . . . 0.0 110.499 173.183 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 869' ' ' ILE . . . . . 0.447 ' HB ' ' O ' ' A' ' 868' ' ' HIS . 2.7 mp 73.32 146.93 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 O-C-N 123.613 0.571 . . . . 0.0 111.293 174.977 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 65.2 m-20 -85.54 -49.97 7.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.204 0.526 . . . . 0.0 110.672 -179.491 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 871' ' ' ILE . . . . . 0.69 HG12 ' HD2' ' A' ' 939' ' ' TYR . 0.8 OUTLIER -135.42 133.64 52.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.936 -0.575 . . . . 0.0 109.905 -179.729 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 872' ' ' VAL . . . . . 0.43 HG13 HD12 ' A' ' 828' ' ' LEU . 64.6 t -115.87 127.94 73.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.592 -178.315 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 873' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -120.14 115.07 22.93 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.144 0.497 . . . . 0.0 110.196 175.298 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 874' ' ' SER . . . . . 0.817 ' HA ' HG23 ' A' ' 830' ' ' VAL . 0.3 OUTLIER -100.19 125.93 46.4 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.162 179.364 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 875' ' ' ASP . . . . . 0.732 ' HB3' ' HA ' ' A' ' 831' ' ' ASP . 1.2 t70 -109.6 123.89 50.22 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.336 0.588 . . . . 0.0 111.012 -179.291 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 876' ' ' VAL . . . . . 0.421 HG23 HG23 ' A' ' 903' ' ' THR . 0.1 OUTLIER -116.29 94.56 3.18 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.285 177.827 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 877' ' ' ASN . . . . . 0.474 ' HB2' ' OD2' ' A' ' 832' ' ' ASP . 68.6 m-80 -63.11 -27.18 69.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.792 174.28 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.533 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.447 174.893 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 -0.131 0 N-CA-C 112.017 -0.433 . . . . 0.0 112.017 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -160.78 -49.01 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -61.6 -46.48 89.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.877 179.436 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.93 -43.9 82.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.72 -178.031 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.23 -47.2 83.5 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.242 -179.021 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -59.41 -44.21 92.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.11 -179.314 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -70.13 -38.28 75.52 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.298 -177.518 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 890' ' ' ILE . . . . . 0.702 HG23 HD13 ' A' ' 895' ' ' LEU . 9.8 mt -59.63 -49.21 84.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.041 0.448 . . . . 0.0 110.985 -179.909 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 891' ' ' ARG . . . . . . . . . . . . . 35.9 ptt85 -75.69 -23.67 56.18 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.102 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.25 -44.66 94.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.158 176.854 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.15 -31.06 64.04 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.943 174.55 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 90.7 66.64 1.18 Allowed Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.25 177.088 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 895' ' ' LEU . . . . . 0.702 HD13 HG23 ' A' ' 890' ' ' ILE . 0.1 OUTLIER -65.78 111.54 3.29 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 110.016 -0.365 . . . . 0.0 110.016 177.889 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.63 -11.99 54.86 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.755 -175.668 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 897' ' ' LEU . . . . . 0.599 HD11 HD21 ' A' ' 864' ' ' LEU . 0.0 OUTLIER -92.64 148.03 35.37 Favored Pre-proline 0 C--N 1.323 -0.548 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.403 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -60.08 128.62 27.11 Favored 'Trans proline' 0 C--O 1.239 0.552 0 C-N-CA 122.844 2.363 . . . . 0.0 112.731 -177.274 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 899' ' ' VAL . . . . . 0.695 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 1.8 t -111.56 129.55 66.73 Favored 'Isoleucine or valine' 0 C--O 1.236 0.387 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.922 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 900' ' ' ILE . . . . . 0.505 HG12 ' CE2' ' A' ' 939' ' ' TYR . 0.0 OUTLIER -107.57 111.31 35.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.096 176.978 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -97.0 105.97 3.28 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.14 -177.201 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 902' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -93.32 130.41 42.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 177.611 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 903' ' ' THR . . . . . 0.642 HG21 ' HG2' ' A' ' 909' ' ' GLU . 0.2 OUTLIER -123.46 138.36 54.6 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.199 -178.431 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 904' ' ' ALA . . . . . 0.829 ' HA ' ' HB2' ' A' ' 925' ' ' LYS . . . -79.08 117.26 19.97 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.973 176.799 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 61.73 54.93 2.81 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-O 121.327 0.584 . . . . 0.0 110.323 -178.552 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 906' ' ' ALA . . . . . 0.485 ' HB1' ' HB2' ' A' ' 909' ' ' GLU . . . -69.94 85.23 0.51 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.465 178.732 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 907' ' ' LEU . . . . . 0.464 HD13 ' HA ' ' A' ' 907' ' ' LEU . 0.8 OUTLIER -83.91 -41.1 17.75 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.891 -178.979 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -127.7 4.02 6.1 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-O 121.412 0.625 . . . . 0.0 110.472 -178.378 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 909' ' ' GLU . . . . . 0.642 ' HG2' HG21 ' A' ' 903' ' ' THR . 5.7 mp0 -69.7 -17.01 63.44 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.794 -173.136 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 910' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.11 -37.8 84.51 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.14 0.495 . . . . 0.0 109.921 176.393 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.07 -34.42 66.24 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.806 177.186 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 6.4 mm100 -65.06 -36.82 85.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.483 177.036 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -62.34 -41.45 98.59 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.454 177.182 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 58.8 m -70.89 -31.15 67.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.748 178.783 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 915' ' ' LEU . . . . . 0.419 HD12 ' HA ' ' A' ' 915' ' ' LEU . 2.9 tp -70.67 -52.12 23.2 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.065 -179.881 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -74.18 -44.76 52.2 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.336 -177.302 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 51.22 46.6 26.22 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.336 -175.546 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -115.89 24.86 9.86 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.785 -177.127 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 919' ' ' MET . . . . . 0.695 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -141.15 -94.71 0.14 Allowed 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.955 -0.298 . . . . 0.0 110.878 -177.876 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 920' ' ' ASP . . . . . 0.489 ' H ' ' CG ' ' A' ' 919' ' ' MET . 29.7 t70 171.42 -57.2 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 123.934 0.894 . . . . 0.0 108.656 176.176 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -133.17 163.13 29.96 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.517 176.046 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 922' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -123.94 136.63 54.45 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.412 176.466 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 923' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -123.45 173.45 8.0 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.554 -179.094 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 924' ' ' SER . . . . . 0.812 ' HB2' ' HD2' ' A' ' 926' ' ' PRO . 0.4 OUTLIER -95.11 158.77 15.32 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.336 179.709 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 925' ' ' LYS . . . . . 0.829 ' HB2' ' HA ' ' A' ' 904' ' ' ALA . 0.0 OUTLIER -60.34 -46.95 97.64 Favored Pre-proline 0 CA--C 1.538 0.516 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.544 173.537 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 926' ' ' PRO . . . . . 0.812 ' HD2' ' HB2' ' A' ' 924' ' ' SER . 52.8 Cg_exo -58.05 88.82 0.05 OUTLIER 'Trans proline' 0 C--N 1.36 1.142 0 C-N-CA 122.161 1.907 . . . . 0.0 112.552 174.122 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 12.6 t -128.56 114.62 34.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.225 177.709 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.74 -177.08 3.37 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.83 -179.088 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 929' ' ' LEU . . . . . 0.584 HD23 ' HG2' ' A' ' 843' ' ' GLN . 1.0 OUTLIER -54.07 -45.75 71.81 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 111.917 0.339 . . . . 0.0 111.917 -175.994 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.98 -36.19 81.62 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.131 0.491 . . . . 0.0 110.669 -177.499 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 69.2 t -76.01 -43.0 38.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.588 -175.249 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 932' ' ' ILE . . . . . 0.613 HD11 HD12 ' A' ' 844' ' ' LEU . 15.4 tt -63.01 -38.95 83.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 178.524 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 2.2 tmmt? -65.12 -48.42 73.68 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.407 178.179 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -59.26 -49.33 78.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.328 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 17.6 m -64.92 -44.02 90.91 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.526 -178.394 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 936' ' ' LEU . . . . . 0.496 HD21 ' HG ' ' A' ' 844' ' ' LEU . 0.8 OUTLIER -62.62 -43.33 99.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.452 179.7 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 937' ' ' THR . . . . . 0.421 ' O ' ' HG2' ' A' ' 941' ' ' GLU . 27.5 m -68.34 -36.25 78.97 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.208 -179.776 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 3.5 tp -64.55 -35.42 80.93 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.956 0.408 . . . . 0.0 110.748 178.493 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 939' ' ' TYR . . . . . 0.69 ' HD2' HG12 ' A' ' 871' ' ' ILE . 1.1 m-85 -79.17 -36.6 40.06 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.732 178.72 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -64.91 -41.6 95.44 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.928 179.211 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 941' ' ' GLU . . . . . 0.421 ' HG2' ' O ' ' A' ' 937' ' ' THR . 9.7 pt-20 -69.06 -36.07 77.26 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.159 -0.312 . . . . 0.0 110.159 177.518 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 942' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -49.17 78.48 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.801 179.093 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 30.9 m -72.38 -30.61 35.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 C-N-CA 120.821 -0.351 . . . . 0.0 110.717 179.774 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 1.9 ttt-85 -63.56 -50.34 69.89 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.895 179.246 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.07 -19.89 61.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.856 0.36 . . . . 0.0 111.278 -178.141 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 17.6 m -81.37 -24.84 36.76 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.061 0.457 . . . . 0.0 110.416 175.6 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -84.05 -53.51 5.49 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.2 0.524 . . . . 0.0 110.443 178.502 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.565 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.659 -174.73 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.467 0.378 0 CA-C-O 121.1 0.476 . . . . 0.0 110.995 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . -173.31 19.51 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.951 -0.643 . . . . 0.0 112.159 -179.787 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 8.6 mmtm -121.45 145.59 47.77 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 178.179 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 708' ' ' ARG . . . . . 0.523 ' HG2' HG13 ' A' ' 732' ' ' VAL . 24.3 mtm180 -102.13 161.77 13.43 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.372 0.605 . . . . 0.0 110.685 -178.549 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 1.6 m -135.77 110.5 8.68 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.241 -0.891 . . . . 0.0 108.822 170.552 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 710' ' ' TRP . . . . . 0.51 ' CZ3' ' HB ' ' A' ' 734' ' ' THR . 97.2 m95 -90.53 103.77 16.43 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.951 -175.489 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 711' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 711' ' ' LEU . 0.8 OUTLIER -102.3 120.48 40.56 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 121.596 0.713 . . . . 0.0 110.655 -177.969 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -104.29 43.46 1.1 Allowed 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.355 -0.839 . . . . 0.0 108.926 175.018 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 713' ' ' VAL . . . . . 0.746 ' HA ' ' CB ' ' A' ' 750' ' ' ASP . 16.4 t -101.42 124.18 54.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.426 -177.8 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 5.5 mtm-85 -108.43 0.57 21.12 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.404 0.621 . . . . 0.0 110.115 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -82.09 111.11 17.93 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.436 173.099 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -54.46 -55.03 33.09 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -171.685 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 717' ' ' SER . . . . . 0.417 ' O ' ' HB2' ' A' ' 721' ' ' PHE . 0.3 OUTLIER -60.4 -36.97 79.37 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.174 0.511 . . . . 0.0 110.926 -178.66 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 718' ' ' LEU . . . . . 0.594 ' HG ' ' HB2' ' A' ' 787' ' ' ALA . 0.9 OUTLIER -73.97 -49.81 22.82 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.206 -177.547 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 719' ' ' CYS . . . . . 0.452 ' O ' ' HB3' ' A' ' 723' ' ' GLU . 19.7 p -67.7 -44.09 78.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.622 -176.393 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.6 -43.65 98.47 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.101 -179.035 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 721' ' ' PHE . . . . . 0.417 ' HB2' ' O ' ' A' ' 717' ' ' SER . 0.8 OUTLIER -58.62 -55.97 28.2 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.911 0.386 . . . . 0.0 111.058 -179.806 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.36 -44.81 93.74 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.127 -177.214 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 723' ' ' GLU . . . . . 0.612 ' HA ' HG11 ' A' ' 733' ' ' VAL . 0.4 OUTLIER -60.68 -48.26 82.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.288 -176.247 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 724' ' ' THR . . . . . . . . . . . . . 8.3 m -63.48 -36.99 85.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.995 0.426 . . . . 0.0 111.087 -177.843 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 725' ' ' SER . . . . . 0.451 ' HA ' ' HD3' ' A' ' 728' ' ' ARG . 12.4 m -70.09 -37.11 75.32 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.203 -179.921 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 726' ' ' LEU . . . . . . . . . . . . . 20.9 mt -75.15 -43.94 49.6 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.239 -177.445 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -69.04 -10.63 58.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.133 0.492 . . . . 0.0 111.029 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 728' ' ' ARG . . . . . 0.451 ' HD3' ' HA ' ' A' ' 725' ' ' SER . 0.0 OUTLIER -67.84 -33.05 74.02 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.303 176.6 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.31 5.94 49.81 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.655 -176.152 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 730' ' ' GLY . . . . . . . . . . . . . . . 86.98 14.66 64.27 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.439 -0.886 . . . . 0.0 112.422 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 731' ' ' ILE . . . . . . . . . . . . . 14.9 mm -86.63 129.41 38.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 174.113 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 732' ' ' VAL . . . . . 0.523 HG13 ' HG2' ' A' ' 708' ' ' ARG . 1.4 p -83.97 103.94 11.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.636 0.731 . . . . 0.0 110.441 -177.426 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 733' ' ' VAL . . . . . 0.612 HG11 ' HA ' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -80.71 115.41 23.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.358 178.543 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 734' ' ' THR . . . . . 0.51 ' HB ' ' CZ3' ' A' ' 710' ' ' TRP . 0.2 OUTLIER -122.9 131.22 53.64 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.431 -177.605 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.27 122.53 17.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.304 -179.06 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 736' ' ' TYR . . . . . 0.446 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 21.8 t80 -86.57 98.0 10.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.157 0.504 . . . . 0.0 110.919 -178.572 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -95.71 -28.64 14.69 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.382 174.359 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 161.2 52.96 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.512 0 N-CA-C 110.774 -0.93 . . . . 0.0 110.774 179.394 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 8.4 mp0 -101.75 -171.32 1.96 Allowed 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -171.149 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 740' ' ' GLU . . . . . 0.5 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 1.0 OUTLIER -69.5 134.68 88.61 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.799 -176.719 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 741' ' ' PRO . . . . . 0.5 ' HD3' ' HA ' ' A' ' 740' ' ' GLU . 3.9 Cg_endo -88.42 137.41 3.58 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 123.478 2.785 . . . . 0.0 111.614 174.017 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 742' ' ' THR . . . . . 0.658 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.2 OUTLIER -131.55 140.21 37.67 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-O 120.777 0.322 . . . . 0.0 111.082 -179.362 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 743' ' ' PRO . . . . . 0.658 ' HD2' HG22 ' A' ' 742' ' ' THR . 38.3 Cg_endo -66.13 -11.19 30.11 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 123.364 2.71 . . . . 0.0 113.254 -177.401 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -108.95 2.71 21.58 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.05 0.453 . . . . 0.0 110.399 178.328 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 745' ' ' ASP . . . . . 0.444 ' CG ' ' HB2' ' A' ' 708' ' ' ARG . 56.5 m-20 -109.63 152.04 26.06 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.45 -175.625 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 746' ' ' VAL . . . . . 0.658 HG21 HD11 ' A' ' 795' ' ' LEU . 29.2 m -120.25 147.02 24.23 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.082 -178.159 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 747' ' ' LEU . . . . . 0.56 HD12 ' HB2' ' A' ' 757' ' ' TRP . 0.3 OUTLIER -105.05 108.72 20.38 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.112 177.153 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 19.8 mt -94.56 106.54 18.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 N-CA-C 108.82 -0.808 . . . . 0.0 108.82 173.852 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.94 153.76 19.24 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 116.056 -0.52 . . . . 0.0 112.23 -170.842 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 750' ' ' ASP . . . . . 0.746 ' CB ' ' HA ' ' A' ' 713' ' ' VAL . 9.3 t0 -113.27 113.41 25.25 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 175.361 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 751' ' ' GLU . . . . . 0.552 ' HG3' ' H ' ' A' ' 752' ' ' VAL . 3.1 tp10 68.15 -173.71 0.19 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.274 179.754 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 752' ' ' VAL . . . . . 0.552 ' H ' ' HG3' ' A' ' 751' ' ' GLU . 0.9 OUTLIER -61.0 127.17 20.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.5 178.092 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 8.8 p -114.93 -12.91 11.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.896 179.256 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 6.6 m 55.53 53.43 9.72 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.404 -178.193 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.03 167.96 28.6 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.407 178.612 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 756' ' ' LYS . . . . . 0.464 ' O ' ' HB3' ' A' ' 757' ' ' TRP . 6.1 tptm -111.3 -40.16 4.49 Favored 'General case' 0 C--N 1.322 -0.587 0 O-C-N 123.118 0.261 . . . . 0.0 110.705 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 757' ' ' TRP . . . . . 0.56 ' HB2' HD12 ' A' ' 747' ' ' LEU . 5.5 t-105 73.11 134.86 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.294 0 O-C-N 124.094 0.871 . . . . 0.0 111.005 179.024 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -114.0 115.4 27.55 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.065 178.014 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 759' ' ' GLY . . . . . . . . . . . . . . . -177.25 -139.65 3.37 Favored Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.826 -0.702 . . . . 0.0 111.813 -178.603 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 8.2 ttt180 -79.22 -54.5 5.91 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.885 0.374 . . . . 0.0 110.08 177.025 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -162.69 163.95 26.71 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.583 179.395 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 2.5 p -131.88 126.43 56.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.233 -0.44 . . . . 0.0 109.996 176.804 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 1.9 t -119.97 109.59 26.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.953 -178.577 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 764' ' ' THR . . . . . 0.412 ' O ' ' HA ' ' A' ' 782' ' ' VAL . 42.5 m -104.35 121.29 43.05 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.169 0.509 . . . . 0.0 112.072 -174.909 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 765' ' ' PHE . . . . . 0.448 ' CE1' HD22 ' A' ' 791' ' ' LEU . 29.9 m-85 -75.98 150.21 37.47 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 171.772 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -132.75 137.8 46.97 Favored 'General case' 0 C--N 1.318 -0.803 0 C-N-CA 120.923 -0.311 . . . . 0.0 110.591 179.65 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 767' ' ' ARG . . . . . 0.506 ' HB2' ' OE1' ' A' ' 751' ' ' GLU . 6.6 mmm-85 -117.78 43.73 2.33 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.162 0.506 . . . . 0.0 109.732 175.786 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 70.69 12.0 7.24 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 114.976 -1.011 . . . . 0.0 112.331 176.671 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 769' ' ' HIS . . . . . 0.512 ' HB2' ' CD ' ' A' ' 751' ' ' GLU . 41.1 m80 -102.8 60.66 0.8 Allowed 'General case' 0 C--N 1.328 -0.345 0 O-C-N 122.219 -0.301 . . . . 0.0 110.391 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 49.6 mt 73.11 130.45 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.101 -178.774 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -92.91 145.25 17.51 Favored Glycine 0 N--CA 1.444 -0.81 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.973 -179.037 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 772' ' ' ILE . . . . . 0.961 HG13 ' HD2' ' A' ' 773' ' ' PRO . 1.0 OUTLIER -89.31 161.9 38.69 Favored Pre-proline 0 C--N 1.323 -0.563 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 174.658 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 773' ' ' PRO . . . . . 0.961 ' HD2' HG13 ' A' ' 772' ' ' ILE . 10.3 Cg_endo -54.37 125.39 18.76 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.512 2.141 . . . . 0.0 112.581 177.021 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 774' ' ' LEU . . . . . 0.553 ' HB3' HG22 ' A' ' 782' ' ' VAL . 0.8 OUTLIER -93.29 -151.0 0.29 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.162 178.486 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 775' ' ' GLU . . . . . 0.536 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 2.8 mp0 -68.68 50.76 0.07 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.85 0.833 . . . . 0.0 112.947 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 776' ' ' LYS . . . . . 0.446 ' HG2' ' H ' ' A' ' 776' ' ' LYS . 0.0 OUTLIER -103.88 2.12 32.23 Favored 'General case' 0 C--N 1.308 -1.207 0 N-CA-C 107.152 -1.425 . . . . 0.0 107.152 168.342 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 777' ' ' ALA . . . . . 0.446 ' HB1' ' CD ' ' A' ' 778' ' ' PRO . . . -136.51 170.36 11.08 Favored Pre-proline 0 N--CA 1.447 -0.62 0 CA-C-N 113.816 -1.538 . . . . 0.0 109.003 -179.181 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 778' ' ' PRO . . . . . 0.446 ' CD ' ' HB1' ' A' ' 777' ' ' ALA . 31.1 Cg_exo -59.6 -26.94 83.69 Favored 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 122.943 2.429 . . . . 0.0 115.707 -169.011 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . -155.47 32.28 0.64 Allowed Glycine 0 C--N 1.331 0.266 0 C-N-CA 119.777 -1.201 . . . . 0.0 112.671 -174.39 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 780' ' ' GLU . . . . . 0.536 ' O ' ' HG3' ' A' ' 775' ' ' GLU . 10.9 mp0 -103.62 130.04 51.01 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 -177.592 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 22.9 m95 -134.94 151.64 51.03 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.655 -0.248 . . . . 0.0 110.438 -176.492 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 782' ' ' VAL . . . . . 0.553 HG22 ' HB3' ' A' ' 774' ' ' LEU . 35.2 m -139.33 157.72 27.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.377 173.643 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 783' ' ' HIS . . . . . 0.4 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 2.6 t-160 -167.3 121.63 1.01 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.97 0.414 . . . . 0.0 110.633 173.484 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -90.37 101.38 14.11 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.476 176.986 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -157.84 179.39 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.937 179.48 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -108.12 31.81 5.26 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.013 179.682 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 787' ' ' ALA . . . . . 0.594 ' HB2' ' HG ' ' A' ' 718' ' ' LEU . . . 63.6 71.74 0.6 Allowed Pre-proline 0 C--O 1.232 0.141 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.8 178.032 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 788' ' ' PRO . . . . . 0.469 ' HB2' ' H ' ' A' ' 789' ' ' HIS . 5.9 Cg_exo -79.95 -119.25 0.01 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 123.033 2.489 . . . . 0.0 110.885 172.455 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 789' ' ' HIS . . . . . 0.583 ' HA ' ' HG2' ' A' ' 792' ' ' PRO . 0.4 OUTLIER -130.77 12.57 5.3 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.037 -0.665 . . . . 0.0 111.835 175.993 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 790' ' ' GLU . . . . . 0.44 ' HG3' ' H ' ' A' ' 790' ' ' GLU . 0.0 OUTLIER -83.95 -54.02 5.16 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.103 -179.275 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 791' ' ' LEU . . . . . 0.521 ' N ' ' HD2' ' A' ' 792' ' ' PRO . 0.3 OUTLIER -63.31 -47.38 84.58 Favored Pre-proline 0 CA--C 1.535 0.396 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 179.32 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 792' ' ' PRO . . . . . 0.583 ' HG2' ' HA ' ' A' ' 789' ' ' HIS . 9.4 Cg_endo -55.81 -29.95 74.34 Favored 'Trans proline' 0 C--N 1.357 0.975 0 C-N-CA 121.775 1.65 . . . . 0.0 112.19 175.102 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -69.24 -41.23 77.27 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-O 120.881 0.372 . . . . 0.0 110.317 176.431 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.71 -43.33 97.96 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.825 176.23 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 795' ' ' LEU . . . . . 0.658 HD11 HG21 ' A' ' 746' ' ' VAL . 1.1 mm? -63.34 -45.07 92.94 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.782 178.997 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -63.4 -37.38 87.06 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.227 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.91 -34.66 71.76 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.455 -0.338 . . . . 0.0 110.372 178.887 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -62.47 -42.37 95.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.585 179.661 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -88.15 4.63 44.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.766 0.317 . . . . 0.0 110.913 179.743 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 40.1 mt . . . . . 0 C--O 1.233 0.191 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.843 178.148 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 10.5 t0 . . . . . 0 C--O 1.234 0.273 0 CA-C-O 121.133 0.492 . . . . 0.0 110.805 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -98.12 101.13 12.52 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.346 177.8 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 826' ' ' MET . . . . . . . . . . . . . 2.6 tpp -104.76 116.54 32.19 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.84 -178.047 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 827' ' ' ILE . . . . . 0.672 ' HB ' HD21 ' A' ' 844' ' ' LEU . 14.4 mm -114.44 137.19 48.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.309 -179.536 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 828' ' ' LEU . . . . . 0.644 HD11 HG13 ' A' ' 863' ' ' VAL . 0.4 OUTLIER -98.24 131.84 44.24 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.709 -179.479 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 829' ' ' VAL . . . . . 0.744 HG23 HD12 ' A' ' 840' ' ' LEU . 0.2 OUTLIER -122.1 104.09 14.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 174.919 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 830' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -120.67 100.57 9.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.196 -177.838 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 831' ' ' ASP . . . . . 0.807 ' HB2' ' HB3' ' A' ' 875' ' ' ASP . 0.2 OUTLIER -117.63 154.4 31.64 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.36 -177.173 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -94.01 -16.42 23.91 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -173.411 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 833' ' ' HIS . . . . . 0.421 ' HB2' ' HB2' ' A' ' 877' ' ' ASN . 1.1 m170 -124.5 98.87 37.05 Favored Pre-proline 0 C--N 1.328 -0.354 0 O-C-N 122.068 -0.395 . . . . 0.0 111.196 -178.427 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_exo -30.64 -39.34 0.06 OUTLIER 'Trans proline' 0 C--N 1.353 0.793 1 C-N-CA 126.032 4.488 . . . . 0.0 116.871 -168.654 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 835' ' ' ILE . . . . . 0.532 ' O ' ' HG3' ' A' ' 838' ' ' ARG . 8.2 tp -59.38 -41.57 84.78 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-N 117.846 0.293 . . . . 0.0 111.689 -176.625 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 836' ' ' ASN . . . . . 0.586 ' HA ' ' HB2' ' A' ' 839' ' ' LEU . 0.8 OUTLIER -79.79 -31.95 40.8 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 -178.802 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 837' ' ' ARG . . . . . 0.435 ' HB2' ' OD2' ' A' ' 831' ' ' ASP . 0.7 OUTLIER -52.73 -48.01 66.98 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.4 176.217 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 838' ' ' ARG . . . . . 0.532 ' HG3' ' O ' ' A' ' 835' ' ' ILE . 0.0 OUTLIER -73.99 -28.72 61.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.737 177.609 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 839' ' ' LEU . . . . . 0.586 ' HB2' ' HA ' ' A' ' 836' ' ' ASN . 0.2 OUTLIER -62.35 -53.92 47.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.728 -0.215 . . . . 0.0 111.442 -178.342 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 840' ' ' LEU . . . . . 0.744 HD12 HG23 ' A' ' 829' ' ' VAL . 0.0 OUTLIER -74.21 -29.55 61.78 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.393 -0.523 . . . . 0.0 110.731 -179.502 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -64.49 -38.65 91.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.233 0.539 . . . . 0.0 110.509 177.967 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -61.6 -49.53 76.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.408 -0.814 . . . . 0.0 109.941 176.725 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 843' ' ' GLN . . . . . 0.869 ' HG3' HD23 ' A' ' 929' ' ' LEU . 0.0 OUTLIER -58.99 -46.46 88.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.84 -179.811 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 844' ' ' LEU . . . . . 0.672 HD21 ' HB ' ' A' ' 827' ' ' ILE . 0.0 OUTLIER -60.07 -39.87 87.55 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.635 178.073 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -61.71 -39.29 97.22 Favored Glycine 0 N--CA 1.448 -0.506 0 CA-C-N 115.697 -0.683 . . . . 0.0 112.317 176.841 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.24 -30.49 66.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.972 0.415 . . . . 0.0 110.485 179.769 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 29.3 mt -73.98 -21.25 60.07 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.812 178.252 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 86.86 38.28 8.1 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 121.087 -0.578 . . . . 0.0 112.962 175.675 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 849' ' ' TYR . . . . . 0.414 ' HB2' HD23 ' A' ' 844' ' ' LEU . 75.0 m-85 -118.2 150.54 39.23 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 178.263 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -72.25 109.67 6.15 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 179.344 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 851' ' ' CYS . . . . . 0.609 ' HB3' HD22 ' A' ' 844' ' ' LEU . 0.0 OUTLIER -102.15 112.07 24.6 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.241 -174.61 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -86.99 108.9 19.04 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 176.079 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 853' ' ' THR . . . . . 0.422 ' HA ' HG13 ' A' ' 829' ' ' VAL . 0.3 OUTLIER -104.1 123.43 47.24 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.015 0.436 . . . . 0.0 111.89 -171.355 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 854' ' ' ALA . . . . . . . . . . . . . . . -140.16 146.9 39.38 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.474 176.62 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 855' ' ' ASN . . . . . 0.436 ' HA ' ' O ' ' A' ' 831' ' ' ASP . 6.1 t-20 -114.76 76.47 0.99 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.109 0.48 . . . . 0.0 110.479 179.629 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 856' ' ' ASP . . . . . . . . . . . . . 8.8 t0 178.95 167.97 0.93 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.154 178.788 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -91.25 -53.39 2.18 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 121.21 -0.519 . . . . 0.0 111.831 178.344 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 6.6 m -58.23 -32.12 43.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.73 0.3 . . . . 0.0 111.707 -179.653 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -68.23 -20.1 64.79 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.41 -177.906 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -67.39 -39.9 85.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.171 0.51 . . . . 0.0 110.059 176.647 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 861' ' ' LEU . . . . . 0.582 HD11 ' HG ' ' A' ' 893' ' ' LEU . 0.2 OUTLIER -74.31 -37.37 63.64 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.126 176.784 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -65.37 -43.26 91.36 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.137 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 863' ' ' VAL . . . . . 0.644 HG13 HD11 ' A' ' 828' ' ' LEU . 9.3 p -71.88 -31.54 41.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.739 -0.209 . . . . 0.0 110.662 179.229 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 864' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.92 -36.06 71.95 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.175 0.512 . . . . 0.0 109.886 173.546 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 3.6 m -87.13 -16.7 34.67 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.718 178.546 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 866' ' ' LYS . . . . . 0.637 ' HB2' ' HA ' ' A' ' 863' ' ' VAL . 17.8 mttt -70.76 -55.42 8.65 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.39 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -143.67 -174.81 4.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.197 179.225 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -98.03 125.31 42.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.076 0.465 . . . . 0.0 111.354 -177.064 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 869' ' ' ILE . . . . . 0.638 HG21 ' HB2' ' A' ' 828' ' ' LEU . 3.4 mp -122.27 148.54 25.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.825 179.288 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -94.58 -58.79 2.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.782 0.325 . . . . 0.0 111.314 -176.292 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 871' ' ' ILE . . . . . 0.649 HG13 ' HG2' ' A' ' 898' ' ' PRO . 0.9 OUTLIER -116.27 135.72 55.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 179.227 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 872' ' ' VAL . . . . . . . . . . . . . 97.3 t -119.08 125.26 74.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.802 -178.854 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 873' ' ' LEU . . . . . 0.464 HD23 HD12 ' A' ' 900' ' ' ILE . 0.0 OUTLIER -109.79 116.0 30.87 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.908 0.385 . . . . 0.0 109.979 174.791 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -104.11 112.57 25.62 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 177.825 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 875' ' ' ASP . . . . . 0.807 ' HB3' ' HB2' ' A' ' 831' ' ' ASP . 58.6 t0 -109.52 124.54 51.26 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.576 -175.144 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -124.75 133.86 68.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.024 0.44 . . . . 0.0 110.721 -177.767 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 877' ' ' ASN . . . . . 0.502 ' HA ' ' HD2' ' A' ' 925' ' ' LYS . 0.1 OUTLIER -88.38 -18.32 28.65 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.067 176.886 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 28.1 mmt . . . . . 0 C--N 1.321 -0.665 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.85 179.12 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.223 -0.566 0 N-CA-C 113.025 -0.03 . . . . 0.0 113.025 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 22.2 t80 -118.16 -50.37 2.47 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 173.585 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 885' ' ' ARG . . . . . 0.418 ' O ' ' HB2' ' A' ' 889' ' ' ARG . 0.0 OUTLIER -64.53 -34.44 78.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.438 179.067 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -62.54 -52.76 62.17 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 116.253 -0.43 . . . . 0.0 109.848 177.19 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -60.67 -42.79 97.79 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.171 0.51 . . . . 0.0 111.094 -178.849 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 888' ' ' GLN . . . . . 0.413 ' HA ' ' OE1' ' A' ' 888' ' ' GLN . 2.5 tp-100 -62.66 -42.81 99.82 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.892 178.592 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 889' ' ' ARG . . . . . 0.509 ' HA ' ' HD3' ' A' ' 889' ' ' ARG . 0.0 OUTLIER -71.82 -44.18 64.34 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.546 -176.32 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 890' ' ' ILE . . . . . 0.467 HG23 HD12 ' A' ' 895' ' ' LEU . 3.3 tt -67.08 -37.54 79.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.826 -0.17 . . . . 0.0 111.449 -176.496 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 891' ' ' ARG . . . . . 0.812 ' HA ' ' HB2' ' A' ' 895' ' ' LEU . 5.6 ptm180 -72.01 -35.49 69.45 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.808 -0.357 . . . . 0.0 110.493 178.602 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -73.24 -22.71 60.36 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.994 -179.567 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 893' ' ' LEU . . . . . 0.582 ' HG ' HD11 ' A' ' 861' ' ' LEU . 0.1 OUTLIER -82.53 0.94 40.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.131 -178.538 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 101.11 51.45 1.15 Allowed Glycine 0 N--CA 1.448 -0.511 0 CA-C-N 115.712 -0.677 . . . . 0.0 112.484 176.569 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 895' ' ' LEU . . . . . 0.812 ' HB2' ' HA ' ' A' ' 891' ' ' ARG . 0.4 OUTLIER -72.91 114.21 10.81 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.975 0.417 . . . . 0.0 110.34 178.435 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -120.66 -12.74 8.83 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.075 -179.789 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 897' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -100.08 153.5 37.73 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.474 -175.877 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 898' ' ' PRO . . . . . 0.649 ' HG2' HG13 ' A' ' 871' ' ' ILE . 55.1 Cg_endo -71.12 126.56 12.54 Favored 'Trans proline' 0 C--O 1.239 0.527 0 C-N-CA 122.592 2.195 . . . . 0.0 112.697 -178.913 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 899' ' ' VAL . . . . . 0.74 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 97.7 t -112.4 119.38 60.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.117 177.305 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 900' ' ' ILE . . . . . 0.464 HD12 HD23 ' A' ' 873' ' ' LEU . 5.5 mt -95.8 115.58 35.3 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.977 179.597 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -95.06 93.79 1.66 Allowed Glycine 0 N--CA 1.444 -0.796 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.666 -174.966 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 902' ' ' VAL . . . . . 0.618 ' O ' ' HA ' ' A' ' 875' ' ' ASP . 1.3 t -76.8 125.24 36.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 175.584 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -139.35 149.24 43.93 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.233 0.539 . . . . 0.0 111.134 -179.019 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -71.13 113.67 8.41 Favored 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 168.447 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -52.43 102.64 0.05 Allowed 'General case' 0 C--O 1.234 0.246 0 O-C-N 123.463 0.477 . . . . 0.0 110.531 -176.161 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 906' ' ' ALA . . . . . 0.502 ' HB3' ' OE1' ' A' ' 909' ' ' GLU . . . -102.53 -77.68 0.55 Allowed 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.824 -174.625 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 5.7 mt -147.9 -86.97 0.09 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.847 0.356 . . . . 0.0 111.748 -176.559 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 908' ' ' ALA . . . . . 0.406 ' O ' ' HG2' ' A' ' 912' ' ' GLN . . . -102.0 24.88 9.4 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -170.073 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 909' ' ' GLU . . . . . 0.502 ' OE1' ' HB3' ' A' ' 906' ' ' ALA . 3.8 mp0 -56.73 -33.46 66.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.97 -179.849 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 910' ' ' GLU . . . . . 0.439 ' H ' ' HG3' ' A' ' 910' ' ' GLU . 0.0 OUTLIER -63.21 -50.89 68.46 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.667 179.14 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -58.21 -47.73 82.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.822 178.215 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 912' ' ' GLN . . . . . 0.406 ' HG2' ' O ' ' A' ' 908' ' ' ALA . 10.7 mm100 -61.14 -45.73 93.46 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.227 -178.211 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 913' ' ' ARG . . . . . 0.473 ' HD2' ' SG ' ' A' ' 922' ' ' CYS . 0.0 OUTLIER -55.78 -44.35 77.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.225 -178.729 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 10.8 m -73.83 -34.04 64.38 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.161 -178.37 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 2.8 tp -70.31 -40.47 74.21 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.796 0.331 . . . . 0.0 111.4 -178.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -77.95 -44.5 26.64 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.122 179.436 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 50.45 45.1 26.76 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.8 -0.637 . . . . 0.0 111.278 -177.635 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -116.42 24.68 9.65 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.814 -0.708 . . . . 0.0 111.948 -179.011 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 919' ' ' MET . . . . . 0.74 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -137.0 -100.44 0.2 Allowed 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 179.555 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 920' ' ' ASP . . . . . 0.471 ' H ' ' HB2' ' A' ' 919' ' ' MET . 15.4 t70 171.46 -64.96 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.45 175.358 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -121.59 175.34 6.27 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.649 -177.532 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 922' ' ' CYS . . . . . 0.473 ' SG ' ' HD2' ' A' ' 913' ' ' ARG . 0.4 OUTLIER -137.14 135.26 37.22 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.325 176.78 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 923' ' ' LEU . . . . . 0.669 HD11 HG21 ' A' ' 935' ' ' THR . 13.7 mt -120.67 167.62 12.25 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.284 -179.029 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -93.43 135.01 35.09 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 174.748 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 925' ' ' LYS . . . . . 0.502 ' HD2' ' HA ' ' A' ' 877' ' ' ASN . 0.1 OUTLIER -49.16 -44.17 71.76 Favored Pre-proline 0 CA--C 1.539 0.555 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -177.647 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -66.01 75.85 0.33 Allowed 'Trans proline' 0 C--N 1.356 0.935 0 C-N-CA 122.03 1.82 . . . . 0.0 112.402 174.215 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -87.96 159.43 3.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.395 179.495 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 928' ' ' THR . . . . . 0.47 ' O ' ' HB ' ' A' ' 932' ' ' ILE . 0.0 OUTLIER -131.97 172.9 11.77 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.639 -179.623 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 929' ' ' LEU . . . . . 0.869 HD23 ' HG3' ' A' ' 843' ' ' GLN . 1.3 tm? -61.67 -48.25 81.68 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.695 0.283 . . . . 0.0 111.699 -176.201 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -78.01 -32.0 50.89 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.864 -0.334 . . . . 0.0 111.327 -175.264 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -74.74 -36.19 39.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 C-N-CA 120.964 -0.295 . . . . 0.0 110.667 179.48 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 932' ' ' ILE . . . . . 0.789 HG21 ' HB3' ' A' ' 843' ' ' GLN . 0.4 OUTLIER -69.03 -34.73 65.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 174.611 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.9 -46.01 91.23 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.991 -0.55 . . . . 0.0 109.876 174.508 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -54.81 -58.27 8.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.766 177.884 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 935' ' ' THR . . . . . 0.669 HG21 HD11 ' A' ' 923' ' ' LEU . 1.9 m -57.55 -51.46 69.39 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.96 -178.363 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 936' ' ' LEU . . . . . 0.572 HD11 HG21 ' A' ' 827' ' ' ILE . 1.8 tp -61.68 -45.72 92.79 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.513 -177.014 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 41.3 m -67.4 -36.31 81.05 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.377 -178.257 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 938' ' ' LEU . . . . . 0.465 ' O ' ' HG3' ' A' ' 941' ' ' GLU . 3.6 tp -71.43 -36.64 71.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.158 0.504 . . . . 0.0 111.307 -178.894 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 939' ' ' TYR . . . . . 0.714 ' HA ' ' HB2' ' A' ' 942' ' ' ARG . 40.0 m-85 -86.49 -25.63 25.03 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 121.877 -0.514 . . . . 0.0 111.521 -178.076 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -67.53 -39.82 85.04 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.947 0.403 . . . . 0.0 110.282 173.655 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 941' ' ' GLU . . . . . 0.465 ' HG3' ' O ' ' A' ' 938' ' ' LEU . 0.2 OUTLIER -72.53 -27.91 62.53 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 174.647 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 942' ' ' ARG . . . . . 0.714 ' HB2' ' HA ' ' A' ' 939' ' ' TYR . 0.0 OUTLIER -60.5 -49.42 77.63 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.881 -179.578 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 6.5 m -72.46 -31.87 39.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.711 178.272 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.61 -36.17 82.94 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.226 -179.404 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.58 -23.51 29.61 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.596 0.236 . . . . 0.0 111.067 179.393 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 51.0 m -72.66 -39.03 67.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.129 0.49 . . . . 0.0 109.963 177.004 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 2.3 mtp180 -84.35 -30.05 25.8 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.579 177.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.466 -175.256 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.32 0 CA-C-O 121.075 0.464 . . . . 0.0 109.933 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 119.31 20.72 3.9 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.269 -178.134 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 707' ' ' LYS . . . . . 0.686 ' HB2' HG12 ' A' ' 731' ' ' ILE . 15.0 mmtt -81.79 165.38 20.95 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 177.67 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 708' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -121.01 130.51 53.82 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -172.859 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -118.02 111.71 19.29 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.345 177.074 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 710' ' ' TRP . . . . . 0.447 ' O ' HD23 ' A' ' 747' ' ' LEU . 98.3 m95 -97.24 112.08 24.04 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 175.337 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 711' ' ' LEU . . . . . 0.565 HD11 ' SG ' ' A' ' 719' ' ' CYS . 0.1 OUTLIER -121.87 131.64 54.14 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.16 0.505 . . . . 0.0 111.285 -174.741 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -125.23 57.57 1.3 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.598 179.152 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 713' ' ' VAL . . . . . 0.823 ' HA ' ' HB2' ' A' ' 750' ' ' ASP . 12.5 t -103.97 125.15 58.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.566 -177.004 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 714' ' ' ARG . . . . . 0.485 ' NH2' ' HG3' ' A' ' 751' ' ' GLU . 18.9 mtm180 -82.66 -38.38 23.54 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.029 0.442 . . . . 0.0 109.883 179.262 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -65.83 102.75 0.8 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.74 176.03 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 716' ' ' ALA . . . . . 0.53 ' HA ' ' HB3' ' A' ' 719' ' ' CYS . . . -63.63 -26.32 68.62 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.071 -174.856 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 4.3 m -65.01 -46.22 82.3 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.118 0.485 . . . . 0.0 109.913 176.006 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 718' ' ' LEU . . . . . 0.419 ' HB3' HG11 ' A' ' 713' ' ' VAL . 0.9 OUTLIER -74.14 -39.57 63.2 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.543 178.385 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 719' ' ' CYS . . . . . 0.648 ' HB2' ' HB ' ' A' ' 713' ' ' VAL . 0.7 OUTLIER -59.59 -51.56 69.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.7 179.683 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 720' ' ' GLN . . . . . 0.793 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -64.99 -33.7 76.67 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.524 -179.383 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -54.73 -55.8 26.07 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.172 0.511 . . . . 0.0 110.145 177.322 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -68.26 -48.5 64.9 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.177 -177.874 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 723' ' ' GLU . . . . . 0.793 ' HG2' ' HA ' ' A' ' 720' ' ' GLN . 10.4 pt-20 -60.77 -41.86 96.33 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 111.601 0.222 . . . . 0.0 111.601 -174.495 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 724' ' ' THR . . . . . . . . . . . . . 53.7 m -67.35 -44.37 79.2 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.948 0.404 . . . . 0.0 110.732 -179.239 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 74.0 m -66.57 -39.48 88.51 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.717 -177.956 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 726' ' ' LEU . . . . . . . . . . . . . 67.1 mt -74.96 -39.37 61.36 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.264 -178.253 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 1.6 pp0? -72.07 -23.75 61.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.792 -0.185 . . . . 0.0 111.062 -179.169 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 9.1 ptt85 -66.74 -22.25 66.05 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 121.278 0.561 . . . . 0.0 110.42 177.801 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 19.9 m -88.01 -78.39 0.32 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.299 179.695 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 730' ' ' GLY . . . . . . . . . . . . . . . 177.76 39.85 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 111.053 -0.819 . . . . 0.0 111.053 179.176 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 731' ' ' ILE . . . . . 0.686 HG12 ' HB2' ' A' ' 707' ' ' LYS . 27.0 mt -119.24 127.98 75.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 115.165 -0.518 . . . . 0.0 110.165 -177.454 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 732' ' ' VAL . . . . . 0.403 HG22 ' O ' ' A' ' 707' ' ' LYS . 10.6 m -81.21 118.45 29.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.339 0.59 . . . . 0.0 110.538 179.311 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 733' ' ' VAL . . . . . 0.521 ' CG1' HD22 ' A' ' 711' ' ' LEU . 21.9 t -89.71 125.04 42.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.628 -178.105 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 734' ' ' THR . . . . . 0.431 ' HB ' ' CZ3' ' A' ' 710' ' ' TRP . 0.3 OUTLIER -133.11 136.26 45.72 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.438 0.637 . . . . 0.0 110.571 -178.898 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.29 113.56 3.68 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.759 -1.11 . . . . 0.0 111.075 178.145 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -80.09 78.95 6.7 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.455 0.645 . . . . 0.0 109.605 176.714 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -78.36 -28.78 47.17 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.031 179.694 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 164.89 55.08 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.53 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 179.395 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 17.3 mp0 -96.63 -171.41 2.26 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.851 0.358 . . . . 0.0 111.331 -174.058 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -98.94 147.37 33.12 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.776 -176.714 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 741' ' ' PRO . . . . . 0.581 ' HA ' ' CZ3' ' A' ' 757' ' ' TRP . 73.0 Cg_endo -78.43 131.1 10.35 Favored 'Trans proline' 0 N--CA 1.463 -0.314 0 C-N-CA 122.825 2.35 . . . . 0.0 113.132 179.266 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 742' ' ' THR . . . . . 0.493 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.2 OUTLIER -118.21 135.39 23.49 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.394 176.411 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 743' ' ' PRO . . . . . 0.876 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 19.6 Cg_endo -60.7 -18.15 53.8 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 123.149 2.566 . . . . 0.0 113.152 -177.64 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -105.89 10.52 32.43 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.55 -0.296 . . . . 0.0 110.608 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -118.74 156.31 29.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.203 -174.342 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 746' ' ' VAL . . . . . 0.405 HG12 ' HB3' ' A' ' 760' ' ' ARG . 1.5 m -122.29 147.67 26.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.277 -178.395 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 747' ' ' LEU . . . . . 0.653 ' HB3' HG23 ' A' ' 762' ' ' VAL . 0.3 OUTLIER -118.13 134.65 54.8 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.97 178.944 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -127.58 107.79 17.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 172.846 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 749' ' ' THR . . . . . 0.429 HG23 ' HA ' ' A' ' 764' ' ' THR . 1.4 t -109.07 146.04 34.66 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.467 0.651 . . . . 0.0 112.016 -172.629 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 750' ' ' ASP . . . . . 0.823 ' HB2' ' HA ' ' A' ' 713' ' ' VAL . 59.8 t0 -91.88 108.56 20.01 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.968 -1.015 . . . . 0.0 109.442 175.569 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 751' ' ' GLU . . . . . 0.485 ' HG3' ' NH2' ' A' ' 714' ' ' ARG . 3.1 mm-40 63.47 -159.74 0.31 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.865 -174.858 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 752' ' ' VAL . . . . . . . . . . . . . 3.8 t -86.58 119.78 35.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.02 0.438 . . . . 0.0 112.099 -170.972 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 3.4 m -107.51 -3.31 10.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.462 172.878 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 13.0 m 53.88 55.02 8.93 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.61 -179.556 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.48 137.62 52.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.541 -179.335 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 20.7 tptt -100.4 87.48 3.41 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.346 0.593 . . . . 0.0 109.674 176.914 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 757' ' ' TRP . . . . . 0.581 ' CZ3' ' HA ' ' A' ' 741' ' ' PRO . 76.1 t-105 -67.93 106.03 2.19 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.631 -178.747 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.95 87.83 6.36 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 173.64 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 759' ' ' GLY . . . . . 0.876 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -159.18 -139.58 2.71 Favored Glycine 0 N--CA 1.444 -0.811 0 C-N-CA 120.512 -0.852 . . . . 0.0 112.377 -178.159 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 760' ' ' ARG . . . . . 0.405 ' HB3' HG12 ' A' ' 746' ' ' VAL . 0.7 OUTLIER -71.18 -55.64 7.73 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.989 -0.284 . . . . 0.0 110.573 178.6 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -170.59 150.69 3.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.874 179.664 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 762' ' ' VAL . . . . . 0.653 HG23 ' HB3' ' A' ' 747' ' ' LEU . 4.5 p -130.23 127.44 63.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.248 175.446 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 763' ' ' VAL . . . . . 0.694 HG11 HD21 ' A' ' 791' ' ' LEU . 85.6 t -112.46 128.65 69.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.515 178.455 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 764' ' ' THR . . . . . 0.429 ' HA ' HG23 ' A' ' 749' ' ' THR . 35.5 m -109.17 118.27 36.31 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.105 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 765' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -84.51 107.29 16.67 Favored 'General case' 0 C--O 1.223 -0.313 0 N-CA-C 109.813 -0.439 . . . . 0.0 109.813 177.341 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.06 134.31 36.61 Favored 'General case' 0 C--N 1.317 -0.848 0 C-N-CA 120.844 -0.343 . . . . 0.0 110.196 -175.474 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.79 -65.35 1.07 Allowed 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.803 -0.359 . . . . 0.0 111.312 -179.632 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 3.7 mtp85 -143.67 -4.82 0.84 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -176.947 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 2.3 m170 -84.17 -67.74 0.77 Allowed 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.294 -0.562 . . . . 0.0 110.863 -178.448 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 25.4 mt 68.65 144.6 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 CA-C-O 121.202 0.525 . . . . 0.0 111.395 -179.447 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . 158.88 -32.2 0.47 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.825 -0.703 . . . . 0.0 111.624 -178.297 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 772' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -82.09 154.24 69.73 Favored Pre-proline 0 C--N 1.324 -0.531 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 176.136 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 773' ' ' PRO . . . . . 0.506 ' HB2' ' H ' ' A' ' 774' ' ' LEU . 12.7 Cg_exo -70.58 -119.88 0.01 OUTLIER 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.792 2.328 . . . . 0.0 112.913 -179.732 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 774' ' ' LEU . . . . . 0.767 ' HA ' HG13 ' A' ' 782' ' ' VAL . 1.1 pt? 178.25 -167.04 0.06 Allowed 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 122.676 0.39 . . . . 0.0 110.105 -177.606 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 775' ' ' GLU . . . . . 0.723 ' HG3' ' HA ' ' A' ' 781' ' ' TRP . 2.4 mp0 -63.03 68.87 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 121.603 0.716 . . . . 0.0 112.631 174.472 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -127.82 6.61 6.11 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 114.642 -1.163 . . . . 0.0 108.214 171.712 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -145.42 144.3 22.61 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 114.314 -1.312 . . . . 0.0 108.946 179.233 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -60.62 100.57 0.16 Allowed 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 122.496 2.131 . . . . 0.0 112.97 -177.64 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 116.75 -3.92 19.36 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.996 176.436 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 780' ' ' GLU . . . . . 0.622 ' O ' ' HG3' ' A' ' 775' ' ' GLU . 10.2 tt0 -103.71 123.67 47.45 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 -177.296 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 781' ' ' TRP . . . . . 0.723 ' HA ' ' HG3' ' A' ' 775' ' ' GLU . 23.2 m95 -134.76 137.41 43.41 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 -179.606 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 782' ' ' VAL . . . . . 0.767 HG13 ' HA ' ' A' ' 774' ' ' LEU . 3.6 m -136.28 151.65 28.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 120.775 0.322 . . . . 0.0 110.29 173.075 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 783' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -167.5 129.18 1.56 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.477 -0.328 . . . . 0.0 110.492 178.858 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.61 101.92 11.11 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 174.255 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 785' ' ' VAL . . . . . 0.846 HG13 ' H ' ' A' ' 787' ' ' ALA . 1.8 p -170.91 168.15 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.202 -175.802 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -108.58 27.78 9.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.754 0.311 . . . . 0.0 110.781 -179.677 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 787' ' ' ALA . . . . . 0.846 ' H ' HG13 ' A' ' 785' ' ' VAL . . . 49.12 57.27 18.35 Favored Pre-proline 0 N--CA 1.47 0.527 0 CA-C-N 115.209 -0.905 . . . . 0.0 112.905 178.877 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 788' ' ' PRO . . . . . 0.509 ' HD3' ' N ' ' A' ' 787' ' ' ALA . 2.7 Cg_exo -76.35 -42.26 0.39 Allowed 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 122.285 1.99 . . . . 0.0 113.414 -178.049 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 4.9 p-80 -151.64 -14.62 0.2 Allowed 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 -170.005 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 790' ' ' GLU . . . . . 0.457 ' H ' ' CD ' ' A' ' 790' ' ' GLU . 0.0 OUTLIER -112.75 -41.92 3.71 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -169.393 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 791' ' ' LEU . . . . . 0.694 HD21 HG11 ' A' ' 763' ' ' VAL . 0.3 OUTLIER -67.89 -50.42 33.04 Favored Pre-proline 0 C--N 1.325 -0.487 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.035 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 792' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -63.9 -26.73 66.94 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 121.3 1.333 . . . . 0.0 111.411 179.253 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -75.0 -39.11 61.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.33 176.359 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -62.66 -41.07 98.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.76 176.382 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 795' ' ' LEU . . . . . 0.516 HD22 ' HA ' ' A' ' 795' ' ' LEU . 0.2 OUTLIER -60.26 -45.53 92.96 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.454 177.624 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -63.54 -38.72 92.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.925 178.456 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 797' ' ' ARG . . . . . 0.514 ' HA ' HD12 ' A' ' 800' ' ' LEU . 0.0 OUTLIER -67.18 -32.71 73.98 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.9 0.381 . . . . 0.0 110.526 178.959 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -70.77 -28.04 32.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.063 0.459 . . . . 0.0 110.694 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 799' ' ' TYR . . . . . 0.528 ' CE2' ' HB3' ' A' ' 707' ' ' LYS . 0.2 OUTLIER -104.26 9.32 36.06 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.171 176.882 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 800' ' ' LEU . . . . . 0.514 HD12 ' HA ' ' A' ' 797' ' ' ARG . 3.9 mt . . . . . 0 C--N 1.326 -0.415 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 177.121 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 824' ' ' ASP . . . . . 0.449 ' HB3' ' H ' ' A' ' 825' ' ' MET . 4.7 t0 . . . . . 0 N--CA 1.457 -0.118 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 825' ' ' MET . . . . . 0.449 ' H ' ' HB3' ' A' ' 824' ' ' ASP . 0.0 OUTLIER -93.28 129.92 39.18 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.02 179.508 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 826' ' ' MET . . . . . 0.509 ' HG3' ' O ' ' A' ' 868' ' ' HIS . 0.0 OUTLIER -124.54 139.25 54.06 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.561 0.696 . . . . 0.0 112.14 -174.777 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 827' ' ' ILE . . . . . 0.543 HG23 ' HB ' ' A' ' 871' ' ' ILE . 3.5 mm -121.25 137.43 54.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.051 -0.977 . . . . 0.0 109.534 177.894 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 13.5 tp -98.4 122.47 41.62 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 179.435 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -112.49 113.57 44.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 120.867 0.365 . . . . 0.0 110.424 -179.277 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 830' ' ' VAL . . . . . 0.501 ' HA ' ' O ' ' A' ' 854' ' ' ALA . 2.9 t -118.21 86.37 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.713 -177.247 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 831' ' ' ASP . . . . . 0.802 ' HA ' ' HB2' ' A' ' 875' ' ' ASP . 13.8 t70 -93.39 154.83 17.73 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.143 0.497 . . . . 0.0 111.475 -173.35 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 832' ' ' ASP . . . . . 1.068 ' HB3' ' HB ' ' A' ' 876' ' ' VAL . 0.0 OUTLIER -60.75 -33.67 73.28 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.818 -177.238 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 833' ' ' HIS . . . . . 0.678 ' HB2' HD21 ' A' ' 836' ' ' ASN . 34.8 m170 -136.4 138.61 27.36 Favored Pre-proline 0 N--CA 1.463 0.186 0 CA-C-O 120.517 0.198 . . . . 0.0 110.519 -178.822 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 834' ' ' PRO . . . . . 0.447 ' HA ' ' HB3' ' A' ' 837' ' ' ARG . 52.1 Cg_exo -56.12 -25.6 55.69 Favored 'Trans proline' 0 CA--C 1.532 0.415 0 C-N-CA 123.115 2.543 . . . . 0.0 113.511 -178.947 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -69.68 -48.18 66.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.946 0.403 . . . . 0.0 111.058 -179.092 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 836' ' ' ASN . . . . . 0.678 HD21 ' HB2' ' A' ' 833' ' ' HIS . 0.1 OUTLIER -74.35 -33.3 63.08 Favored 'General case' 0 CA--C 1.515 -0.396 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 178.508 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 837' ' ' ARG . . . . . 0.585 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 6.5 ttp180 -53.45 -43.2 67.89 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.193 175.042 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.75 -30.32 67.89 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.665 178.984 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.98 -49.13 66.36 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.312 178.929 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 840' ' ' LEU . . . . . 0.504 ' H ' ' HG ' ' A' ' 840' ' ' LEU . 0.0 OUTLIER -69.05 -32.94 72.79 Favored 'General case' 0 CA--C 1.521 -0.146 0 C-N-CA 120.704 -0.399 . . . . 0.0 110.139 178.216 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -64.97 -32.05 73.59 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.009 177.117 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.24 -42.62 88.35 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.04 0.447 . . . . 0.0 109.829 176.946 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 843' ' ' GLN . . . . . 0.545 ' HG3' ' CD2' ' A' ' 929' ' ' LEU . 0.0 OUTLIER -65.24 -46.88 78.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.842 178.868 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 844' ' ' LEU . . . . . 0.48 HD21 HD21 ' A' ' 936' ' ' LEU . 0.1 OUTLIER -59.18 -40.95 87.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.331 177.783 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -70.2 -27.39 72.92 Favored Glycine 0 N--CA 1.453 -0.205 0 C-N-CA 121.306 -0.473 . . . . 0.0 112.537 -179.739 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 18.4 m -79.34 -23.69 43.25 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.059 0.457 . . . . 0.0 110.449 177.779 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.04 -22.49 42.32 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.266 177.116 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 84.48 58.31 2.19 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.894 -0.669 . . . . 0.0 112.116 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 849' ' ' TYR . . . . . 0.44 ' HE1' ' HB3' ' A' ' 825' ' ' MET . 2.4 m-85 -132.75 147.26 52.32 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 29.1 mm-40 -72.99 115.39 12.24 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 176.268 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 851' ' ' CYS . . . . . 0.469 ' SG ' ' HB3' ' A' ' 844' ' ' LEU . 0.0 OUTLIER -109.48 136.08 49.45 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.986 0.422 . . . . 0.0 111.029 -176.277 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.3 116.45 31.03 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 173.757 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 853' ' ' THR . . . . . 0.482 ' HB ' ' CZ ' ' A' ' 837' ' ' ARG . 0.2 OUTLIER -91.02 134.11 34.76 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -171.464 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 854' ' ' ALA . . . . . 0.501 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -151.47 164.55 36.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.935 175.128 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 855' ' ' ASN . . . . . 0.54 ' O ' ' HB3' ' A' ' 856' ' ' ASP . 0.2 OUTLIER -153.5 74.02 0.99 Allowed 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.74 0.305 . . . . 0.0 110.978 176.63 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 856' ' ' ASP . . . . . 0.54 ' HB3' ' O ' ' A' ' 855' ' ' ASN . 4.3 p-10 163.82 173.65 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 124.28 1.032 . . . . 0.0 109.712 178.647 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -87.04 -44.2 5.75 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.732 -0.747 . . . . 0.0 113.898 -175.094 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -67.5 -38.21 80.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 112.011 0.374 . . . . 0.0 112.011 -174.324 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -67.89 -37.28 81.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.914 0.388 . . . . 0.0 110.622 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -61.63 -38.83 89.1 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.417 177.577 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 861' ' ' LEU . . . . . 0.496 HD21 ' HA ' ' A' ' 890' ' ' ILE . 0.1 OUTLIER -74.73 -31.31 61.8 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.957 178.036 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -64.68 -49.75 69.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.301 177.901 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 863' ' ' VAL . . . . . 0.489 HG22 HD11 ' A' ' 869' ' ' ILE . 7.9 p -66.99 -31.2 52.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.428 177.638 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 864' ' ' LEU . . . . . 0.669 ' HG ' HD11 ' A' ' 890' ' ' ILE . 0.7 OUTLIER -65.63 -33.86 76.87 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.824 175.683 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 27.2 m -65.9 -37.79 87.04 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.072 0.463 . . . . 0.0 109.861 178.164 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.05 -28.7 68.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.721 174.016 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 7.2 t30 56.12 73.0 0.46 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 114.575 -1.193 . . . . 0.0 111.976 176.613 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 868' ' ' HIS . . . . . 0.509 ' O ' ' HG3' ' A' ' 826' ' ' MET . 64.7 m-70 -135.14 46.24 2.43 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 174.558 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 869' ' ' ILE . . . . . 0.489 HD11 HG22 ' A' ' 863' ' ' VAL . 2.0 mp -142.2 145.79 23.35 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.132 -0.94 . . . . 0.0 109.835 -177.896 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -101.43 -52.42 3.24 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.88 0.372 . . . . 0.0 110.426 177.173 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 871' ' ' ILE . . . . . 0.543 ' HB ' HG23 ' A' ' 827' ' ' ILE . 38.4 mm -115.42 129.49 71.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.139 179.029 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 872' ' ' VAL . . . . . 0.764 HG23 HD11 ' A' ' 897' ' ' LEU . 9.7 t -106.53 124.39 62.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 120.728 0.299 . . . . 0.0 110.697 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 873' ' ' LEU . . . . . 0.843 HD11 HD11 ' A' ' 936' ' ' LEU . 52.1 mt -109.96 132.34 54.25 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.141 -0.481 . . . . 0.0 109.719 174.995 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -120.8 95.2 4.61 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.065 0.459 . . . . 0.0 110.011 178.01 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 875' ' ' ASP . . . . . 0.802 ' HB2' ' HA ' ' A' ' 831' ' ' ASP . 0.9 OUTLIER -88.66 105.63 17.8 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.978 -179.512 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 876' ' ' VAL . . . . . 1.068 ' HB ' ' HB3' ' A' ' 832' ' ' ASP . 2.9 t 50.92 65.56 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.558 0.694 . . . . 0.0 111.519 -179.372 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 877' ' ' ASN . . . . . 0.434 ' HB3' HD22 ' A' ' 886' ' ' LEU . 1.6 t-20 -90.48 33.17 0.91 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.827 176.392 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 4.7 tpp . . . . . 0 C--N 1.325 -0.498 0 CA-C-N 115.162 -0.927 . . . . 0.0 109.473 179.861 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.51 -0.273 0 N-CA-C 111.39 -0.684 . . . . 0.0 111.39 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 6.5 p90 -80.31 -18.84 48.04 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.296 -0.452 . . . . 0.0 110.687 -171.566 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.89 -32.12 73.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.857 0.36 . . . . 0.0 110.344 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 886' ' ' LEU . . . . . 0.434 HD22 ' HB3' ' A' ' 877' ' ' ASN . 0.0 OUTLIER -72.62 -50.73 23.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.15 179.807 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 887' ' ' THR . . . . . 0.631 ' HB ' ' HB3' ' A' ' 916' ' ' GLU . 0.0 OUTLIER -63.28 -40.6 97.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.139 -179.144 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 40.0 tp60 -65.31 -42.77 92.68 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.331 178.234 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 889' ' ' ARG . . . . . 0.404 ' HG2' HD22 ' A' ' 861' ' ' LEU . 0.7 OUTLIER -64.86 -45.75 84.75 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.992 -178.401 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 890' ' ' ILE . . . . . 0.669 HD11 ' HG ' ' A' ' 864' ' ' LEU . 1.1 tt -69.05 -34.15 62.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.62 0.247 . . . . 0.0 111.017 -177.882 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 891' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.17 -23.07 57.68 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.905 0.383 . . . . 0.0 110.475 178.952 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 -77.84 -52.21 9.25 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.456 176.326 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.82 -60.53 3.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.852 -175.116 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 171.3 77.99 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.712 0 C-N-CA 120.394 -0.908 . . . . 0.0 112.02 -176.27 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 895' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -92.27 110.28 21.67 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.023 0.44 . . . . 0.0 110.071 178.843 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -123.25 -26.5 4.29 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.617 178.08 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 897' ' ' LEU . . . . . 0.764 HD11 HG23 ' A' ' 872' ' ' VAL . 2.5 pt? -97.52 151.9 37.89 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.349 -177.35 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -66.91 128.55 18.98 Favored 'Trans proline' 0 C--O 1.239 0.555 0 C-N-CA 122.763 2.309 . . . . 0.0 112.732 -177.887 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 899' ' ' VAL . . . . . 0.655 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 58.7 t -105.9 109.37 27.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.225 176.748 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 900' ' ' ILE . . . . . 0.427 ' O ' ' HA ' ' A' ' 873' ' ' LEU . 3.6 mp -101.01 114.39 39.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 178.995 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -112.57 116.47 4.05 Favored Glycine 0 N--CA 1.442 -0.916 0 C-N-CA 120.448 -0.882 . . . . 0.0 112.599 -174.79 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 902' ' ' VAL . . . . . 0.675 HG22 ' HA ' ' A' ' 875' ' ' ASP . 0.8 OUTLIER -89.55 138.71 18.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 108.76 -0.829 . . . . 0.0 108.76 176.031 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -138.27 160.5 39.3 Favored 'General case' 0 C--N 1.319 -0.739 0 O-C-N 121.957 -0.464 . . . . 0.0 111.686 -176.597 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -85.4 105.85 16.33 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.327 174.319 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 905' ' ' ASN . . . . . 0.403 ' HB3' ' H ' ' A' ' 906' ' ' ALA . 11.8 t-20 62.29 -96.41 0.06 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.778 -174.929 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 906' ' ' ALA . . . . . 0.494 ' O ' ' HG3' ' A' ' 909' ' ' GLU . . . 53.22 55.61 8.57 Favored 'General case' 0 N--CA 1.462 0.141 0 O-C-N 123.487 0.492 . . . . 0.0 111.05 -179.413 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 907' ' ' LEU . . . . . 0.417 ' O ' ' HB3' ' A' ' 908' ' ' ALA . 2.1 tp -49.31 143.1 6.65 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.394 -179.281 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 908' ' ' ALA . . . . . 0.417 ' HB3' ' O ' ' A' ' 907' ' ' LEU . . . 76.5 39.38 0.26 Allowed 'General case' 0 N--CA 1.465 0.315 0 O-C-N 124.33 1.018 . . . . 0.0 109.685 -173.898 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 909' ' ' GLU . . . . . 0.494 ' HG3' ' O ' ' A' ' 906' ' ' ALA . 1.0 OUTLIER -57.79 -45.41 86.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.951 -178.307 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 910' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.42 -44.17 88.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.586 179.077 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.54 -33.95 76.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.847 -178.469 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.17 -57.9 8.99 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.327 177.396 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.83 -33.46 71.79 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.37 -176.89 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 77.0 m -76.24 -33.53 59.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.116 179.398 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 4.6 tp -70.8 -47.75 57.85 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.868 0.365 . . . . 0.0 110.63 179.372 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 916' ' ' GLU . . . . . 0.631 ' HB3' ' HB ' ' A' ' 887' ' ' THR . 28.5 mt-10 -69.87 -27.51 64.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.155 -178.225 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.59 35.63 15.18 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.294 178.919 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -140.77 24.71 2.59 Favored Glycine 0 C--O 1.226 -0.351 0 C-N-CA 120.517 -0.849 . . . . 0.0 112.488 -179.002 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 919' ' ' MET . . . . . 0.655 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -125.29 -119.29 0.27 Allowed 'General case' 0 C--N 1.323 -0.577 0 O-C-N 122.812 -0.228 . . . . 0.0 110.686 -177.233 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 920' ' ' ASP . . . . . 0.543 ' H ' ' HB3' ' A' ' 919' ' ' MET . 20.1 t70 173.29 -68.28 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 123.683 0.793 . . . . 0.0 109.429 174.252 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 25.5 m -128.67 137.73 51.79 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.065 -177.931 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 922' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -103.42 129.89 50.63 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.54 -179.666 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 923' ' ' LEU . . . . . . . . . . . . . 14.3 mt -126.11 178.0 6.04 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.126 -179.763 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -108.27 148.04 30.57 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 176.895 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 925' ' ' LYS . . . . . 0.456 ' N ' ' HD2' ' A' ' 926' ' ' PRO . 0.8 OUTLIER -67.16 -48.76 47.69 Favored Pre-proline 0 CA--C 1.533 0.316 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.298 177.881 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 926' ' ' PRO . . . . . 0.456 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 56.2 Cg_endo -71.58 64.88 3.01 Favored 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 121.914 1.743 . . . . 0.0 111.789 172.831 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -105.9 149.17 9.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.603 -178.801 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.91 153.9 40.8 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.89 179.688 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 929' ' ' LEU . . . . . 0.545 ' CD2' ' HG3' ' A' ' 843' ' ' GLN . 1.1 tm? -59.95 -31.78 70.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.005 -176.898 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -71.26 -26.53 62.93 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.971 -178.866 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 21.3 t -78.54 -44.98 26.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.839 -0.164 . . . . 0.0 111.314 -178.253 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 932' ' ' ILE . . . . . 0.465 HG12 HD22 ' A' ' 936' ' ' LEU . 0.0 OUTLIER -60.61 -41.86 89.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 174.775 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -44.72 96.18 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.651 176.402 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 934' ' ' GLN . . . . . 0.549 ' O ' ' HB2' ' A' ' 938' ' ' LEU . 0.7 OUTLIER -58.16 -53.09 62.25 Favored 'General case' 0 C--O 1.222 -0.39 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.05 179.888 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 4.0 m -61.46 -43.23 99.24 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.812 0.339 . . . . 0.0 111.309 -177.676 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 936' ' ' LEU . . . . . 0.843 HD11 HD11 ' A' ' 873' ' ' LEU . 0.0 OUTLIER -64.55 -51.32 63.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.954 -179.178 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 24.0 m -66.61 -39.38 88.34 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.381 -176.816 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 938' ' ' LEU . . . . . 0.549 ' HB2' ' O ' ' A' ' 934' ' ' GLN . 0.3 OUTLIER -61.94 -47.46 84.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.813 -179.277 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 939' ' ' TYR . . . . . 0.429 ' O ' HG22 ' A' ' 943' ' ' VAL . 5.1 m-85 -76.68 -32.78 58.14 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.002 -177.253 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -61.85 -49.38 76.48 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.86 0.362 . . . . 0.0 110.564 177.805 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 941' ' ' GLU . . . . . 0.599 ' O ' ' HB3' ' A' ' 945' ' ' LYS . 7.9 pt-20 -67.08 -30.71 70.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.36 179.29 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 942' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.71 -49.27 54.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.565 -178.443 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 943' ' ' VAL . . . . . 0.429 HG22 ' O ' ' A' ' 939' ' ' TYR . 18.5 m -70.38 -34.13 56.83 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 CA-C-O 121.263 0.554 . . . . 0.0 110.282 -178.653 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.56 -18.62 61.61 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.287 176.457 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 945' ' ' LYS . . . . . 0.599 ' HB3' ' O ' ' A' ' 941' ' ' GLU . 0.0 OUTLIER -85.17 -23.37 28.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.727 179.31 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -74.06 -39.74 63.28 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.971 0.415 . . . . 0.0 110.137 173.683 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 6.8 mtt180 -72.8 -50.01 26.97 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.202 176.006 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 21.6 t0 . . . . . 0 C--N 1.321 -0.655 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.977 -179.975 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.465 0.297 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 94.18 -11.19 70.93 Favored Glycine 0 C--N 1.33 0.238 0 CA-C-N 115.416 -0.811 . . . . 0.0 114.187 166.918 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 707' ' ' LYS . . . . . 0.413 ' HD2' ' H ' ' A' ' 708' ' ' ARG . 0.1 OUTLIER -81.85 142.16 32.78 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 117.377 0.589 . . . . 0.0 111.196 -176.968 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 708' ' ' ARG . . . . . 0.48 ' HA ' HG23 ' A' ' 732' ' ' VAL . 0.0 OUTLIER -95.18 143.1 26.88 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.164 178.87 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -117.82 119.06 33.73 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 174.78 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 710' ' ' TRP . . . . . 0.419 ' O ' HD23 ' A' ' 747' ' ' LEU . 77.4 m95 -91.56 115.7 28.26 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 711' ' ' LEU . . . . . 0.444 HD22 HG12 ' A' ' 733' ' ' VAL . 0.7 OUTLIER -119.74 129.72 54.64 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.476 0.655 . . . . 0.0 110.945 -178.576 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -126.43 56.88 1.44 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.019 175.684 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 713' ' ' VAL . . . . . 0.821 HG13 ' HB3' ' A' ' 750' ' ' ASP . 24.0 t -107.23 118.3 54.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 115.031 -0.986 . . . . 0.0 109.713 179.158 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.46 -3.17 58.5 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.402 0.62 . . . . 0.0 110.005 -179.425 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 715' ' ' ASN . . . . . 0.617 ' HB3' ' HB2' ' A' ' 718' ' ' LEU . 1.8 m-80 -86.74 103.13 14.89 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.507 -0.769 . . . . 0.0 109.553 175.687 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 716' ' ' ALA . . . . . 0.56 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -54.6 -46.78 73.87 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -172.346 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.2 -39.42 93.95 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.141 0.496 . . . . 0.0 110.714 -179.756 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 718' ' ' LEU . . . . . 0.617 ' HB2' ' HB3' ' A' ' 715' ' ' ASN . 0.2 OUTLIER -69.5 -50.06 48.82 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.089 -178.911 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 719' ' ' CYS . . . . . 0.732 ' HB3' ' HB ' ' A' ' 713' ' ' VAL . 31.9 p -67.61 -39.51 84.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.687 -176.411 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 720' ' ' GLN . . . . . 0.433 ' HA ' ' OE1' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -59.59 -43.98 93.51 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.335 178.277 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -59.33 -49.6 77.19 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.831 0.348 . . . . 0.0 110.998 -178.216 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 722' ' ' LEU . . . . . 0.485 HD23 ' HG3' ' A' ' 792' ' ' PRO . 4.8 mt -65.83 -45.34 82.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.785 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 723' ' ' GLU . . . . . 0.591 ' HG2' ' N ' ' A' ' 724' ' ' THR . 0.0 OUTLIER -57.82 -49.19 77.47 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.822 -177.204 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 724' ' ' THR . . . . . 0.591 ' N ' ' HG2' ' A' ' 723' ' ' GLU . 6.1 m -67.15 -36.77 82.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.304 -174.616 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 27.7 m -69.91 -35.95 74.98 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.02 0.438 . . . . 0.0 111.022 179.544 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 726' ' ' LEU . . . . . 0.58 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 29.4 mt -75.74 -44.16 43.18 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.305 -177.845 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.65 -25.88 65.05 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.888 0.375 . . . . 0.0 110.394 177.649 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 728' ' ' ARG . . . . . 0.582 ' HB2' ' O ' ' A' ' 724' ' ' THR . 0.0 OUTLIER -65.74 -33.57 76.17 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.582 175.57 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 19.0 m -85.4 -56.7 3.39 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.002 -177.881 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 730' ' ' GLY . . . . . . . . . . . . . . . 155.42 28.2 0.03 OUTLIER Glycine 0 N--CA 1.453 -0.172 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.617 -179.685 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 731' ' ' ILE . . . . . 0.58 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 11.1 mm -113.66 129.73 68.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 178.549 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 732' ' ' VAL . . . . . 0.48 HG23 ' HA ' ' A' ' 708' ' ' ARG . 3.9 m -85.62 114.83 26.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.445 0.641 . . . . 0.0 110.707 -179.203 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 733' ' ' VAL . . . . . 0.446 HG11 ' HB2' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -78.19 115.22 19.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.661 -177.637 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -121.92 126.37 48.49 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.434 179.705 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.41 127.84 34.14 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.911 177.923 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -73.59 90.79 1.8 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.303 0.573 . . . . 0.0 110.037 177.641 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -73.53 -73.75 0.2 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.085 176.81 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -168.74 63.56 0.19 Allowed Glycine 0 N--CA 1.449 -0.494 0 N-CA-C 111.078 -0.809 . . . . 0.0 111.078 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -103.67 155.2 18.75 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.62 0.248 . . . . 0.0 110.632 -175.403 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 740' ' ' GLU . . . . . 0.491 ' H ' ' CD ' ' A' ' 740' ' ' GLU . 1.5 pm0 -71.47 129.58 88.59 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 116.112 -0.494 . . . . 0.0 109.708 177.53 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 741' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -57.64 122.81 12.39 Favored 'Trans proline' 0 C--O 1.233 0.244 0 C-N-CA 122.938 2.425 . . . . 0.0 112.912 -175.97 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 742' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -93.78 129.23 38.77 Favored Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.146 176.717 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 743' ' ' PRO . . . . . 0.595 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 41.2 Cg_endo -67.22 -5.73 14.48 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 123.087 2.525 . . . . 0.0 113.328 -175.324 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -112.57 4.98 17.63 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.662 0.268 . . . . 0.0 110.62 176.286 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -112.6 157.99 20.53 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.167 0.508 . . . . 0.0 110.849 -175.902 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 746' ' ' VAL . . . . . 0.54 HG21 HD11 ' A' ' 795' ' ' LEU . 10.2 m -120.57 147.76 24.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.601 -178.943 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 747' ' ' LEU . . . . . 0.419 HD23 ' O ' ' A' ' 710' ' ' TRP . 0.1 OUTLIER -119.78 107.82 13.65 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.098 178.91 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 6.7 mt -94.66 108.44 20.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 176.202 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 4.8 t -121.36 165.52 15.41 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.655 -0.248 . . . . 0.0 110.63 -176.154 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 750' ' ' ASP . . . . . 0.821 ' HB3' HG13 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -122.93 148.22 45.71 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.032 0.444 . . . . 0.0 111.306 179.357 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 61.2 -119.64 0.77 Allowed 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.064 -177.032 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 752' ' ' VAL . . . . . . . . . . . . . 29.9 t -125.51 93.8 2.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.041 0.448 . . . . 0.0 111.002 -175.542 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 9.8 p -74.74 -21.96 17.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.868 178.162 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 55.42 53.95 9.19 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.108 -179.025 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.25 134.33 32.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.847 -177.622 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -90.25 85.9 6.36 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 175.558 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 77.1 t-105 -68.97 94.47 0.64 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.901 179.718 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 61.2 mt-30 -82.61 67.59 8.72 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.298 0.57 . . . . 0.0 109.964 176.723 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 759' ' ' GLY . . . . . 0.595 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -128.91 -136.9 4.22 Favored Glycine 0 N--CA 1.44 -1.071 0 CA-C-N 115.64 -0.709 . . . . 0.0 112.188 -178.44 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 7.5 ttm-85 -86.43 -47.84 8.96 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.818 0.342 . . . . 0.0 110.456 178.1 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 761' ' ' ALA . . . . . 0.402 ' O ' ' HA ' ' A' ' 746' ' ' VAL . . . -164.66 138.42 5.08 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.921 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 2.4 p -113.92 130.53 67.92 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 172.44 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 763' ' ' VAL . . . . . 0.641 HG11 HD21 ' A' ' 791' ' ' LEU . 0.7 OUTLIER -115.65 113.13 42.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-O 120.971 0.415 . . . . 0.0 110.5 -178.032 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 764' ' ' THR . . . . . 0.5 ' HB ' HG12 ' A' ' 782' ' ' VAL . 44.5 m -102.66 112.78 25.71 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.983 -175.509 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 765' ' ' PHE . . . . . 0.683 ' HE1' HG23 ' A' ' 785' ' ' VAL . 6.2 m-85 -88.58 105.72 17.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.818 174.706 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.23 134.02 37.13 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.691 0.281 . . . . 0.0 110.949 -173.783 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 767' ' ' ARG . . . . . 0.417 ' HA ' ' HD3' ' A' ' 767' ' ' ARG . 0.1 OUTLIER -112.66 -64.52 1.29 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.114 -178.092 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.15 -31.97 3.52 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.783 0.325 . . . . 0.0 111.395 -176.152 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 9.6 t-80 -115.31 133.5 55.97 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.182 0.515 . . . . 0.0 110.779 -177.591 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 2.0 mt -106.07 158.77 6.28 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.459 176.322 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -175.78 -37.76 0.05 OUTLIER Glycine 0 CA--C 1.507 -0.468 0 N-CA-C 110.806 -0.918 . . . . 0.0 110.806 -178.823 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 772' ' ' ILE . . . . . . . . . . . . . 1.6 mm -83.8 133.92 45.36 Favored Pre-proline 0 C--N 1.324 -0.52 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 172.835 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 773' ' ' PRO . . . . . 0.563 ' O ' ' HB3' ' A' ' 774' ' ' LEU . 23.6 Cg_endo -62.41 -92.86 0.0 OUTLIER 'Trans proline' 0 CA--C 1.535 0.531 0 C-N-CA 122.93 2.42 . . . . 0.0 113.75 -175.633 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 774' ' ' LEU . . . . . 0.665 ' HA ' HG13 ' A' ' 782' ' ' VAL . 1.3 pt? 165.98 -171.8 0.01 OUTLIER 'General case' 0 C--O 1.234 0.268 0 C-N-CA 123.147 0.579 . . . . 0.0 110.218 -174.569 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 775' ' ' GLU . . . . . 0.606 ' HG3' ' HA ' ' A' ' 781' ' ' TRP . 1.5 mp0 -62.07 69.18 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 O-C-N 123.834 0.709 . . . . 0.0 112.036 172.806 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 18.7 pttt -128.79 7.87 5.7 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 172.489 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 777' ' ' ALA . . . . . 0.433 ' HA ' ' HD3' ' A' ' 778' ' ' PRO . . . -145.07 149.37 41.84 Favored Pre-proline 0 N--CA 1.449 -0.515 0 CA-C-N 114.348 -1.296 . . . . 0.0 109.122 -179.157 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 778' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 777' ' ' ALA . 24.7 Cg_exo -64.16 93.92 0.19 Allowed 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.72 2.28 . . . . 0.0 112.407 -179.452 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 112.15 19.62 7.1 Favored Glycine 0 C--O 1.228 -0.255 0 C-N-CA 120.923 -0.656 . . . . 0.0 113.2 176.794 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 780' ' ' GLU . . . . . 0.522 ' O ' ' HA ' ' A' ' 775' ' ' GLU . 0.1 OUTLIER -119.73 124.88 47.29 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 177.593 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 781' ' ' TRP . . . . . 0.606 ' HA ' ' HG3' ' A' ' 775' ' ' GLU . 17.0 m95 -137.24 136.02 37.73 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 -176.556 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 782' ' ' VAL . . . . . 0.665 HG13 ' HA ' ' A' ' 774' ' ' LEU . 32.6 m -129.69 155.67 41.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.981 0.419 . . . . 0.0 110.875 176.927 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 783' ' ' HIS . . . . . 0.537 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.2 OUTLIER -161.18 126.92 3.77 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.931 176.189 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 784' ' ' SER . . . . . 0.404 ' O ' HG13 ' A' ' 785' ' ' VAL . 0.9 OUTLIER -96.67 99.48 11.09 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 120.874 0.369 . . . . 0.0 110.03 177.703 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 785' ' ' VAL . . . . . 0.683 HG23 ' HE1' ' A' ' 765' ' ' PHE . 0.0 OUTLIER -171.24 -170.52 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.225 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -179.747 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -123.67 56.72 1.2 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.733 0.301 . . . . 0.0 110.824 178.111 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 787' ' ' ALA . . . . . 0.463 ' HB2' HD23 ' A' ' 718' ' ' LEU . . . 53.57 63.23 8.31 Favored Pre-proline 0 N--CA 1.467 0.382 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.34 178.717 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 788' ' ' PRO . . . . . 0.615 ' HD2' ' OE1' ' A' ' 790' ' ' GLU . 5.2 Cg_exo -76.01 43.27 1.1 Allowed 'Trans proline' 0 CA--C 1.534 0.498 0 C-N-CA 123.086 2.524 . . . . 0.0 113.292 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 69.71 -0.02 2.82 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 171.0 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 790' ' ' GLU . . . . . 0.615 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -94.55 -46.08 7.13 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 121.882 -0.511 . . . . 0.0 111.305 -177.447 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 791' ' ' LEU . . . . . 0.641 HD21 HG11 ' A' ' 763' ' ' VAL . 0.2 OUTLIER -58.82 -45.05 99.64 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -179.926 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 792' ' ' PRO . . . . . 0.485 ' HG3' HD23 ' A' ' 722' ' ' LEU . 51.7 Cg_exo -54.17 -31.87 67.7 Favored 'Trans proline' 0 C--N 1.356 0.941 0 C-N-CA 121.717 1.611 . . . . 0.0 111.974 175.917 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -70.44 -44.37 67.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.774 179.006 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 794' ' ' LEU . . . . . 0.552 ' HA ' ' HG2' ' A' ' 797' ' ' ARG . 0.3 OUTLIER -71.55 -28.76 64.09 Favored 'General case' 0 C--O 1.219 -0.51 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.732 179.784 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 795' ' ' LEU . . . . . 0.54 HD11 HG21 ' A' ' 746' ' ' VAL . 0.1 OUTLIER -62.99 -39.42 94.69 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.116 0.484 . . . . 0.0 110.072 177.037 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -62.94 -48.85 77.13 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.262 177.522 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 797' ' ' ARG . . . . . 0.748 ' HA ' HD23 ' A' ' 800' ' ' LEU . 8.8 ptp180 -71.45 -32.99 68.95 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.684 -177.541 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 798' ' ' ILE . . . . . 0.432 ' HB ' ' O ' ' A' ' 794' ' ' LEU . 0.1 OUTLIER -60.95 -34.01 57.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.622 0.249 . . . . 0.0 111.061 175.569 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 799' ' ' TYR . . . . . 0.44 ' HD1' ' HA ' ' A' ' 799' ' ' TYR . 0.5 OUTLIER -83.19 -61.48 1.84 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.658 -0.246 . . . . 0.0 110.424 177.631 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 800' ' ' LEU . . . . . 0.748 HD23 ' HA ' ' A' ' 797' ' ' ARG . 0.2 OUTLIER . . . . . 0 N--CA 1.468 0.436 0 O-C-N 123.666 0.604 . . . . 0.0 112.122 178.661 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 824' ' ' ASP . . . . . 0.4 ' HB3' ' H ' ' A' ' 825' ' ' MET . 19.2 t0 . . . . . 0 CA--C 1.53 0.193 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 825' ' ' MET . . . . . 0.563 ' O ' ' HB2' ' A' ' 850' ' ' GLN . 0.0 OUTLIER -115.76 139.0 50.58 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.915 -175.551 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 826' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -105.39 123.13 47.36 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.041 -176.496 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 827' ' ' ILE . . . . . 0.58 HG23 ' HB ' ' A' ' 871' ' ' ILE . 1.2 mm -119.87 124.28 72.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.699 177.786 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 828' ' ' LEU . . . . . 0.678 HD12 ' HB3' ' A' ' 852' ' ' LYS . 3.1 tp -109.01 123.31 48.92 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.648 0.261 . . . . 0.0 110.699 -178.229 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 829' ' ' VAL . . . . . 0.76 HG12 HD12 ' A' ' 873' ' ' LEU . 27.0 m -105.43 128.36 59.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.822 177.867 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 830' ' ' VAL . . . . . 0.502 ' HA ' ' O ' ' A' ' 854' ' ' ALA . 0.2 OUTLIER -126.09 87.48 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 116.771 -0.195 . . . . 0.0 111.047 -177.775 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 831' ' ' ASP . . . . . 0.578 ' HA ' ' O ' ' A' ' 875' ' ' ASP . 9.9 t70 -107.67 137.97 44.73 Favored 'General case' 0 CA--C 1.515 -0.397 0 C-N-CA 120.631 -0.428 . . . . 0.0 110.388 -178.893 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.38 -31.2 72.29 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.125 -178.307 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 833' ' ' HIS . . . . . 0.434 ' HA ' ' HD3' ' A' ' 834' ' ' PRO . 0.2 OUTLIER -108.81 128.77 24.9 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-O 120.781 0.324 . . . . 0.0 111.697 -173.549 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 834' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 833' ' ' HIS . 67.6 Cg_exo -53.81 -45.26 42.3 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 123.51 2.807 . . . . 0.0 113.584 -178.711 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 835' ' ' ILE . . . . . 0.445 ' HA ' ' HD2' ' A' ' 838' ' ' ARG . 1.1 pt -65.35 -37.17 79.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 121.074 0.464 . . . . 0.0 110.778 -179.29 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 836' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -72.06 -45.47 60.61 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.692 179.563 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 837' ' ' ARG . . . . . . . . . . . . . 19.2 ttp180 -53.73 -47.73 70.32 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.377 -0.828 . . . . 0.0 111.07 177.386 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 838' ' ' ARG . . . . . 0.445 ' HD2' ' HA ' ' A' ' 835' ' ' ILE . 0.0 OUTLIER -66.01 -29.6 70.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.806 -179.827 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.92 -51.4 62.06 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.727 179.475 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 840' ' ' LEU . . . . . 0.496 ' H ' ' HG ' ' A' ' 840' ' ' LEU . 0.0 OUTLIER -72.32 -29.6 63.99 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.673 0.273 . . . . 0.0 110.873 -179.859 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -66.65 -31.14 71.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.045 0.45 . . . . 0.0 110.442 176.888 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -68.5 -44.16 75.29 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.806 175.05 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 843' ' ' GLN . . . . . 0.622 ' HG3' HD23 ' A' ' 929' ' ' LEU . 0.0 OUTLIER -60.39 -52.42 65.32 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.861 178.929 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 844' ' ' LEU . . . . . 0.526 ' HG ' HD23 ' A' ' 847' ' ' LEU . 0.2 OUTLIER -61.63 -31.62 71.72 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.91 177.555 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -65.36 -33.63 87.17 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 121.122 -0.561 . . . . 0.0 112.364 177.945 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.29 -22.85 51.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.963 0.411 . . . . 0.0 110.291 175.721 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 847' ' ' LEU . . . . . 0.526 HD23 ' HG ' ' A' ' 844' ' ' LEU . 1.0 OUTLIER -72.98 -44.33 61.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.06 177.478 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 100.19 25.48 8.88 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.54 -0.838 . . . . 0.0 113.912 172.364 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 6.0 m-30 -103.68 169.12 8.71 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 117.254 0.527 . . . . 0.0 109.865 176.934 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 850' ' ' GLN . . . . . 0.563 ' HB2' ' O ' ' A' ' 825' ' ' MET . 1.5 mt-30 -69.1 111.33 5.0 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 110.368 -0.234 . . . . 0.0 110.368 -178.577 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -98.63 112.94 24.84 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.055 0.455 . . . . 0.0 111.409 -175.092 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 852' ' ' LYS . . . . . 0.678 ' HB3' HD12 ' A' ' 828' ' ' LEU . 0.2 OUTLIER -101.56 110.48 22.48 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 173.851 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.26 117.6 29.78 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.666 -175.868 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 854' ' ' ALA . . . . . 0.502 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -136.83 162.28 33.65 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.626 178.796 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 26.7 p-10 -153.01 75.53 1.09 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.095 0.474 . . . . 0.0 111.689 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 856' ' ' ASP . . . . . . . . . . . . . 27.9 t70 173.1 150.94 0.07 Allowed 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.176 176.159 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -72.33 -47.85 27.28 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 121.183 -0.532 . . . . 0.0 112.656 -179.178 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -73.16 -34.14 43.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.027 0.442 . . . . 0.0 110.232 -177.099 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -61.49 -35.14 76.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.793 176.005 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 860' ' ' ALA . . . . . 0.427 ' O ' HG12 ' A' ' 863' ' ' VAL . . . -66.28 -39.5 89.43 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.681 177.573 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 861' ' ' LEU . . . . . 0.625 HD11 ' HB3' ' A' ' 889' ' ' ARG . 1.9 mt -67.17 -40.92 86.66 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.156 0.503 . . . . 0.0 110.337 177.348 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -63.0 -45.72 91.06 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.522 178.692 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 863' ' ' VAL . . . . . 0.427 HG12 ' O ' ' A' ' 860' ' ' ALA . 0.3 OUTLIER -66.36 -31.99 56.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.918 179.913 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 864' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.6 -35.75 80.55 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.913 0.387 . . . . 0.0 110.084 175.851 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 2.2 m -74.4 -37.97 63.24 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.438 178.291 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -65.03 -54.03 36.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.164 -179.426 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -144.17 143.19 30.98 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.505 -179.416 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -73.5 140.56 46.48 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.962 -179.742 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 869' ' ' ILE . . . . . . . . . . . . . 1.9 mp -120.55 134.05 65.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.023 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -74.88 -55.46 5.78 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.039 0.447 . . . . 0.0 110.617 -177.769 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 871' ' ' ILE . . . . . 0.58 ' HB ' HG23 ' A' ' 827' ' ' ILE . 28.4 mm -117.2 120.83 66.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.157 -177.861 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 872' ' ' VAL . . . . . 0.532 HG21 HD12 ' A' ' 897' ' ' LEU . 0.0 OUTLIER -105.82 125.56 61.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.821 -178.055 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 873' ' ' LEU . . . . . 0.76 HD12 HG12 ' A' ' 829' ' ' VAL . 26.5 mt -110.95 108.77 18.64 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 177.01 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 2.1 m -94.39 96.72 9.71 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 177.867 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 875' ' ' ASP . . . . . 0.578 ' O ' ' HA ' ' A' ' 831' ' ' ASP . 3.1 m-20 -93.03 104.41 16.63 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.822 0.82 . . . . 0.0 110.78 -173.762 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 876' ' ' VAL . . . . . 0.635 ' HB ' HG23 ' A' ' 903' ' ' THR . 0.2 OUTLIER -104.65 89.07 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.752 -178.244 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -68.54 -43.45 76.67 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 174.683 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 10.6 ptm . . . . . 0 N--CA 1.452 -0.346 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.496 173.022 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.866 0 N-CA-C 111.951 -0.46 . . . . 0.0 111.951 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -149.17 -36.99 0.17 Allowed 'General case' 0 C--O 1.235 0.312 0 CA-C-O 120.47 0.176 . . . . 0.0 111.462 -179.727 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -68.44 -46.24 70.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.495 -176.585 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -55.89 -49.78 72.48 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.394 177.787 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.1 -45.35 87.36 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.437 -177.884 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -64.67 -49.99 68.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.929 179.577 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 889' ' ' ARG . . . . . 0.625 ' HB3' HD11 ' A' ' 861' ' ' LEU . 0.0 OUTLIER -64.15 -41.16 97.29 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.853 -174.659 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 890' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -68.5 -40.41 82.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 111.511 0.189 . . . . 0.0 111.511 -176.646 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 891' ' ' ARG . . . . . 0.428 ' HB3' ' HA2' ' A' ' 918' ' ' GLY . 0.4 OUTLIER -75.31 -24.38 57.44 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.068 0.461 . . . . 0.0 110.425 178.988 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -73.36 -54.79 7.48 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.795 178.753 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 893' ' ' LEU . . . . . 0.454 ' HA ' HD13 ' A' ' 893' ' ' LEU . 1.8 mm? -67.2 -50.85 59.37 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.306 -174.489 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 166.46 82.96 0.05 OUTLIER Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 119.775 -1.202 . . . . 0.0 112.887 -178.223 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 895' ' ' LEU . . . . . . . . . . . . . 4.6 tp -89.93 109.33 20.36 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 175.462 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.16 6.26 5.9 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.054 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 897' ' ' LEU . . . . . 0.532 HD12 HG21 ' A' ' 872' ' ' VAL . 0.0 OUTLIER -123.81 141.22 36.22 Favored Pre-proline 0 C--N 1.325 -0.461 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 179.89 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -61.8 114.67 2.38 Favored 'Trans proline' 0 C--O 1.236 0.422 0 C-N-CA 122.799 2.333 . . . . 0.0 112.847 -176.58 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 899' ' ' VAL . . . . . 0.665 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 27.1 t -98.64 113.4 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-O 121.361 0.601 . . . . 0.0 110.257 177.923 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 900' ' ' ILE . . . . . 0.422 HG13 ' OG ' ' A' ' 921' ' ' SER . 1.7 mp -85.63 112.5 22.45 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.688 176.648 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -89.87 104.33 3.11 Favored Glycine 0 N--CA 1.443 -0.878 0 C-N-CA 120.595 -0.812 . . . . 0.0 111.464 177.486 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 902' ' ' VAL . . . . . 0.813 HG22 ' HE2' ' A' ' 925' ' ' LYS . 0.2 OUTLIER -110.59 103.34 15.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.632 0.729 . . . . 0.0 109.663 179.537 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 903' ' ' THR . . . . . 0.635 HG23 ' HB ' ' A' ' 876' ' ' VAL . 0.2 OUTLIER -108.64 149.13 29.37 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.356 -174.44 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -94.76 135.87 35.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.668 175.336 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 61.28 -156.77 0.34 Allowed 'General case' 0 C--N 1.33 -0.268 0 O-C-N 123.676 0.61 . . . . 0.0 110.247 -176.328 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . 68.92 -71.84 0.11 Allowed 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.39 0.676 . . . . 0.0 111.959 176.845 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 97.6 mt 68.92 176.33 0.27 Allowed 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 123.203 0.601 . . . . 0.0 111.069 -179.793 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . 65.49 30.36 10.78 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.518 0.675 . . . . 0.0 109.759 -173.189 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -67.65 -18.02 64.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.842 -1.072 . . . . 0.0 111.546 -174.874 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 910' ' ' GLU . . . . . 0.441 ' HA ' ' SG ' ' A' ' 922' ' ' CYS . 0.4 OUTLIER -66.13 -42.02 89.69 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.956 0.408 . . . . 0.0 109.963 176.431 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 911' ' ' LYS . . . . . 0.418 ' HE2' HD12 ' A' ' 915' ' ' LEU . 0.0 OUTLIER -73.3 -34.05 65.53 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.043 178.902 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -66.1 -43.33 87.57 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.859 178.365 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 913' ' ' ARG . . . . . 0.465 ' HA ' ' SD ' ' A' ' 919' ' ' MET . 0.0 OUTLIER -63.12 -35.67 81.05 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.71 179.649 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 82.6 m -71.8 -37.23 70.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.902 0.382 . . . . 0.0 110.349 176.588 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 915' ' ' LEU . . . . . 0.418 HD12 ' HE2' ' A' ' 911' ' ' LYS . 0.2 OUTLIER -62.53 -51.76 66.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.168 -179.252 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -77.5 -33.0 54.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.299 -177.957 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.21 48.84 22.29 Favored 'General case' 0 N--CA 1.464 0.266 0 O-C-N 123.675 0.61 . . . . 0.0 111.433 -177.402 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 918' ' ' GLY . . . . . 0.428 ' HA2' ' HB3' ' A' ' 891' ' ' ARG . . . -140.15 25.02 2.66 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.295 -178.667 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 919' ' ' MET . . . . . 0.665 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -129.72 -111.66 0.26 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.623 0.249 . . . . 0.0 110.757 -177.473 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 920' ' ' ASP . . . . . . . . . . . . . 10.8 t70 169.33 -60.13 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 123.986 0.914 . . . . 0.0 109.034 177.375 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 921' ' ' SER . . . . . 0.422 ' OG ' HG13 ' A' ' 900' ' ' ILE . 0.0 OUTLIER -123.17 170.08 10.6 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.808 178.363 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 922' ' ' CYS . . . . . 0.441 ' SG ' ' HA ' ' A' ' 910' ' ' GLU . 0.8 OUTLIER -144.64 130.39 19.15 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.7 0.286 . . . . 0.0 110.804 -179.34 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 923' ' ' LEU . . . . . 0.544 ' O ' ' HA ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -139.04 165.62 26.67 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 177.327 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -87.43 147.9 25.22 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.004 177.804 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 925' ' ' LYS . . . . . 0.813 ' HE2' HG22 ' A' ' 902' ' ' VAL . 0.0 OUTLIER -47.56 -38.81 18.1 Favored Pre-proline 0 CA--C 1.539 0.545 0 N-CA-C 114.02 1.118 . . . . 0.0 114.02 -179.008 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -58.66 77.28 0.04 OUTLIER 'Trans proline' 0 C--N 1.358 1.066 0 C-N-CA 122.039 1.826 . . . . 0.0 112.777 170.959 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 88.9 t -107.76 97.05 5.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.872 178.202 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 928' ' ' THR . . . . . 0.405 ' O ' HG22 ' A' ' 932' ' ' ILE . 0.2 OUTLIER -71.87 170.26 14.07 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.436 -179.674 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 929' ' ' LEU . . . . . 0.622 HD23 ' HG3' ' A' ' 843' ' ' GLN . 0.7 OUTLIER -52.29 -45.84 65.65 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.139 -0.482 . . . . 0.0 112.06 -177.314 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 930' ' ' ASP . . . . . 0.463 ' HA ' ' HE3' ' A' ' 933' ' ' LYS . 0.5 OUTLIER -69.89 -33.6 72.43 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.764 -0.375 . . . . 0.0 110.437 -177.738 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 43.1 t -66.48 -52.12 49.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.768 -179.875 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 932' ' ' ILE . . . . . 0.498 HD11 HD12 ' A' ' 844' ' ' LEU . 3.8 tt -65.15 -36.4 77.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.92 0.391 . . . . 0.0 110.582 -179.023 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 933' ' ' LYS . . . . . 0.463 ' HE3' ' HA ' ' A' ' 930' ' ' ASP . 0.3 OUTLIER -68.2 -47.6 67.46 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.139 -179.398 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 934' ' ' GLN . . . . . 0.53 ' HG3' ' N ' ' A' ' 935' ' ' THR . 0.4 OUTLIER -68.34 -36.52 79.37 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.694 -0.23 . . . . 0.0 111.231 -177.551 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 935' ' ' THR . . . . . 0.53 ' N ' ' HG3' ' A' ' 934' ' ' GLN . 22.9 m -67.34 -43.89 80.45 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.896 0.379 . . . . 0.0 110.531 178.534 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 936' ' ' LEU . . . . . 0.501 HD13 ' HA ' ' A' ' 936' ' ' LEU . 0.2 OUTLIER -63.5 -47.5 81.45 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.639 179.073 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 34.2 m -62.92 -42.12 99.69 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.004 -179.74 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 938' ' ' LEU . . . . . 0.466 ' HB2' ' O ' ' A' ' 934' ' ' GLN . 0.6 OUTLIER -60.39 -45.24 94.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.022 179.505 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -78.63 -27.33 45.38 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.699 -175.295 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -64.3 -43.61 94.18 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.382 0.611 . . . . 0.0 110.089 174.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 941' ' ' GLU . . . . . 0.418 ' HG3' ' N ' ' A' ' 942' ' ' ARG . 0.0 OUTLIER -73.63 -29.67 62.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.109 177.152 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 942' ' ' ARG . . . . . 0.439 HH11 ' HD3' ' A' ' 942' ' ' ARG . 0.2 OUTLIER -65.9 -47.09 75.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.137 179.973 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 27.5 m -68.17 -29.83 45.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.893 0.378 . . . . 0.0 110.439 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.4 -31.39 71.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.583 174.453 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 20.4 mmtm -70.06 -36.37 74.93 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.071 178.657 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.96 -45.12 12.49 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.409 -176.223 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 947' ' ' ARG . . . . . 0.41 ' HE ' ' HB3' ' A' ' 947' ' ' ARG . 0.1 OUTLIER -73.88 -52.59 12.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.28 -177.893 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 3.0 t70 . . . . . 0 C--N 1.326 -0.425 0 CA-C-O 120.71 0.291 . . . . 0.0 110.842 -175.795 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 705' ' ' SER . . . . . 0.755 ' HA ' ' O ' ' A' ' 730' ' ' GLY . 0.9 OUTLIER . . . . . 0 N--CA 1.45 -0.447 0 CA-C-O 121.309 0.576 . . . . 0.0 110.619 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 154.71 -19.77 0.59 Allowed Glycine 0 N--CA 1.448 -0.513 0 N-CA-C 111.033 -0.827 . . . . 0.0 111.033 -175.805 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 4.1 mmtt -77.48 130.99 37.72 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 174.872 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 708' ' ' ARG . . . . . 0.448 ' HA ' HG13 ' A' ' 732' ' ' VAL . 5.9 mtm-85 -95.64 139.55 31.73 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.235 0.54 . . . . 0.0 111.86 -171.06 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -122.39 116.58 24.26 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.612 174.897 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 710' ' ' TRP . . . . . 0.694 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 93.0 m95 -99.65 118.55 36.43 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.721 0.295 . . . . 0.0 110.298 -177.296 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 711' ' ' LEU . . . . . 0.525 HD23 ' C ' ' A' ' 710' ' ' TRP . 5.2 mt -111.25 118.15 35.13 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.836 0.351 . . . . 0.0 111.424 -176.038 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 712' ' ' ALA . . . . . 0.56 ' HB3' ' HB ' ' A' ' 749' ' ' THR . . . -108.08 44.53 1.1 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.573 0.701 . . . . 0.0 109.382 174.769 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 713' ' ' VAL . . . . . 0.843 HG13 ' HB3' ' A' ' 750' ' ' ASP . 16.3 t -100.29 124.84 54.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.583 -177.655 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 714' ' ' ARG . . . . . 0.409 HH11 ' HD3' ' A' ' 714' ' ' ARG . 2.1 mtp180 -88.73 -21.02 24.07 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 177.645 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 715' ' ' ASN . . . . . 0.414 ' HB3' ' HB2' ' A' ' 718' ' ' LEU . 3.7 m-80 -71.39 102.4 2.62 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.876 174.665 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 716' ' ' ALA . . . . . 0.549 ' O ' ' HB2' ' A' ' 720' ' ' GLN . . . -59.95 -35.93 75.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.333 -177.21 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.44 -46.35 88.92 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.134 0.492 . . . . 0.0 110.549 178.615 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 718' ' ' LEU . . . . . 0.576 ' HB3' HG11 ' A' ' 713' ' ' VAL . 0.3 OUTLIER -69.38 -48.98 59.52 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.84 -179.76 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 719' ' ' CYS . . . . . 0.656 ' HB2' ' HB ' ' A' ' 713' ' ' VAL . 12.2 t -60.92 -51.77 67.85 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.702 -177.354 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 720' ' ' GLN . . . . . 0.783 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 1.2 mt-30 -63.03 -36.28 83.05 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.767 -176.713 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -59.48 -52.89 63.63 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.169 0.509 . . . . 0.0 110.4 179.099 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 48.9 mt -66.9 -48.25 69.3 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.316 -178.034 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 723' ' ' GLU . . . . . 0.783 ' HG2' ' HA ' ' A' ' 720' ' ' GLN . 1.4 pt-20 -60.94 -44.76 96.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.825 -173.684 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 724' ' ' THR . . . . . 0.618 ' N ' ' HG3' ' A' ' 723' ' ' GLU . 16.0 m -64.75 -43.3 93.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.79 0.329 . . . . 0.0 110.775 -179.394 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 18.5 m -63.73 -40.16 96.05 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.342 179.78 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 726' ' ' LEU . . . . . 0.462 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 11.0 mt -71.95 -37.96 69.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.842 0.354 . . . . 0.0 111.211 -179.041 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -66.17 -15.25 62.98 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.862 0.363 . . . . 0.0 111.319 179.365 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.44 -16.12 60.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.096 0.474 . . . . 0.0 110.612 176.906 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -104.39 -1.08 27.34 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.157 0.503 . . . . 0.0 110.783 177.435 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 730' ' ' GLY . . . . . 0.755 ' O ' ' HA ' ' A' ' 705' ' ' SER . . . 98.13 -0.63 58.88 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.52 179.23 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 731' ' ' ILE . . . . . 0.462 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 36.6 mm -66.22 120.05 12.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 120.683 0.278 . . . . 0.0 110.402 -178.539 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 732' ' ' VAL . . . . . 0.448 HG13 ' HA ' ' A' ' 708' ' ' ARG . 1.5 p -78.22 98.14 2.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 122.028 0.918 . . . . 0.0 110.06 -179.384 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 733' ' ' VAL . . . . . 0.55 HG21 ' HA ' ' A' ' 723' ' ' GLU . 82.8 t -81.96 119.95 32.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 114.915 -1.039 . . . . 0.0 110.601 179.746 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.33 125.46 44.39 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.945 177.603 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -59.74 114.42 2.76 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.646 177.334 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 736' ' ' TYR . . . . . 0.694 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 65.1 t80 -72.19 95.31 1.65 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.96 -179.871 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 737' ' ' GLU . . . . . 0.519 ' H ' ' HG3' ' A' ' 737' ' ' GLU . 0.0 OUTLIER -92.86 -52.83 4.42 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.139 0.495 . . . . 0.0 109.912 176.82 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -165.62 68.53 0.2 Allowed Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 111.083 -0.807 . . . . 0.0 111.083 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 15.7 mp0 -117.12 179.71 3.95 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.778 0.323 . . . . 0.0 110.581 -175.907 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -98.91 142.99 25.56 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.479 -179.123 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 741' ' ' PRO . . . . . 0.581 ' HB2' ' O ' ' A' ' 758' ' ' GLN . 71.8 Cg_endo -79.27 147.5 20.55 Favored 'Trans proline' 0 CA--C 1.532 0.414 0 C-N-CA 122.865 2.377 . . . . 0.0 113.446 -177.911 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 742' ' ' THR . . . . . 0.76 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.1 OUTLIER -132.61 144.24 52.11 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.597 179.122 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 743' ' ' PRO . . . . . 0.835 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 28.7 Cg_endo -62.5 -12.6 28.69 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 123.573 2.849 . . . . 0.0 113.777 -175.13 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 31.8 tp10 -98.08 -9.99 25.02 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.061 0.457 . . . . 0.0 110.792 179.39 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 745' ' ' ASP . . . . . 0.405 ' HB3' ' HD1' ' A' ' 710' ' ' TRP . 74.6 m-20 -106.65 158.47 16.93 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.321 -167.845 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 746' ' ' VAL . . . . . 0.511 HG11 HD11 ' A' ' 795' ' ' LEU . 6.4 p -126.64 138.56 54.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.731 -179.053 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 747' ' ' LEU . . . . . 0.49 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 0.0 OUTLIER -103.79 103.35 13.22 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.916 177.167 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 27.5 mt -94.93 107.64 19.75 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 175.377 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 749' ' ' THR . . . . . 0.56 ' HB ' ' HB3' ' A' ' 712' ' ' ALA . 1.9 t -119.92 148.19 43.81 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.611 -174.981 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 750' ' ' ASP . . . . . 0.843 ' HB3' HG13 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -109.54 126.32 53.44 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 176.421 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 751' ' ' GLU . . . . . 0.491 ' HB2' ' O ' ' A' ' 750' ' ' ASP . 3.6 mm-40 74.5 173.93 0.27 Allowed 'General case' 0 C--O 1.235 0.325 0 CA-C-N 114.684 -1.143 . . . . 0.0 110.372 -170.964 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 752' ' ' VAL . . . . . 0.837 HG13 HG13 ' A' ' 772' ' ' ILE . 27.7 t -81.31 102.82 7.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.243 -176.208 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 753' ' ' VAL . . . . . 0.626 HG13 ' HB2' ' A' ' 755' ' ' LYS . 7.1 p -80.7 -1.21 4.67 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.09 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 40.7 m 58.88 40.3 22.86 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.404 178.618 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 755' ' ' LYS . . . . . 0.626 ' HB2' HG13 ' A' ' 753' ' ' VAL . 0.0 OUTLIER -130.14 153.87 48.08 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.579 178.28 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 756' ' ' LYS . . . . . 0.542 ' O ' ' HD2' ' A' ' 756' ' ' LYS . 0.0 OUTLIER -95.78 -49.26 5.42 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 123.071 0.232 . . . . 0.0 111.136 -178.079 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 757' ' ' TRP . . . . . 0.49 ' CD2' ' HB2' ' A' ' 747' ' ' LEU . 71.4 t-105 76.88 139.47 0.07 Allowed 'General case' 0 N--CA 1.467 0.402 0 O-C-N 123.88 0.737 . . . . 0.0 110.634 179.486 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 758' ' ' GLN . . . . . 0.581 ' O ' ' HB2' ' A' ' 741' ' ' PRO . 0.0 OUTLIER -128.37 105.02 8.05 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.81 178.341 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 759' ' ' GLY . . . . . 0.835 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -178.03 -140.77 3.93 Favored Glycine 0 N--CA 1.44 -1.085 0 C-N-CA 119.733 -1.222 . . . . 0.0 112.824 -178.914 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 760' ' ' ARG . . . . . 0.407 ' HD2' HH11 ' A' ' 760' ' ' ARG . 7.2 ttm105 -67.19 -52.76 37.36 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.927 0.394 . . . . 0.0 110.086 -179.219 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -170.44 165.32 8.63 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.53 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 2.2 p -131.66 120.52 45.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.845 174.76 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 57.9 t -104.92 104.03 16.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 116.165 -0.471 . . . . 0.0 109.929 -178.436 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 764' ' ' THR . . . . . 0.547 HG21 HD12 ' A' ' 772' ' ' ILE . 38.5 m -103.18 117.5 34.67 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.415 -177.816 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 765' ' ' PHE . . . . . 0.633 ' HZ ' ' HG ' ' A' ' 791' ' ' LEU . 75.9 m-85 -81.84 133.3 35.31 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.046 176.477 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -95.93 136.43 36.38 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 -179.032 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 767' ' ' ARG . . . . . 0.466 ' HB3' ' HD2' ' A' ' 768' ' ' ARG . 0.0 OUTLIER -136.92 -73.04 0.43 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.722 0.296 . . . . 0.0 110.953 -178.253 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 768' ' ' ARG . . . . . 0.466 ' HD2' ' HB3' ' A' ' 767' ' ' ARG . 0.0 OUTLIER -112.25 -35.28 5.66 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.028 -176.396 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 74.3 m80 -100.33 136.94 39.45 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.308 -178.298 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 2.6 mt -129.92 127.74 64.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.955 -179.199 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . 148.72 26.1 0.07 OUTLIER Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.317 -0.944 . . . . 0.0 112.972 179.293 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 772' ' ' ILE . . . . . 0.837 HG13 HG13 ' A' ' 752' ' ' VAL . 0.0 OUTLIER -104.56 146.49 32.72 Favored Pre-proline 0 C--N 1.324 -0.5 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 176.912 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 773' ' ' PRO . . . . . 0.499 ' HD2' HG12 ' A' ' 772' ' ' ILE . 26.4 Cg_endo -61.73 125.76 17.42 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.615 2.21 . . . . 0.0 112.82 -178.398 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 774' ' ' LEU . . . . . 0.588 ' HA ' HG13 ' A' ' 782' ' ' VAL . 0.4 OUTLIER -98.13 -162.14 0.93 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.893 176.666 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 775' ' ' GLU . . . . . 0.591 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 2.4 mp0 -67.62 59.6 0.06 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 122.099 0.952 . . . . 0.0 112.691 177.903 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 14.5 ptpt -128.19 10.9 6.39 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 167.908 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 777' ' ' ALA . . . . . 0.728 ' HB1' ' HD2' ' A' ' 778' ' ' PRO . . . -133.79 164.63 42.61 Favored Pre-proline 0 N--CA 1.446 -0.645 0 CA-C-N 113.741 -1.572 . . . . 0.0 108.692 178.485 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 778' ' ' PRO . . . . . 0.728 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 14.2 Cg_endo -55.44 -24.35 43.22 Favored 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 123.591 2.861 . . . . 0.0 115.64 -169.756 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . -158.49 27.62 0.42 Allowed Glycine 0 CA--C 1.507 -0.407 0 C-N-CA 119.804 -1.189 . . . . 0.0 112.316 -174.715 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 780' ' ' GLU . . . . . 0.591 ' O ' ' HG3' ' A' ' 775' ' ' GLU . 13.8 mp0 -103.67 129.13 50.95 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -175.384 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 14.3 m95 -133.01 140.6 47.83 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 -177.561 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 782' ' ' VAL . . . . . 0.588 HG13 ' HA ' ' A' ' 774' ' ' LEU . 4.4 m -135.7 148.71 28.03 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.319 0 CA-C-O 120.53 0.205 . . . . 0.0 110.637 174.008 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 783' ' ' HIS . . . . . 0.564 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.1 OUTLIER -169.98 148.72 3.5 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.793 0.33 . . . . 0.0 110.978 177.771 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 784' ' ' SER . . . . . 0.414 ' HB3' ' NH1' ' A' ' 767' ' ' ARG . 0.9 OUTLIER -105.48 102.32 11.8 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.078 175.94 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 785' ' ' VAL . . . . . 0.868 HG13 ' H ' ' A' ' 787' ' ' ALA . 1.4 p -171.03 160.02 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 -179.627 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -94.63 25.01 4.22 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.787 0.327 . . . . 0.0 111.289 -178.574 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 787' ' ' ALA . . . . . 0.868 ' H ' HG13 ' A' ' 785' ' ' VAL . . . 52.43 64.47 7.41 Favored Pre-proline 0 CA--C 1.535 0.378 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.972 -179.491 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 788' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -65.43 -50.68 1.78 Allowed 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.55 2.166 . . . . 0.0 111.947 -178.113 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -161.98 -30.84 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.06 -179.685 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 790' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.57 -45.17 95.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.914 -0.584 . . . . 0.0 112.14 -178.183 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 791' ' ' LEU . . . . . 0.633 ' HG ' ' HZ ' ' A' ' 765' ' ' PHE . 0.3 OUTLIER -66.41 -53.66 29.2 Favored Pre-proline 0 CA--C 1.534 0.363 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -177.469 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 792' ' ' PRO . . . . . 0.415 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 9.7 Cg_endo -56.97 -34.58 97.76 Favored 'Trans proline' 0 C--N 1.357 0.98 0 C-N-CA 121.441 1.427 . . . . 0.0 112.17 176.187 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -64.05 -44.79 91.39 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.76 0.314 . . . . 0.0 110.624 176.408 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 794' ' ' LEU . . . . . 0.635 ' HA ' ' HD3' ' A' ' 797' ' ' ARG . 1.3 tm? -58.97 -49.13 79.05 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.16 178.678 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 795' ' ' LEU . . . . . 0.511 HD11 HG11 ' A' ' 746' ' ' VAL . 2.5 mm? -65.42 -41.24 93.76 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.336 -176.655 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -60.12 -50.36 74.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.286 -179.521 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 797' ' ' ARG . . . . . 0.635 ' HD3' ' HA ' ' A' ' 794' ' ' LEU . 0.0 OUTLIER -71.82 -25.4 61.97 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.583 -177.423 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -73.93 -23.73 19.1 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 CA-C-O 120.942 0.401 . . . . 0.0 111.29 178.436 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -80.26 -19.3 47.1 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.787 177.976 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 5.3 mt . . . . . 0 C--O 1.234 0.265 0 O-C-N 124.291 0.995 . . . . 0.0 112.011 177.955 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 824' ' ' ASP . . . . . 0.467 ' HB3' ' H ' ' A' ' 825' ' ' MET . 13.9 t0 . . . . . 0 C--O 1.231 0.129 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 825' ' ' MET . . . . . 0.467 ' H ' ' HB3' ' A' ' 824' ' ' ASP . 35.9 ttm -96.32 137.62 35.13 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.715 -175.863 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 826' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.66 120.23 37.38 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.886 -177.713 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 827' ' ' ILE . . . . . 0.71 HD12 ' HB ' ' A' ' 871' ' ' ILE . 13.0 mm -107.59 125.21 63.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.5 176.213 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 828' ' ' LEU . . . . . 0.407 ' HB3' HG21 ' A' ' 869' ' ' ILE . 6.7 tp -98.66 130.11 45.16 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.883 0.373 . . . . 0.0 110.613 -177.529 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 829' ' ' VAL . . . . . 0.549 HG21 HD12 ' A' ' 840' ' ' LEU . 0.2 OUTLIER -118.92 117.08 53.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.852 179.117 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 830' ' ' VAL . . . . . 0.434 HG13 ' HB3' ' A' ' 854' ' ' ALA . 0.0 OUTLIER -112.54 99.36 8.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 115.617 -0.719 . . . . 0.0 109.521 178.021 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 831' ' ' ASP . . . . . 0.665 ' HA ' ' O ' ' A' ' 875' ' ' ASP . 0.2 OUTLIER -117.29 146.98 42.97 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.834 0.349 . . . . 0.0 110.385 -178.609 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -91.75 -14.29 30.18 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.272 -172.449 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 2.5 m80 -124.98 98.42 36.35 Favored Pre-proline 0 C--N 1.327 -0.408 0 C-N-CA 120.881 -0.328 . . . . 0.0 111.346 -176.92 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 834' ' ' PRO . . . . . 0.632 ' HA ' ' HD3' ' A' ' 837' ' ' ARG . 15.1 Cg_exo -31.37 -41.98 0.11 Allowed 'Trans proline' 0 C--N 1.352 0.744 1 C-N-CA 125.899 4.399 . . . . 0.0 117.0 -169.29 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -58.94 -35.38 56.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.824 0.345 . . . . 0.0 111.569 -177.469 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 836' ' ' ASN . . . . . 0.595 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 22.4 m120 -72.32 -38.84 68.57 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 -179.002 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 837' ' ' ARG . . . . . 0.651 ' HG3' ' HB3' ' A' ' 831' ' ' ASP . 0.0 OUTLIER -51.72 -45.33 63.56 Favored 'General case' 0 C--O 1.224 -0.263 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.112 177.002 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 838' ' ' ARG . . . . . 0.489 ' HD3' ' N ' ' A' ' 839' ' ' LEU . 0.0 OUTLIER -59.09 -50.39 74.26 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.248 176.843 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 839' ' ' LEU . . . . . 0.489 ' N ' ' HD3' ' A' ' 838' ' ' ARG . 0.1 OUTLIER -62.99 -52.87 61.32 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.706 -0.679 . . . . 0.0 112.551 -170.045 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 840' ' ' LEU . . . . . 0.595 ' HG ' ' O ' ' A' ' 836' ' ' ASN . 0.0 OUTLIER -72.24 -33.11 67.28 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 120.293 -0.563 . . . . 0.0 110.964 -176.703 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -67.54 -39.3 85.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.933 0.397 . . . . 0.0 110.37 179.412 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.97 -41.18 97.63 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.089 177.396 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 843' ' ' GLN . . . . . 0.819 ' HG2' HD23 ' A' ' 929' ' ' LEU . 58.2 mt-30 -58.62 -48.05 82.3 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.214 175.672 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 844' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.81 -34.69 73.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.751 -0.658 . . . . 0.0 111.038 177.495 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -65.2 -40.2 96.6 Favored Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.89 -0.596 . . . . 0.0 112.411 178.738 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.81 -25.02 64.46 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.884 0.373 . . . . 0.0 110.574 178.416 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.18 -27.51 61.68 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.145 0.498 . . . . 0.0 110.196 176.06 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 94.39 25.46 16.1 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.755 -0.736 . . . . 0.0 113.16 175.206 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 849' ' ' TYR . . . . . 0.405 ' CE1' ' HB3' ' A' ' 825' ' ' MET . 0.4 OUTLIER -115.91 161.98 18.01 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.986 0.393 . . . . 0.0 110.654 179.86 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.55 131.0 37.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.321 -177.545 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -116.63 142.99 46.18 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.665 -178.957 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.11 109.84 13.4 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 175.603 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 853' ' ' THR . . . . . 0.441 HG22 ' HG2' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -94.21 133.99 37.15 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.945 0.402 . . . . 0.0 111.395 -175.988 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 854' ' ' ALA . . . . . 0.434 ' HB3' HG13 ' A' ' 830' ' ' VAL . . . -146.79 177.15 9.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.783 178.753 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 855' ' ' ASN . . . . . 0.574 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 42.5 t30 -154.58 80.72 1.1 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.349 177.754 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 856' ' ' ASP . . . . . 0.574 ' HB2' ' O ' ' A' ' 855' ' ' ASN . 2.1 t0 164.85 145.27 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.538 0 O-C-N 123.979 0.799 . . . . 0.0 110.151 177.285 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -73.59 -42.33 40.54 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.179 179.617 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 3.6 m -69.41 -31.34 49.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.778 0.323 . . . . 0.0 111.015 -178.463 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -73.96 -37.19 64.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.847 0.356 . . . . 0.0 110.539 179.418 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 860' ' ' ALA . . . . . 0.402 ' O ' HG12 ' A' ' 863' ' ' VAL . . . -61.1 -36.64 80.24 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.09 175.679 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 861' ' ' LEU . . . . . 0.855 HD21 ' HA ' ' A' ' 890' ' ' ILE . 6.8 mt -68.41 -43.46 77.14 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.574 176.763 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 32.5 t30 -58.69 -50.28 74.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.817 179.344 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 863' ' ' VAL . . . . . 0.529 HG13 HD11 ' A' ' 869' ' ' ILE . 1.6 p -64.4 -30.99 51.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.987 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 864' ' ' LEU . . . . . 0.474 ' HA ' HD12 ' A' ' 869' ' ' ILE . 0.7 OUTLIER -63.24 -38.02 89.53 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.002 0.429 . . . . 0.0 110.973 177.307 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -83.34 -18.89 37.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.909 0.385 . . . . 0.0 111.03 -177.45 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 11.6 tptp -87.54 -46.54 9.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.121 -178.879 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -130.9 165.49 22.96 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.874 -174.529 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 53.5 t60 -87.66 128.77 35.28 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.929 0.395 . . . . 0.0 110.695 -179.01 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 869' ' ' ILE . . . . . 0.529 HD11 HG13 ' A' ' 863' ' ' VAL . 4.4 mt -117.31 136.68 53.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.389 174.738 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 870' ' ' ASP . . . . . 0.412 ' OD2' ' HG3' ' A' ' 825' ' ' MET . 23.0 m-20 -88.53 -48.72 7.38 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.814 0.34 . . . . 0.0 110.856 -177.987 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 871' ' ' ILE . . . . . 0.71 ' HB ' HD12 ' A' ' 827' ' ' ILE . 6.6 mm -128.4 137.26 57.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.316 -179.127 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 872' ' ' VAL . . . . . 0.548 HG22 HD12 ' A' ' 897' ' ' LEU . 0.0 OUTLIER -110.4 117.9 55.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.66 0.267 . . . . 0.0 111.173 -179.36 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 873' ' ' LEU . . . . . 0.403 HD12 ' HB ' ' A' ' 829' ' ' VAL . 0.3 OUTLIER -105.09 113.0 26.33 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 175.192 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -104.71 96.85 6.85 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 177.671 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 875' ' ' ASP . . . . . 0.665 ' O ' ' HA ' ' A' ' 831' ' ' ASP . 52.8 t0 -104.83 106.95 17.66 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.395 0.617 . . . . 0.0 110.395 -174.876 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 876' ' ' VAL . . . . . 0.429 HG23 HG23 ' A' ' 903' ' ' THR . 0.0 OUTLIER -124.56 134.66 66.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.302 -176.273 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -72.1 -50.39 28.5 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 173.988 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 3.2 ptm . . . . . 0 C--N 1.325 -0.479 0 CA-C-N 115.315 -0.857 . . . . 0.0 108.805 174.414 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.722 0 N-CA-C 111.264 -0.735 . . . . 0.0 111.264 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 30.7 t80 -122.68 -44.34 2.22 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.082 0.468 . . . . 0.0 110.423 -177.015 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.46 -38.51 80.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.074 -177.793 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.33 -48.89 73.85 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.62 -178.48 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.53 -42.68 98.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.442 -178.704 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.16 -48.52 81.19 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.37 178.562 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 889' ' ' ARG . . . . . 0.405 ' HB3' HD11 ' A' ' 861' ' ' LEU . 0.0 OUTLIER -63.15 -41.87 99.35 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.768 -176.651 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 890' ' ' ILE . . . . . 0.855 ' HA ' HD21 ' A' ' 861' ' ' LEU . 8.1 mm -58.8 -52.81 55.74 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 121.131 0.491 . . . . 0.0 111.023 -178.888 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 891' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -71.48 -22.72 61.77 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.795 -179.1 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.31 -45.85 78.91 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.832 0.349 . . . . 0.0 110.41 177.986 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -67.82 -43.8 78.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.301 178.942 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 125.41 81.5 0.44 Allowed Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 120.219 -0.991 . . . . 0.0 112.567 178.133 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 895' ' ' LEU . . . . . 0.631 ' O ' ' HG ' ' A' ' 895' ' ' LEU . 0.3 OUTLIER -70.33 120.67 16.34 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.244 0.545 . . . . 0.0 110.211 178.452 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -113.97 8.86 17.29 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.601 0.715 . . . . 0.0 110.895 179.22 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 897' ' ' LEU . . . . . 0.548 HD12 HG22 ' A' ' 872' ' ' VAL . 0.0 OUTLIER -130.43 137.85 31.74 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.541 -176.481 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -58.97 120.38 8.21 Favored 'Trans proline' 0 C--O 1.236 0.406 0 C-N-CA 122.656 2.237 . . . . 0.0 112.104 -178.647 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 899' ' ' VAL . . . . . 0.714 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 7.4 t -95.36 127.71 47.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.096 0.474 . . . . 0.0 110.629 -179.118 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 900' ' ' ILE . . . . . 0.529 HG23 ' HB2' ' A' ' 921' ' ' SER . 4.5 mt -107.95 109.6 28.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.851 176.215 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 901' ' ' GLY . . . . . 0.462 ' HA3' ' SD ' ' A' ' 919' ' ' MET . . . -92.95 97.82 2.31 Favored Glycine 0 N--CA 1.444 -0.812 0 CA-C-N 115.865 -0.607 . . . . 0.0 112.319 -178.124 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 902' ' ' VAL . . . . . 0.946 ' HB ' ' HB3' ' A' ' 923' ' ' LEU . 0.2 OUTLIER -94.07 119.77 42.47 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.218 0.532 . . . . 0.0 109.797 175.981 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 903' ' ' THR . . . . . 0.506 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.3 OUTLIER -125.68 154.68 42.02 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.562 -179.098 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -88.22 102.56 14.93 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.636 -0.426 . . . . 0.0 110.685 178.262 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 14.2 t30 40.65 67.55 0.5 Allowed 'General case' 0 N--CA 1.47 0.574 0 O-C-N 124.135 0.897 . . . . 0.0 112.168 176.64 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -72.83 -53.36 11.68 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.035 -177.088 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 167.52 -53.68 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 -176.937 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -163.87 86.6 0.49 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.379 -1.282 . . . . 0.0 109.164 178.68 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -55.15 -36.46 65.84 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.576 -176.628 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 910' ' ' GLU . . . . . 0.573 ' HG2' ' N ' ' A' ' 911' ' ' LYS . 8.0 pm0 -68.43 -40.48 81.16 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.661 -179.684 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 911' ' ' LYS . . . . . 0.573 ' N ' ' HG2' ' A' ' 910' ' ' GLU . 7.2 tttt -71.07 -35.11 71.76 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.127 -178.884 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 912' ' ' GLN . . . . . 0.585 ' O ' ' HG3' ' A' ' 916' ' ' GLU . 5.0 tp60 -60.03 -48.05 83.32 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.765 175.191 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 913' ' ' ARG . . . . . 0.576 ' HA ' ' OE2' ' A' ' 916' ' ' GLU . 0.0 OUTLIER -59.75 -34.78 73.4 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.123 179.017 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 66.3 m -70.71 -33.91 71.36 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.906 0.384 . . . . 0.0 110.607 177.502 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.71 -52.87 15.57 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.559 -178.968 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 916' ' ' GLU . . . . . 0.585 ' HG3' ' O ' ' A' ' 912' ' ' GLN . 1.2 pp20? -78.17 -46.73 19.77 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.215 -176.135 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 1.4 m 51.16 43.94 28.94 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.727 -175.369 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 918' ' ' GLY . . . . . 0.409 ' H ' ' CD ' ' A' ' 916' ' ' GLU . . . -122.86 -32.55 0.92 Allowed Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.024 179.238 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 919' ' ' MET . . . . . 0.714 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 75.0 mtm -72.58 -91.01 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 176.987 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 920' ' ' ASP . . . . . 0.712 ' HB2' ' O ' ' A' ' 919' ' ' MET . 14.8 t0 149.31 -49.09 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.923 1.289 . . . . 0.0 110.43 172.682 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 921' ' ' SER . . . . . 0.529 ' HB2' HG23 ' A' ' 900' ' ' ILE . 0.8 OUTLIER -113.62 148.8 35.59 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.832 0.349 . . . . 0.0 110.69 179.878 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 922' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -117.26 141.96 47.65 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.056 178.842 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 923' ' ' LEU . . . . . 0.946 ' HB3' ' HB ' ' A' ' 902' ' ' VAL . 0.3 OUTLIER -148.4 167.68 24.62 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.843 0.354 . . . . 0.0 110.553 -179.401 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 924' ' ' SER . . . . . 0.506 ' HA ' ' O ' ' A' ' 903' ' ' THR . 3.9 m -115.88 150.0 37.76 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.997 175.498 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 925' ' ' LYS . . . . . 0.515 ' N ' ' HD2' ' A' ' 926' ' ' PRO . 1.4 tttp -51.62 -43.72 88.23 Favored Pre-proline 0 CA--C 1.54 0.595 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.897 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 926' ' ' PRO . . . . . 0.515 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 42.7 Cg_endo -69.01 63.24 1.36 Allowed 'Trans proline' 0 C--N 1.357 1.003 0 C-N-CA 121.987 1.792 . . . . 0.0 113.073 174.905 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 3.4 p -92.97 147.19 5.56 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.807 175.482 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -103.56 167.54 9.73 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.011 -177.593 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 929' ' ' LEU . . . . . 0.819 HD23 ' HG2' ' A' ' 843' ' ' GLN . 1.6 tm? -63.84 -35.8 81.81 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.152 179.04 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.28 -47.44 79.53 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.256 0.551 . . . . 0.0 110.359 -179.198 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 82.3 t -67.49 -44.94 86.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.924 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 932' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -62.43 -36.18 73.49 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-O 120.569 0.223 . . . . 0.0 110.426 -179.702 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 1.6 ttmt -68.28 -47.87 66.51 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.409 179.227 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.91 -43.02 95.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.907 179.425 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 17.8 m -65.45 -50.08 66.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.214 -178.79 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 936' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.33 -44.38 95.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.943 -178.45 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 36.2 m -62.94 -43.33 99.09 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.814 0.34 . . . . 0.0 111.48 -179.198 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.29 -49.36 64.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.954 -179.662 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -66.21 -34.65 78.5 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.213 -177.192 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -63.13 -45.57 91.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.794 0.33 . . . . 0.0 111.063 178.43 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 941' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.81 -34.11 76.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.121 179.266 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 942' ' ' ARG . . . . . 0.576 ' HG3' ' N ' ' A' ' 943' ' ' VAL . 0.0 OUTLIER -63.96 -47.56 79.94 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.967 -178.668 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 943' ' ' VAL . . . . . 0.576 ' N ' ' HG3' ' A' ' 942' ' ' ARG . 15.9 m -73.08 -29.9 30.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.551 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.49 -40.48 95.75 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.011 178.821 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 945' ' ' LYS . . . . . 0.441 ' HG2' ' O ' ' A' ' 942' ' ' ARG . 0.4 OUTLIER -79.63 -20.76 46.0 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 121.098 -0.241 . . . . 0.0 111.473 -179.161 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 16.1 m -72.93 -30.4 63.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.561 0.696 . . . . 0.0 109.797 171.873 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -82.55 -17.6 44.36 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.08 174.265 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 10.1 t70 . . . . . 0 C--O 1.232 0.146 0 CA-C-N 114.858 -1.065 . . . . 0.0 110.771 -178.609 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 705' ' ' SER . . . . . 0.503 ' HA ' ' O ' ' A' ' 730' ' ' GLY . 0.0 OUTLIER . . . . . 0 N--CA 1.452 -0.357 0 CA-C-O 120.739 0.304 . . . . 0.0 111.033 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 93.42 -19.79 50.42 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.527 179.411 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 707' ' ' LYS . . . . . 0.681 ' NZ ' ' HA ' ' A' ' 745' ' ' ASP . 7.8 tmtm? -84.61 147.98 26.7 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 -179.89 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 708' ' ' ARG . . . . . 0.459 ' HD2' ' CZ2' ' A' ' 710' ' ' TRP . 6.4 mtm-85 -113.22 162.68 15.72 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.612 0.72 . . . . 0.0 111.678 -177.171 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 709' ' ' CYS . . . . . 0.63 ' SG ' HD22 ' A' ' 726' ' ' LEU . 1.2 m -132.88 117.89 18.26 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 114.6 -1.182 . . . . 0.0 108.847 168.11 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 710' ' ' TRP . . . . . 0.459 ' CZ2' ' HD2' ' A' ' 708' ' ' ARG . 91.0 m95 -94.04 107.16 19.1 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 711' ' ' LEU . . . . . 0.964 HD21 HG13 ' A' ' 733' ' ' VAL . 0.1 OUTLIER -110.12 128.46 55.46 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.127 0.489 . . . . 0.0 111.124 -176.845 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -119.45 44.19 2.43 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.21 175.449 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 713' ' ' VAL . . . . . 0.933 ' HA ' ' HB2' ' A' ' 750' ' ' ASP . 43.6 t -99.42 123.52 52.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.431 -178.387 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 714' ' ' ARG . . . . . 0.728 HH12 ' HG3' ' A' ' 751' ' ' GLU . 0.0 OUTLIER -78.46 -35.98 45.94 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 177.836 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 13.7 m-80 -59.92 109.95 1.06 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.382 -0.827 . . . . 0.0 110.715 -176.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -58.91 -43.67 91.09 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.491 -176.343 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.28 -42.81 96.21 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.229 0.538 . . . . 0.0 110.73 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 718' ' ' LEU . . . . . 0.606 ' HB3' HG11 ' A' ' 713' ' ' VAL . 0.2 OUTLIER -72.05 -49.71 34.42 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.121 -177.858 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 719' ' ' CYS . . . . . 0.812 ' SG ' ' HB ' ' A' ' 713' ' ' VAL . 0.1 OUTLIER -62.67 -50.35 71.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.089 -178.251 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -59.09 -44.15 91.89 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.668 -177.626 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -61.39 -52.13 65.88 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.799 0.333 . . . . 0.0 110.993 -178.158 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 14.7 mt -62.73 -45.1 94.27 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.653 -178.894 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 723' ' ' GLU . . . . . 0.538 ' HA ' HG21 ' A' ' 733' ' ' VAL . 0.8 OUTLIER -59.08 -46.47 88.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.865 -179.045 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 724' ' ' THR . . . . . . . . . . . . . 57.6 m -61.63 -41.73 97.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.892 0.377 . . . . 0.0 111.043 -178.905 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 14.1 m -67.22 -39.49 86.25 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.067 -0.515 . . . . 0.0 112.167 -175.422 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 726' ' ' LEU . . . . . 0.89 HD23 HD12 ' A' ' 731' ' ' ILE . 0.2 OUTLIER -82.31 -33.68 28.91 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.916 -0.313 . . . . 0.0 111.326 -178.881 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 727' ' ' GLN . . . . . 0.461 HE21 ' HB3' ' A' ' 727' ' ' GLN . 0.8 OUTLIER -72.95 -13.24 61.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.02 0.438 . . . . 0.0 110.413 177.28 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.84 -19.3 63.97 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.618 176.487 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 729' ' ' SER . . . . . 0.432 ' HB2' ' H ' ' A' ' 730' ' ' GLY . 0.0 OUTLIER -98.11 -96.26 0.22 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.339 177.748 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 730' ' ' GLY . . . . . 0.503 ' O ' ' HA ' ' A' ' 705' ' ' SER . . . -159.1 21.64 0.29 Allowed Glycine 0 N--CA 1.45 -0.416 0 N-CA-C 111.016 -0.834 . . . . 0.0 111.016 178.264 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 731' ' ' ILE . . . . . 0.89 HD12 HD23 ' A' ' 726' ' ' LEU . 2.5 mt -89.76 132.25 34.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 -177.283 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 732' ' ' VAL . . . . . 0.422 HG13 ' HG3' ' A' ' 708' ' ' ARG . 1.5 p -87.13 108.59 18.27 Favored 'Isoleucine or valine' 0 C--O 1.238 0.488 0 CA-C-O 121.826 0.822 . . . . 0.0 111.335 -176.784 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 733' ' ' VAL . . . . . 0.964 HG13 HD21 ' A' ' 711' ' ' LEU . 2.2 t -75.41 117.33 19.59 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.0 -1.0 . . . . 0.0 109.85 176.661 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.01 126.28 41.03 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.637 -179.085 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -56.89 130.63 46.69 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.802 177.551 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -72.42 77.86 1.03 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.394 0.616 . . . . 0.0 110.443 178.192 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.41 -13.1 61.74 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.639 177.375 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 109.1 39.5 1.67 Allowed Glycine 0 N--CA 1.447 -0.574 0 N-CA-C 111.06 -0.816 . . . . 0.0 111.06 -174.531 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -85.81 -167.15 1.75 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.47 -0.365 . . . . 0.0 110.784 -177.795 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -67.78 122.0 81.78 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.341 -177.649 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 741' ' ' PRO . . . . . 0.442 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 29.4 Cg_endo -65.22 122.9 10.77 Favored 'Trans proline' 0 N--CA 1.463 -0.315 0 C-N-CA 122.371 2.047 . . . . 0.0 111.183 176.765 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 742' ' ' THR . . . . . 0.719 ' HB ' ' HB2' ' A' ' 745' ' ' ASP . 0.1 OUTLIER -104.99 124.88 35.21 Favored Pre-proline 0 C--N 1.322 -0.606 0 CA-C-O 120.948 0.404 . . . . 0.0 111.363 -174.391 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 743' ' ' PRO . . . . . 0.822 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 34.7 Cg_endo -65.47 -12.93 37.25 Favored 'Trans proline' 0 N--CA 1.473 0.267 0 C-N-CA 123.497 2.798 . . . . 0.0 113.693 -175.681 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -108.18 -0.66 20.85 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.553 0.692 . . . . 0.0 110.583 177.564 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 745' ' ' ASP . . . . . 0.719 ' HB2' ' HB ' ' A' ' 742' ' ' THR . 28.0 m-20 -111.89 165.87 11.7 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.758 -173.927 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 746' ' ' VAL . . . . . 0.654 HG21 HD11 ' A' ' 795' ' ' LEU . 16.6 m -123.46 147.42 27.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.432 -171.517 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 747' ' ' LEU . . . . . 0.424 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 0.2 OUTLIER -107.45 99.9 9.38 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.18 178.231 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 5.7 mt -90.62 106.61 17.59 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 174.403 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 8.9 t -117.89 148.13 42.43 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.361 0.6 . . . . 0.0 111.989 -171.522 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 750' ' ' ASP . . . . . 0.933 ' HB2' ' HA ' ' A' ' 713' ' ' VAL . 54.0 t0 -95.86 109.24 21.61 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.089 -0.959 . . . . 0.0 109.033 177.287 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 751' ' ' GLU . . . . . 0.728 ' HG3' HH12 ' A' ' 714' ' ' ARG . 9.2 mt-10 67.66 -150.76 0.17 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.423 -177.954 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 752' ' ' VAL . . . . . 0.481 ' H ' ' HB3' ' A' ' 751' ' ' GLU . 59.0 t -88.03 116.96 30.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.17 0.509 . . . . 0.0 111.815 -172.691 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 6.1 p -95.97 156.4 3.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.016 171.732 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.7 41.5 0.57 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.952 0.406 . . . . 0.0 111.887 -176.537 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.77 -170.44 2.9 Favored 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 179.044 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 756' ' ' LYS . . . . . 0.617 ' O ' ' HB2' ' A' ' 757' ' ' TRP . 0.0 OUTLIER -117.22 -77.28 0.57 Allowed 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 170.138 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 757' ' ' TRP . . . . . 0.617 ' HB2' ' O ' ' A' ' 756' ' ' LYS . 10.7 t-105 152.93 109.21 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.41 0 O-C-N 124.76 1.288 . . . . 0.0 110.359 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.81 75.89 4.24 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 171.017 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 759' ' ' GLY . . . . . 0.822 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -158.1 -143.52 3.68 Favored Glycine 0 N--CA 1.444 -0.798 0 CA-C-N 115.681 -0.69 . . . . 0.0 112.381 -175.806 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.63 -55.72 5.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.767 0.283 . . . . 0.0 111.105 -178.051 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -166.51 149.12 6.78 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.746 -179.08 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 2.5 p -116.64 131.03 70.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 121.006 0.431 . . . . 0.0 110.572 178.641 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 763' ' ' VAL . . . . . 0.605 HG11 HD21 ' A' ' 791' ' ' LEU . 38.9 t -110.54 111.34 35.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.956 -0.565 . . . . 0.0 109.938 179.315 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 764' ' ' THR . . . . . 0.447 ' HB ' HG12 ' A' ' 782' ' ' VAL . 1.5 m -103.47 122.18 44.37 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.21 -176.518 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 765' ' ' PHE . . . . . . . . . . . . . 36.5 m-85 -92.16 123.98 35.91 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 175.386 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 766' ' ' CYS . . . . . 0.49 ' SG ' ' HB ' ' A' ' 782' ' ' VAL . 1.3 m -96.4 132.89 41.47 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.762 0.315 . . . . 0.0 110.814 -176.158 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.83 -57.01 1.35 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.614 179.481 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 2.7 tpm_? -136.15 -43.36 0.64 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.17 0.509 . . . . 0.0 110.288 177.715 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -89.6 110.51 21.37 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.759 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 5.1 mt -116.87 83.26 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-O 121.109 0.48 . . . . 0.0 110.003 178.593 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -125.71 13.18 7.3 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.302 179.831 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 772' ' ' ILE . . . . . 0.441 ' HA ' ' HD3' ' A' ' 773' ' ' PRO . 42.6 mm -105.36 132.78 20.58 Favored Pre-proline 0 C--N 1.322 -0.6 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 177.868 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 773' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 772' ' ' ILE . 36.0 Cg_exo -61.7 150.41 85.83 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.771 2.314 . . . . 0.0 112.381 178.016 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 774' ' ' LEU . . . . . 0.626 ' HG ' ' H ' ' A' ' 776' ' ' LYS . 0.5 OUTLIER -97.45 -162.34 0.95 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.602 179.874 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 775' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -62.4 8.31 0.05 Allowed 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 113.307 0.855 . . . . 0.0 113.307 179.552 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 776' ' ' LYS . . . . . 0.626 ' H ' ' HG ' ' A' ' 774' ' ' LEU . 7.6 ptmt -65.07 -18.26 65.15 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 165.692 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 777' ' ' ALA . . . . . 0.725 ' HB3' ' HB2' ' A' ' 780' ' ' GLU . . . -105.83 161.17 23.63 Favored Pre-proline 0 N--CA 1.451 -0.415 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.79 176.099 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 778' ' ' PRO . . . . . 0.566 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 57.2 Cg_endo -69.77 -9.6 26.5 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.781 2.321 . . . . 0.0 114.47 -172.305 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . -156.35 23.54 0.51 Allowed Glycine 0 CA--C 1.505 -0.551 0 C-N-CA 119.838 -1.173 . . . . 0.0 112.603 -175.393 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 780' ' ' GLU . . . . . 0.725 ' HB2' ' HB3' ' A' ' 777' ' ' ALA . 0.4 OUTLIER -114.88 129.2 56.66 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 -178.601 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 18.6 m95 -129.62 139.13 51.51 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 179.83 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 782' ' ' VAL . . . . . 0.49 ' HB ' ' SG ' ' A' ' 766' ' ' CYS . 14.7 m -133.45 143.89 37.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 110.17 -0.308 . . . . 0.0 110.17 173.732 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 783' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -166.62 148.03 6.29 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.536 176.319 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -102.57 102.35 12.58 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.38 178.888 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -154.7 162.8 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.587 -0.279 . . . . 0.0 110.252 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -100.4 32.23 3.12 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.115 -179.735 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 56.5 79.15 0.34 Allowed Pre-proline 0 N--CA 1.465 0.291 0 CA-C-N 116.064 -0.516 . . . . 0.0 112.006 178.081 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 788' ' ' PRO . . . . . 0.642 ' HB2' ' OE2' ' A' ' 790' ' ' GLU . 10.2 Cg_endo -88.35 -128.4 0.01 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 122.948 2.432 . . . . 0.0 111.278 175.544 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 789' ' ' HIS . . . . . 0.465 ' H ' ' HB2' ' A' ' 788' ' ' PRO . 14.2 p-80 -114.06 1.09 14.52 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.875 0.369 . . . . 0.0 111.038 -179.18 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 790' ' ' GLU . . . . . 0.642 ' OE2' ' HB2' ' A' ' 788' ' ' PRO . 1.7 pm0 -92.36 -44.51 8.67 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.334 -176.956 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 791' ' ' LEU . . . . . 0.605 HD21 HG11 ' A' ' 763' ' ' VAL . 0.2 OUTLIER -71.18 -42.48 11.91 Favored Pre-proline 0 CA--C 1.535 0.387 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -177.769 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 792' ' ' PRO . . . . . 0.549 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 10.3 Cg_endo -57.83 -29.37 85.82 Favored 'Trans proline' 0 C--N 1.353 0.8 0 C-N-CA 121.261 1.307 . . . . 0.0 111.607 172.048 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -74.34 -34.29 63.37 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.258 175.824 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -60.31 -43.24 96.5 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.671 174.512 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 795' ' ' LEU . . . . . 0.654 HD11 HG21 ' A' ' 746' ' ' VAL . 0.2 OUTLIER -62.29 -39.77 94.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.566 177.971 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -63.54 -46.31 86.58 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.788 178.653 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 797' ' ' ARG . . . . . 0.443 ' HG3' ' N ' ' A' ' 798' ' ' ILE . 0.0 OUTLIER -65.51 -34.8 79.12 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.477 -0.328 . . . . 0.0 110.37 179.037 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 798' ' ' ILE . . . . . 0.443 ' N ' ' HG3' ' A' ' 797' ' ' ARG . 0.1 OUTLIER -65.49 -25.92 38.03 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.527 179.878 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.03 -65.36 0.69 Allowed 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.309 -0.405 . . . . 0.0 109.936 175.352 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 800' ' ' LEU . . . . . 0.478 HD23 ' HA ' ' A' ' 800' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.248 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.062 177.444 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 32.6 t70 . . . . . 0 C--O 1.232 0.172 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 1.4 tpp -79.49 90.77 5.09 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 171.646 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 826' ' ' MET . . . . . 0.519 ' H ' ' HG2' ' A' ' 826' ' ' MET . 0.0 OUTLIER -93.3 105.74 17.78 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.142 -173.938 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 827' ' ' ILE . . . . . . . . . . . . . 6.4 mm -115.12 129.25 71.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.342 178.244 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -94.81 131.9 40.18 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 178.739 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 829' ' ' VAL . . . . . 0.567 HG13 HD12 ' A' ' 873' ' ' LEU . 0.0 OUTLIER -113.84 95.89 4.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 176.959 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 830' ' ' VAL . . . . . . . . . . . . . 10.7 t -97.18 88.18 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.147 -179.601 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 831' ' ' ASP . . . . . 0.675 ' HA ' ' HB2' ' A' ' 875' ' ' ASP . 0.0 OUTLIER -104.65 154.61 19.74 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.087 -176.077 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -87.63 -22.82 24.5 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -175.898 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -130.74 114.17 16.61 Favored Pre-proline 0 N--CA 1.465 0.32 0 O-C-N 121.394 -0.817 . . . . 0.0 111.951 -174.433 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -42.44 -52.93 4.02 Favored 'Trans proline' 0 N--CA 1.479 0.632 0 C-N-CA 124.731 3.621 . . . . 0.0 115.315 -172.134 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 835' ' ' ILE . . . . . 0.419 ' O ' ' HB3' ' A' ' 838' ' ' ARG . 3.6 tp -58.67 -40.02 78.06 Favored 'Isoleucine or valine' 0 C--O 1.24 0.572 0 CA-C-O 121.437 0.637 . . . . 0.0 111.063 -178.149 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 836' ' ' ASN . . . . . 0.547 ' HB3' ' HZ2' ' A' ' 925' ' ' LYS . 3.7 m-20 -70.23 -40.5 74.45 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.608 -179.703 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 837' ' ' ARG . . . . . 0.668 ' HB2' ' OD1' ' A' ' 831' ' ' ASP . 0.0 OUTLIER -54.72 -44.53 73.57 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.55 174.755 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 838' ' ' ARG . . . . . 0.419 ' HB3' ' O ' ' A' ' 835' ' ' ILE . 0.0 OUTLIER -51.54 -46.54 63.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.557 178.766 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.5 -48.06 79.14 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.881 -0.6 . . . . 0.0 112.042 -176.251 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 840' ' ' LEU . . . . . 0.495 ' H ' ' HG ' ' A' ' 840' ' ' LEU . 0.0 OUTLIER -70.87 -37.84 73.08 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 122.037 -0.414 . . . . 0.0 110.928 -178.13 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -66.35 -31.69 72.63 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.241 0.543 . . . . 0.0 110.366 178.343 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 842' ' ' ASP . . . . . 0.41 ' HB2' ' O ' ' A' ' 838' ' ' ARG . 10.9 t0 -65.39 -42.47 92.6 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.83 175.35 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 843' ' ' GLN . . . . . 0.579 ' HG3' HD23 ' A' ' 929' ' ' LEU . 0.0 OUTLIER -64.96 -44.92 87.8 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.33 178.581 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 844' ' ' LEU . . . . . 0.628 ' HA ' HD23 ' A' ' 847' ' ' LEU . 0.0 OUTLIER -60.95 -43.55 98.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.086 178.752 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -64.71 -42.4 97.22 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.913 -0.66 . . . . 0.0 112.282 179.682 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 51.0 m -77.02 -9.58 58.8 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.904 0.383 . . . . 0.0 111.185 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 847' ' ' LEU . . . . . 0.628 HD23 ' HA ' ' A' ' 844' ' ' LEU . 0.0 OUTLIER -87.69 -28.31 21.88 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 175.333 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 106.97 18.32 10.71 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.488 174.783 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 5.5 m-30 -106.38 165.69 11.08 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.94 -0.392 . . . . 0.0 109.94 179.326 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -95.17 117.49 30.32 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.931 0.396 . . . . 0.0 110.343 -178.565 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -100.59 127.17 47.05 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.276 -176.189 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.64 116.66 32.32 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 172.153 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.71 132.93 35.51 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 -171.883 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 854' ' ' ALA . . . . . . . . . . . . . . . -151.02 147.2 26.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.769 176.785 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 855' ' ' ASN . . . . . 0.653 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 9.1 t-20 -128.13 73.19 1.45 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.982 176.144 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 856' ' ' ASP . . . . . 0.653 ' HB2' ' O ' ' A' ' 855' ' ' ASN . 2.1 t70 162.18 159.74 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.213 175.865 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -81.66 -30.98 34.32 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.137 178.835 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 858' ' ' VAL . . . . . 0.455 HG22 ' OD1' ' A' ' 856' ' ' ASP . 3.3 m -73.23 -31.76 35.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.688 0.28 . . . . 0.0 111.074 -178.222 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -67.79 -42.75 81.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.236 0.541 . . . . 0.0 109.973 178.741 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 860' ' ' ALA . . . . . 0.439 ' O ' ' HB2' ' A' ' 864' ' ' LEU . . . -64.77 -44.69 89.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.641 177.43 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 861' ' ' LEU . . . . . 0.484 HD21 ' HA3' ' A' ' 894' ' ' GLY . 0.1 OUTLIER -61.06 -34.25 74.59 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.717 178.348 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -61.17 -54.57 42.66 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.915 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 14.4 p -71.78 -32.45 44.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.731 0.301 . . . . 0.0 110.824 -177.848 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 864' ' ' LEU . . . . . 0.439 ' HB2' ' O ' ' A' ' 860' ' ' ALA . 0.2 OUTLIER -63.5 -45.12 92.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.771 178.311 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 15.2 m -71.71 -21.76 61.73 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.801 -179.192 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.28 -69.18 0.37 Allowed 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 173.811 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 867' ' ' ASN . . . . . 0.599 ' O ' ' HB2' ' A' ' 868' ' ' HIS . 9.0 t30 159.17 127.4 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.609 0 O-C-N 124.274 0.984 . . . . 0.0 110.021 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 868' ' ' HIS . . . . . 0.599 ' HB2' ' O ' ' A' ' 867' ' ' ASN . 14.3 m-70 134.92 171.7 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.005 0 O-C-N 125.202 1.564 . . . . 0.0 110.528 165.667 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 869' ' ' ILE . . . . . 0.591 ' HB ' ' O ' ' A' ' 868' ' ' HIS . 1.5 mp 86.0 129.57 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 O-C-N 124.461 1.1 . . . . 0.0 111.109 174.748 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -112.76 -16.58 12.74 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.435 -178.311 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 871' ' ' ILE . . . . . . . . . . . . . 2.1 mt -145.95 137.69 19.69 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 178.761 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 872' ' ' VAL . . . . . 0.587 ' HB ' HG22 ' A' ' 899' ' ' VAL . 7.2 t -122.39 135.75 61.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.676 0.274 . . . . 0.0 110.962 -177.879 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 873' ' ' LEU . . . . . 0.567 HD12 HG13 ' A' ' 829' ' ' VAL . 10.0 mt -110.88 136.11 50.4 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 173.984 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -120.66 104.96 10.33 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.26 178.8 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 875' ' ' ASP . . . . . 0.675 ' HB2' ' HA ' ' A' ' 831' ' ' ASP . 0.8 OUTLIER -89.17 105.68 17.94 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.543 -176.825 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -95.95 100.02 10.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.548 -177.145 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 877' ' ' ASN . . . . . 0.424 ' HA ' ' HB3' ' A' ' 904' ' ' ALA . 0.8 OUTLIER -73.11 -43.0 62.33 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.758 176.368 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.577 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.256 174.984 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.32 0 N-CA-C 112.66 -0.176 . . . . 0.0 112.66 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 23.3 p90 -89.28 -22.4 22.71 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 -178.292 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -61.5 -31.35 71.34 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.752 174.882 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.92 -53.89 53.14 Favored 'General case' 0 CA--C 1.528 0.127 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.609 179.613 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.49 -36.19 80.62 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.839 -178.894 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 888' ' ' GLN . . . . . 0.474 ' HA ' ' HD3' ' A' ' 891' ' ' ARG . 60.9 mm-40 -61.08 -50.48 73.11 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.004 179.613 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.59 -44.72 95.93 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.485 -177.534 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 890' ' ' ILE . . . . . . . . . . . . . 18.0 mt -69.15 -46.45 77.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.059 -177.961 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 891' ' ' ARG . . . . . 0.474 ' HD3' ' HA ' ' A' ' 888' ' ' GLN . 2.3 ptm180 -66.96 -23.97 66.01 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.893 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 892' ' ' GLN . . . . . 0.457 ' HB2' ' O ' ' A' ' 888' ' ' GLN . 1.5 tp60 -71.88 -60.34 2.28 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.71 177.772 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -157.2 48.24 0.43 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.594 -176.349 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 894' ' ' GLY . . . . . 0.484 ' HA3' HD21 ' A' ' 861' ' ' LEU . . . -141.86 0.06 1.57 Allowed Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.35 176.508 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 895' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -108.4 110.74 22.36 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.973 0.416 . . . . 0.0 110.763 -178.312 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -134.54 22.57 3.67 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.563 0.697 . . . . 0.0 109.717 175.904 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 897' ' ' LEU . . . . . 0.406 ' HB2' ' HD2' ' A' ' 898' ' ' PRO . 0.4 OUTLIER -159.51 164.46 20.44 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.748 -173.666 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 898' ' ' PRO . . . . . 0.406 ' HD2' ' HB2' ' A' ' 897' ' ' LEU . 38.0 Cg_endo -67.07 128.76 19.2 Favored 'Trans proline' 0 C--O 1.241 0.629 0 C-N-CA 122.316 2.011 . . . . 0.0 111.941 176.129 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 899' ' ' VAL . . . . . 0.79 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 69.0 t -115.61 128.31 72.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.143 178.897 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 900' ' ' ILE . . . . . 0.455 ' HA ' ' O ' ' A' ' 921' ' ' SER . 3.0 mt -108.52 121.91 62.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.008 179.263 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -96.32 126.95 9.0 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 120.686 -0.768 . . . . 0.0 111.907 -178.913 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 902' ' ' VAL . . . . . 0.765 HG12 ' HA ' ' A' ' 925' ' ' LYS . 1.1 t -104.59 97.56 5.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 177.94 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.27 135.95 33.35 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.959 -172.895 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 904' ' ' ALA . . . . . 0.46 ' HA ' ' HB2' ' A' ' 925' ' ' LYS . . . -96.31 115.06 26.83 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.705 178.565 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 60.8 45.62 9.72 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 121.207 0.527 . . . . 0.0 111.238 177.267 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -98.27 98.86 10.07 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.046 177.41 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 11.1 tp -45.26 -45.15 11.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.521 176.476 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 908' ' ' ALA . . . . . 0.411 ' HB1' ' HB2' ' A' ' 911' ' ' LYS . . . -126.39 78.96 1.82 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.019 0.438 . . . . 0.0 110.582 177.605 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 909' ' ' GLU . . . . . 0.435 ' H ' ' HG2' ' A' ' 909' ' ' GLU . 0.0 OUTLIER -62.31 -41.37 98.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.527 -178.868 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 910' ' ' GLU . . . . . 0.526 ' H ' ' HG2' ' A' ' 910' ' ' GLU . 0.1 OUTLIER -64.02 -31.02 72.05 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.091 -179.753 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 911' ' ' LYS . . . . . 0.411 ' HB2' ' HB1' ' A' ' 908' ' ' ALA . 12.6 tttt -68.87 -41.64 78.08 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.259 179.781 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 69.9 tp60 -63.13 -36.24 82.96 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.134 177.017 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 913' ' ' ARG . . . . . 0.578 ' HB2' ' SG ' ' A' ' 922' ' ' CYS . 3.7 ttp180 -58.66 -46.96 86.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.944 177.814 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 7.4 m -74.94 -26.1 59.36 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.549 -176.171 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 1.2 tp -70.02 -51.74 29.81 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.954 0.407 . . . . 0.0 111.099 179.406 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -78.52 -42.53 29.24 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.506 -178.219 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 2.3 m 51.15 47.8 24.2 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.088 0.47 . . . . 0.0 111.573 -176.777 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -133.06 24.43 3.79 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.013 179.716 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 919' ' ' MET . . . . . 0.79 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -130.14 -101.45 0.31 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.576 0.226 . . . . 0.0 110.755 -177.198 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 920' ' ' ASP . . . . . 0.422 ' HB2' ' O ' ' A' ' 919' ' ' MET . 10.4 t70 168.2 -64.83 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.993 0.917 . . . . 0.0 108.801 179.83 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 921' ' ' SER . . . . . 0.455 ' O ' ' HA ' ' A' ' 900' ' ' ILE . 70.9 m -139.23 163.11 33.32 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.653 179.018 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 922' ' ' CYS . . . . . 0.578 ' SG ' ' HB2' ' A' ' 913' ' ' ARG . 0.0 OUTLIER -137.6 158.24 44.8 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.03 0.443 . . . . 0.0 111.496 -177.506 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 923' ' ' LEU . . . . . 0.465 HD21 HG21 ' A' ' 935' ' ' THR . 0.0 OUTLIER -146.8 168.35 21.62 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.232 175.218 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 1.4 m -78.37 142.71 37.46 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.064 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 925' ' ' LYS . . . . . 0.765 ' HA ' HG12 ' A' ' 902' ' ' VAL . 0.0 OUTLIER -54.35 -39.95 78.8 Favored Pre-proline 0 CA--C 1.538 0.502 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 179.433 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -62.11 74.03 0.1 OUTLIER 'Trans proline' 0 C--N 1.36 1.162 0 C-N-CA 122.077 1.852 . . . . 0.0 112.194 171.184 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -98.47 140.17 18.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.968 -176.638 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.07 163.41 12.44 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.554 177.357 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 929' ' ' LEU . . . . . 0.579 HD23 ' HG3' ' A' ' 843' ' ' GLN . 0.0 OUTLIER -56.43 -46.41 80.29 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.355 -177.271 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -67.57 -34.38 76.93 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.028 0.442 . . . . 0.0 110.799 -177.459 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 62.4 t -69.61 -48.77 63.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.448 -178.728 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 932' ' ' ILE . . . . . 0.414 HG21 ' HB3' ' A' ' 843' ' ' GLN . 2.0 tp -67.28 -37.36 78.93 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 CA-C-O 120.64 0.257 . . . . 0.0 110.589 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 933' ' ' LYS . . . . . 0.492 ' HA ' HD13 ' A' ' 847' ' ' LEU . 0.8 OUTLIER -61.77 -47.64 84.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.169 176.87 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 934' ' ' GLN . . . . . 0.588 ' O ' ' HB2' ' A' ' 938' ' ' LEU . 1.9 tp60 -60.52 -51.08 70.95 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.743 -179.175 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 935' ' ' THR . . . . . 0.465 HG21 HD21 ' A' ' 923' ' ' LEU . 8.6 m -61.87 -47.63 84.16 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.529 -177.874 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 936' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.73 -47.84 68.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.385 -176.014 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 67.9 m -67.87 -39.46 83.71 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 111.708 0.262 . . . . 0.0 111.708 -178.181 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 938' ' ' LEU . . . . . 0.588 ' HB2' ' O ' ' A' ' 934' ' ' GLN . 0.2 OUTLIER -62.35 -44.31 96.78 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.987 0.422 . . . . 0.0 110.45 179.101 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -72.79 -30.65 64.26 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.929 -179.761 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -64.2 -35.82 82.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.857 0.361 . . . . 0.0 110.612 176.2 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 941' ' ' GLU . . . . . 0.419 ' HG3' ' N ' ' A' ' 942' ' ' ARG . 0.0 OUTLIER -78.9 -31.85 45.5 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.474 178.256 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 942' ' ' ARG . . . . . 0.625 ' HG3' ' N ' ' A' ' 943' ' ' VAL . 0.0 OUTLIER -65.59 -46.88 77.69 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 178.133 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 943' ' ' VAL . . . . . 0.625 ' N ' ' HG3' ' A' ' 942' ' ' ARG . 30.7 m -69.65 -28.25 36.76 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.265 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.08 179.503 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.7 -44.23 85.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.252 174.902 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 5.1 mttt -64.44 -45.06 89.12 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.315 -179.291 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.75 -35.64 77.35 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.832 0.349 . . . . 0.0 111.456 -178.983 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 27.4 mtt-85 -71.76 -50.38 30.52 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.861 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 6.7 t70 . . . . . 0 C--N 1.323 -0.549 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.404 -176.035 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 705' ' ' SER . . . . . 0.455 ' HA ' ' O ' ' A' ' 730' ' ' GLY . 0.7 OUTLIER . . . . . 0 N--CA 1.456 -0.143 0 CA-C-O 121.148 0.499 . . . . 0.0 111.825 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . -170.66 25.63 0.1 OUTLIER Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 121.042 -0.599 . . . . 0.0 112.038 176.626 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 707' ' ' LYS . . . . . 0.539 ' HE3' ' HB3' ' A' ' 744' ' ' GLU . 26.1 mmtm -133.7 137.56 45.35 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 178.014 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 708' ' ' ARG . . . . . 0.755 ' HA ' HG23 ' A' ' 732' ' ' VAL . 6.5 mtp85 -92.11 136.24 33.34 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 121.369 0.604 . . . . 0.0 111.218 -173.892 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 1.7 t -104.31 109.97 22.02 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 171.906 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 710' ' ' TRP . . . . . 0.417 ' CZ2' ' HD3' ' A' ' 708' ' ' ARG . 89.2 m95 -90.13 96.23 10.57 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.815 0.817 . . . . 0.0 109.156 -178.526 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 711' ' ' LEU . . . . . 0.458 HD21 ' HB2' ' A' ' 719' ' ' CYS . 1.3 tp -95.64 104.65 16.58 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 114.611 -1.177 . . . . 0.0 111.305 -169.434 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 712' ' ' ALA . . . . . 0.404 ' HB2' ' HB3' ' A' ' 736' ' ' TYR . . . -103.51 30.92 4.66 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.786 0.803 . . . . 0.0 109.345 174.961 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 713' ' ' VAL . . . . . 0.722 HG13 ' HB3' ' A' ' 750' ' ' ASP . 49.1 t -92.98 115.43 31.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 114.954 -1.021 . . . . 0.0 109.833 178.244 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 32.2 mtp85 -110.1 17.92 20.53 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.678 0.752 . . . . 0.0 110.069 -179.816 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -92.05 109.78 21.14 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.026 -0.988 . . . . 0.0 108.845 173.054 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -45.41 -53.49 8.63 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 -172.772 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.42 -48.59 81.1 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.1 0.476 . . . . 0.0 110.747 -178.56 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 718' ' ' LEU . . . . . 0.579 HD21 ' CD2' ' A' ' 765' ' ' PHE . 0.2 OUTLIER -68.76 -48.35 63.94 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.684 -176.292 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 719' ' ' CYS . . . . . 0.458 ' HB2' HD21 ' A' ' 711' ' ' LEU . 16.3 p -67.29 -46.66 72.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.06 -174.825 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -62.48 -34.56 77.09 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.647 -0.252 . . . . 0.0 110.967 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 721' ' ' PHE . . . . . 0.429 ' HE2' ' HG3' ' A' ' 792' ' ' PRO . 93.7 t80 -65.64 -56.34 12.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.871 0.367 . . . . 0.0 110.366 178.984 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 91.9 mt -61.53 -45.73 92.92 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.237 -177.35 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 723' ' ' GLU . . . . . 0.582 ' HG3' ' N ' ' A' ' 724' ' ' THR . 0.0 OUTLIER -59.78 -42.2 92.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.115 -175.891 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 724' ' ' THR . . . . . 0.582 ' N ' ' HG3' ' A' ' 723' ' ' GLU . 8.6 m -77.43 -41.41 39.95 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.657 0.265 . . . . 0.0 111.499 -177.877 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 25.9 m -65.0 -36.62 85.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.835 0.35 . . . . 0.0 111.297 -178.828 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 726' ' ' LEU . . . . . 0.513 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 50.9 mt -79.31 -42.72 25.1 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.562 -176.654 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 727' ' ' GLN . . . . . 0.438 ' HG3' ' O ' ' A' ' 724' ' ' THR . 3.5 pp0? -62.69 -19.61 64.05 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 120.676 0.274 . . . . 0.0 111.318 -177.897 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 8.5 mtp-105 -57.42 -39.87 77.11 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.082 178.401 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -96.31 6.26 49.17 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.056 -177.268 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 730' ' ' GLY . . . . . 0.455 ' O ' ' HA ' ' A' ' 705' ' ' SER . . . 94.26 7.65 60.6 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.556 -0.83 . . . . 0.0 113.09 176.422 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 731' ' ' ILE . . . . . 0.513 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 36.4 mm -67.23 116.4 6.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 176.096 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 732' ' ' VAL . . . . . 0.755 HG23 ' HA ' ' A' ' 708' ' ' ARG . 3.0 m -79.56 90.97 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 121.587 0.708 . . . . 0.0 111.097 -173.488 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 733' ' ' VAL . . . . . 0.511 HG21 ' HA ' ' A' ' 723' ' ' GLU . 21.8 t -72.4 135.71 27.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.097 178.393 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -143.89 127.4 16.94 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.15 -177.42 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.3 114.07 2.25 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.127 178.576 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 736' ' ' TYR . . . . . 0.404 ' HB3' ' HB2' ' A' ' 712' ' ' ALA . 43.0 t80 -87.25 100.63 12.83 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.107 0.479 . . . . 0.0 110.601 -178.973 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -104.62 -11.42 16.94 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.205 177.168 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 139.92 68.56 0.04 OUTLIER Glycine 0 N--CA 1.448 -0.519 0 N-CA-C 111.211 -0.756 . . . . 0.0 111.211 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 739' ' ' GLN . . . . . 0.458 ' HB3' ' H ' ' A' ' 740' ' ' GLU . 14.7 mp0 -110.0 -138.46 0.37 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.885 0.374 . . . . 0.0 111.376 -174.672 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 740' ' ' GLU . . . . . 0.458 ' H ' ' HB3' ' A' ' 739' ' ' GLN . 2.2 tp10 -108.21 133.84 20.39 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.969 -175.032 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 741' ' ' PRO . . . . . 0.623 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 1.1 Cg_endo -83.39 123.54 3.44 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 123.241 2.627 . . . . 0.0 112.324 177.979 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 742' ' ' THR . . . . . 0.434 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.2 OUTLIER -108.28 132.47 21.07 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.437 176.272 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 743' ' ' PRO . . . . . 0.434 ' HD2' HG22 ' A' ' 742' ' ' THR . 37.5 Cg_endo -66.2 -5.33 12.21 Favored 'Trans proline' 0 N--CA 1.475 0.411 0 C-N-CA 123.151 2.567 . . . . 0.0 113.53 -175.286 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 744' ' ' GLU . . . . . 0.539 ' HB3' ' HE3' ' A' ' 707' ' ' LYS . 5.4 mm-40 -116.38 0.52 12.81 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.837 0.351 . . . . 0.0 110.894 177.622 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 745' ' ' ASP . . . . . 0.447 ' CG ' ' HB2' ' A' ' 708' ' ' ARG . 30.8 m-20 -103.93 165.61 10.93 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.44 -176.328 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 746' ' ' VAL . . . . . 0.672 HG21 HD11 ' A' ' 795' ' ' LEU . 2.6 p -128.35 136.04 61.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.252 0.548 . . . . 0.0 111.603 -174.54 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 747' ' ' LEU . . . . . 0.416 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 0.6 OUTLIER -99.72 104.91 16.67 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.866 176.895 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 24.9 mt -98.96 109.54 24.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 109.157 -0.682 . . . . 0.0 109.157 174.961 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 14.7 t -117.43 158.51 24.36 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.205 -174.683 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 750' ' ' ASP . . . . . 0.722 ' HB3' HG13 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -105.33 136.54 44.69 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.69 174.786 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 60.87 -167.45 0.19 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.882 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 752' ' ' VAL . . . . . . . . . . . . . 3.6 t -82.2 91.0 2.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.301 -175.779 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 753' ' ' VAL . . . . . 0.426 HG13 ' HB2' ' A' ' 755' ' ' LYS . 4.8 p -78.7 -18.06 13.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.405 175.712 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 1.4 m 56.25 56.8 5.47 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.358 -179.102 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 755' ' ' LYS . . . . . 0.426 ' HB2' HG13 ' A' ' 753' ' ' VAL . 0.0 OUTLIER -131.6 152.43 50.82 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 176.031 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 756' ' ' LYS . . . . . 0.428 ' HD3' ' HA ' ' A' ' 756' ' ' LYS . 42.4 mmtt -93.93 -43.36 8.59 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.262 -177.912 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 757' ' ' TRP . . . . . 0.623 ' CH2' ' HA ' ' A' ' 741' ' ' PRO . 71.3 t-105 68.75 96.66 0.06 Allowed 'General case' 0 N--CA 1.464 0.265 0 O-C-N 124.019 0.825 . . . . 0.0 111.709 178.506 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 4.4 tp60 -81.04 63.87 5.57 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.293 0.568 . . . . 0.0 110.501 175.622 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 759' ' ' GLY . . . . . 0.422 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -128.89 -149.77 6.99 Favored Glycine 0 N--CA 1.446 -0.698 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.966 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 2.0 ttt-85 -70.43 -49.36 49.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.782 0.325 . . . . 0.0 110.157 177.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -166.2 153.07 9.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.526 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 762' ' ' VAL . . . . . 0.441 ' HB ' ' HB3' ' A' ' 757' ' ' TRP . 7.7 p -119.03 132.1 69.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 176.626 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 763' ' ' VAL . . . . . 0.565 HG21 HD21 ' A' ' 795' ' ' LEU . 1.4 t -123.02 125.15 71.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 120.832 0.349 . . . . 0.0 110.649 -177.925 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 764' ' ' THR . . . . . 0.947 ' HB ' HG12 ' A' ' 782' ' ' VAL . 86.3 m -111.68 124.33 52.1 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.346 -179.282 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 765' ' ' PHE . . . . . 0.89 ' HE1' HG23 ' A' ' 785' ' ' VAL . 0.7 OUTLIER -95.41 110.32 22.37 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 172.672 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.25 133.1 38.13 Favored 'General case' 0 C--N 1.317 -0.837 0 C-N-CA 120.527 -0.469 . . . . 0.0 109.946 -178.266 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.7 -38.5 3.7 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.296 -179.407 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.67 -35.94 1.44 Allowed 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.288 -179.324 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 58.3 m80 -120.88 140.74 51.38 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.153 0.501 . . . . 0.0 111.212 -175.11 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 3.3 mt -123.97 103.25 12.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.484 179.12 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -121.41 -19.65 3.44 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.18 178.099 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 772' ' ' ILE . . . . . 0.422 ' HA ' ' HD3' ' A' ' 773' ' ' PRO . 18.8 mm -94.56 132.69 28.24 Favored Pre-proline 0 C--N 1.326 -0.416 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 773' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 772' ' ' ILE . 3.9 Cg_exo -80.31 164.86 21.5 Favored 'Trans proline' 0 N--CA 1.459 -0.552 0 C-N-CA 122.967 2.445 . . . . 0.0 112.45 179.848 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 774' ' ' LEU . . . . . 0.487 HD23 ' H ' ' A' ' 774' ' ' LEU . 0.7 OUTLIER -91.95 -157.47 0.52 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.337 179.074 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 775' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -64.76 61.13 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 178.609 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.71 -12.4 17.69 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 169.026 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -136.32 150.1 69.77 Favored Pre-proline 0 N--CA 1.447 -0.585 0 CA-C-N 114.139 -1.391 . . . . 0.0 108.617 176.507 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -61.94 102.65 0.26 Allowed 'Trans proline' 0 C--O 1.233 0.254 0 C-N-CA 122.706 2.271 . . . . 0.0 113.174 -177.034 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 115.34 -4.58 21.74 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.481 -0.866 . . . . 0.0 113.548 174.865 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 780' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.33 122.74 39.53 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 117.217 0.508 . . . . 0.0 109.999 -179.197 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 781' ' ' TRP . . . . . 0.706 ' HZ3' HD13 ' A' ' 794' ' ' LEU . 13.0 m95 -133.78 134.9 43.47 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 -179.178 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 782' ' ' VAL . . . . . 0.947 HG12 ' HB ' ' A' ' 764' ' ' THR . 26.6 m -140.77 152.11 20.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 121.129 0.49 . . . . 0.0 110.735 174.557 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 783' ' ' HIS . . . . . . . . . . . . . 3.1 t-160 -155.67 119.84 4.57 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.276 174.623 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -89.49 100.14 13.0 Favored 'General case' 0 C--N 1.317 -0.833 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.689 -179.701 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 785' ' ' VAL . . . . . 0.89 HG23 ' HE1' ' A' ' 765' ' ' PHE . 0.0 OUTLIER -167.58 -172.46 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.527 179.365 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -114.53 55.24 0.75 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.484 0.183 . . . . 0.0 111.468 -178.042 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 787' ' ' ALA . . . . . 0.542 ' HB2' ' HG ' ' A' ' 718' ' ' LEU . . . 51.52 61.99 11.81 Favored Pre-proline 0 N--CA 1.469 0.491 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.442 177.384 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 788' ' ' PRO . . . . . 0.417 ' HD3' ' N ' ' A' ' 787' ' ' ALA . 1.1 Cg_endo -84.0 46.24 1.96 Allowed 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 123.088 2.525 . . . . 0.0 112.837 -176.745 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 70.07 -15.73 0.32 Allowed 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 113.305 0.854 . . . . 0.0 113.305 174.167 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 790' ' ' GLU . . . . . 0.434 ' H ' ' HG3' ' A' ' 790' ' ' GLU . 0.0 OUTLIER -73.72 -51.76 15.49 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -175.39 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 791' ' ' LEU . . . . . 0.514 ' N ' ' HD2' ' A' ' 792' ' ' PRO . 0.3 OUTLIER -58.91 -50.54 87.46 Favored Pre-proline 0 CA--C 1.534 0.354 0 N-CA-C 112.427 0.528 . . . . 0.0 112.427 -176.959 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 792' ' ' PRO . . . . . 0.514 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 10.8 Cg_endo -55.8 -33.45 88.19 Favored 'Trans proline' 0 C--N 1.357 0.987 0 C-N-CA 121.971 1.781 . . . . 0.0 112.258 177.283 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -66.4 -50.39 63.6 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 120.938 0.399 . . . . 0.0 110.723 178.677 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 794' ' ' LEU . . . . . 0.706 HD13 ' HZ3' ' A' ' 781' ' ' TRP . 1.0 OUTLIER -64.41 -33.8 76.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.926 179.683 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 795' ' ' LEU . . . . . 0.672 HD11 HG21 ' A' ' 746' ' ' VAL . 0.7 OUTLIER -67.25 -43.8 81.01 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.995 -179.092 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -60.25 -37.14 79.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.074 0.464 . . . . 0.0 110.621 178.25 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 797' ' ' ARG . . . . . 0.462 ' HD2' HD23 ' A' ' 794' ' ' LEU . 0.0 OUTLIER -71.91 -48.78 43.12 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.225 179.124 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 798' ' ' ILE . . . . . 0.421 HG22 ' O ' ' A' ' 795' ' ' LEU . 0.6 OUTLIER -62.86 -18.02 20.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -176.979 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -63.22 -39.37 94.43 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 175.872 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 800' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 797' ' ' ARG . 6.1 mt . . . . . 0 N--CA 1.467 0.392 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.232 177.739 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 15.1 t70 . . . . . 0 N--CA 1.466 0.34 0 CA-C-O 120.883 0.373 . . . . 0.0 111.491 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 4.0 ttm -137.7 135.4 36.41 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 -178.176 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 826' ' ' MET . . . . . 0.559 ' HA ' ' HB2' ' A' ' 850' ' ' GLN . 21.2 ptp -108.43 129.09 55.27 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.663 0.744 . . . . 0.0 111.613 -177.122 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 827' ' ' ILE . . . . . . . . . . . . . 10.0 mm -109.82 144.17 18.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-N 114.864 -1.062 . . . . 0.0 108.836 175.405 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 828' ' ' LEU . . . . . 0.614 ' HB2' HG12 ' A' ' 869' ' ' ILE . 16.1 tp -103.23 122.24 44.35 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.664 0.268 . . . . 0.0 110.282 -177.861 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 829' ' ' VAL . . . . . 0.503 ' HA ' ' HG ' ' A' ' 873' ' ' LEU . 1.2 p -114.73 104.33 16.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.372 0.606 . . . . 0.0 110.1 -179.222 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 830' ' ' VAL . . . . . 0.796 HG22 ' HB3' ' A' ' 854' ' ' ALA . 60.6 t -119.09 119.87 62.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.172 -179.703 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 831' ' ' ASP . . . . . 1.014 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 0.9 OUTLIER -130.06 153.8 48.09 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 176.86 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.75 -13.96 59.07 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -172.365 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 7.8 m80 -131.68 95.83 22.24 Favored Pre-proline 0 C--N 1.327 -0.371 0 O-C-N 121.798 -0.564 . . . . 0.0 111.451 -178.53 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_exo -27.03 -46.52 0.08 OUTLIER 'Trans proline' 0 C--N 1.353 0.811 1 C-N-CA 125.835 4.357 . . . . 0.0 116.618 -171.756 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 1.2 pp -57.18 -44.0 82.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -176.677 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 836' ' ' ASN . . . . . 0.504 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 1.5 t30 -73.09 -46.75 49.57 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -178.322 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 837' ' ' ARG . . . . . 1.014 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 0.4 OUTLIER -51.9 -39.85 59.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.862 178.451 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 838' ' ' ARG . . . . . 0.403 ' HD3' ' O ' ' A' ' 838' ' ' ARG . 0.0 OUTLIER -64.51 -47.08 80.22 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.489 177.751 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.62 -42.48 95.47 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.106 -0.497 . . . . 0.0 112.011 -173.831 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 840' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 836' ' ' ASN . 0.0 OUTLIER -70.88 -26.79 63.39 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.211 177.14 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -66.81 -33.57 75.91 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.156 0.503 . . . . 0.0 109.818 175.257 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -64.49 -41.72 96.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.974 174.415 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 843' ' ' GLN . . . . . 0.645 ' HG2' HG21 ' A' ' 932' ' ' ILE . 0.3 OUTLIER -62.01 -41.61 98.26 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.491 176.069 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 844' ' ' LEU . . . . . 0.74 HD13 ' HB3' ' A' ' 851' ' ' CYS . 0.5 OUTLIER -61.66 -33.19 73.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.595 176.067 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -65.39 -34.19 88.64 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.94 -0.648 . . . . 0.0 111.707 175.789 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 9.3 m -68.91 -28.23 66.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.91 0.386 . . . . 0.0 110.606 176.992 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.65 -22.45 63.45 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.27 176.013 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 84.84 24.06 47.03 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 121.088 -0.577 . . . . 0.0 113.446 173.685 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -114.77 -177.93 3.25 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.718 0.294 . . . . 0.0 110.454 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 850' ' ' GLN . . . . . 0.559 ' HB2' ' HA ' ' A' ' 826' ' ' MET . 4.2 mm100 -85.76 141.38 29.74 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 177.011 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 851' ' ' CYS . . . . . 0.74 ' HB3' HD13 ' A' ' 844' ' ' LEU . 0.0 OUTLIER -132.09 116.59 17.23 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 120.797 0.332 . . . . 0.0 110.892 -177.682 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -93.74 109.6 21.26 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 176.956 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 853' ' ' THR . . . . . 0.443 ' HA ' HG13 ' A' ' 829' ' ' VAL . 0.0 OUTLIER -91.8 116.6 29.03 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.689 -174.065 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 854' ' ' ALA . . . . . 0.796 ' HB3' HG22 ' A' ' 830' ' ' VAL . . . -136.18 161.09 36.71 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.752 178.691 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -142.04 73.95 1.43 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.975 177.926 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 856' ' ' ASP . . . . . 0.769 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 31.7 t70 176.55 150.17 0.14 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.784 -178.474 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -77.4 -42.69 17.72 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.514 -178.103 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -71.71 -34.67 52.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.739 0.304 . . . . 0.0 110.348 -178.698 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 859' ' ' ASP . . . . . 0.769 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 0.1 OUTLIER -57.03 -38.85 73.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.642 177.306 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 860' ' ' ALA . . . . . 0.474 ' O ' HG12 ' A' ' 863' ' ' VAL . . . -66.57 -40.79 89.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.833 179.228 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 861' ' ' LEU . . . . . 0.467 HD22 ' HA ' ' A' ' 861' ' ' LEU . 0.2 OUTLIER -66.33 -33.25 75.3 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.095 0.474 . . . . 0.0 110.439 178.358 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -67.42 -42.55 83.03 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.884 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 863' ' ' VAL . . . . . 0.479 HG11 HD13 ' A' ' 828' ' ' LEU . 1.6 p -70.72 -32.02 47.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.715 0.293 . . . . 0.0 110.462 178.334 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 864' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -61.53 -39.68 91.93 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 121.15 0.5 . . . . 0.0 109.954 174.746 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 6.0 m -78.0 -16.97 57.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.935 178.888 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 2.8 tttp -76.26 -60.63 2.25 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.423 178.178 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -121.69 -90.17 0.58 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.147 177.876 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 23.7 p80 -179.1 -39.56 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 122.168 0.187 . . . . 0.0 110.869 176.291 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 869' ' ' ILE . . . . . 0.614 HG12 ' HB2' ' A' ' 828' ' ' LEU . 0.3 OUTLIER 69.38 149.58 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 O-C-N 123.392 0.432 . . . . 0.0 110.273 -175.6 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -92.41 -39.89 11.18 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.518 -0.473 . . . . 0.0 111.414 -177.073 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 871' ' ' ILE . . . . . . . . . . . . . 1.4 mt -138.64 133.9 42.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 177.901 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 872' ' ' VAL . . . . . 0.575 HG13 HD23 ' A' ' 828' ' ' LEU . 72.4 t -107.89 112.29 39.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.661 -179.363 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 873' ' ' LEU . . . . . 0.503 ' HG ' ' HA ' ' A' ' 829' ' ' VAL . 1.4 pp -108.72 127.92 54.41 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.115 0.484 . . . . 0.0 110.028 176.315 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -123.26 114.69 20.58 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.668 -177.707 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 875' ' ' ASP . . . . . 0.812 ' HB3' ' HB2' ' A' ' 831' ' ' ASP . 34.0 t0 -102.5 136.32 42.54 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 178.468 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 876' ' ' VAL . . . . . 0.452 HG23 HG23 ' A' ' 903' ' ' THR . 0.0 OUTLIER -141.09 129.19 22.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-O 121.296 0.569 . . . . 0.0 111.402 -177.053 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -80.21 -39.06 29.88 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 171.09 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.536 0 CA-C-N 114.519 -1.219 . . . . 0.0 109.001 175.21 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.341 0 CA-C-O 120.306 -0.163 . . . . 0.0 113.094 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -123.25 -43.25 2.21 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.101 0.477 . . . . 0.0 110.346 -178.03 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -60.92 -36.4 79.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.809 -177.788 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.26 -42.96 99.23 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.462 -179.552 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.2 -44.34 76.03 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.047 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 888' ' ' GLN . . . . . 0.445 ' OE1' ' HD3' ' A' ' 891' ' ' ARG . 3.3 tp-100 -60.49 -43.04 97.41 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.6 178.958 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -70.62 -33.08 70.63 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.148 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 890' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -60.81 -48.35 89.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.707 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 891' ' ' ARG . . . . . 0.468 HH21 ' HG3' ' A' ' 892' ' ' GLN . 0.0 OUTLIER -74.49 -23.17 58.82 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.814 0.34 . . . . 0.0 110.6 179.606 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 892' ' ' GLN . . . . . 0.468 ' HG3' HH21 ' A' ' 891' ' ' ARG . 5.3 mt-30 -70.92 -43.36 68.41 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.896 178.454 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.06 -55.04 18.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.87 -178.421 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 163.06 60.96 0.02 OUTLIER Glycine 0 N--CA 1.453 -0.208 0 C-N-CA 120.34 -0.933 . . . . 0.0 112.432 -179.716 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 895' ' ' LEU . . . . . 0.439 ' HB3' ' HA ' ' A' ' 891' ' ' ARG . 0.4 OUTLIER -68.15 111.15 4.33 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.971 0.415 . . . . 0.0 110.894 -179.509 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -128.42 7.84 5.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.442 174.143 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 897' ' ' LEU . . . . . 0.553 HD12 HG23 ' A' ' 872' ' ' VAL . 0.1 OUTLIER -125.31 138.98 32.74 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.032 -177.163 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.32 144.88 46.98 Favored 'Trans proline' 0 C--O 1.238 0.486 0 C-N-CA 122.571 2.181 . . . . 0.0 112.572 -178.107 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 899' ' ' VAL . . . . . 0.792 HG13 ' HA ' ' A' ' 919' ' ' MET . 0.2 OUTLIER -121.07 137.75 53.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 121.534 0.683 . . . . 0.0 110.331 179.443 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 900' ' ' ILE . . . . . 0.743 HG23 ' HB2' ' A' ' 921' ' ' SER . 6.3 mt -108.47 112.11 38.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.03 -179.85 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 901' ' ' GLY . . . . . 0.459 ' O ' ' HA ' ' A' ' 922' ' ' CYS . . . -97.93 110.04 3.94 Favored Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 121.053 -0.594 . . . . 0.0 112.009 -179.027 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 902' ' ' VAL . . . . . 0.579 ' HB ' ' HB2' ' A' ' 923' ' ' LEU . 0.2 OUTLIER -105.06 126.19 60.04 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 178.83 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 903' ' ' THR . . . . . 0.452 HG23 HG23 ' A' ' 876' ' ' VAL . 0.2 OUTLIER -135.2 153.77 51.83 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.056 0.455 . . . . 0.0 111.611 -174.665 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 904' ' ' ALA . . . . . 0.42 ' HB2' ' HD3' ' A' ' 925' ' ' LYS . . . -90.78 104.02 16.65 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.722 174.89 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 16.4 t30 43.73 61.46 2.27 Favored 'General case' 0 N--CA 1.468 0.427 0 O-C-N 124.034 0.834 . . . . 0.0 111.553 -178.326 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 906' ' ' ALA . . . . . 0.579 ' HB1' ' HB2' ' A' ' 909' ' ' GLU . . . -55.29 -64.82 0.72 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.843 -178.279 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 3.6 mp 56.24 35.19 25.34 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.848 178.475 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -175.7 -45.36 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.096 -175.822 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 909' ' ' GLU . . . . . 0.579 ' HB2' ' HB1' ' A' ' 906' ' ' ALA . 0.0 OUTLIER -69.99 -20.23 63.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.327 -175.618 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 910' ' ' GLU . . . . . 0.428 ' HG2' ' H ' ' A' ' 911' ' ' LYS . 3.5 pm0 -62.29 -40.82 97.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.245 0.545 . . . . 0.0 109.682 172.911 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 911' ' ' LYS . . . . . 0.428 ' H ' ' HG2' ' A' ' 910' ' ' GLU . 0.7 OUTLIER -67.84 -35.94 79.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.99 178.286 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 912' ' ' GLN . . . . . 0.463 ' O ' ' HG3' ' A' ' 916' ' ' GLU . 0.0 OUTLIER -63.32 -44.19 95.64 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.225 176.125 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 913' ' ' ARG . . . . . 0.58 ' HD3' ' HB3' ' A' ' 919' ' ' MET . 0.0 OUTLIER -63.7 -28.07 69.64 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.912 179.562 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 63.8 m -74.42 -28.11 60.92 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.96 0.41 . . . . 0.0 110.064 176.451 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.43 -49.98 50.02 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.049 179.217 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 916' ' ' GLU . . . . . 0.514 ' HG3' ' H ' ' A' ' 916' ' ' GLU . 0.0 OUTLIER -77.26 -38.42 51.02 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.984 -178.574 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.74 36.72 18.45 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 121.286 0.565 . . . . 0.0 111.18 -175.939 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -125.09 -14.06 3.44 Favored Glycine 0 N--CA 1.446 -0.646 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.691 179.789 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 919' ' ' MET . . . . . 0.792 ' HA ' HG13 ' A' ' 899' ' ' VAL . 2.7 ttm -63.79 -108.24 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.542 0.337 . . . . 0.0 110.575 175.617 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 920' ' ' ASP . . . . . 0.718 ' HB2' ' O ' ' A' ' 919' ' ' MET . 0.6 OUTLIER 153.0 -81.12 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.563 1.145 . . . . 0.0 110.097 174.355 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 921' ' ' SER . . . . . 0.743 ' HB2' HG23 ' A' ' 900' ' ' ILE . 0.0 OUTLIER -98.61 149.38 22.83 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.133 -174.188 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 922' ' ' CYS . . . . . 0.459 ' HA ' ' O ' ' A' ' 901' ' ' GLY . 10.2 m -130.82 119.46 22.28 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.045 0.45 . . . . 0.0 109.838 176.67 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 923' ' ' LEU . . . . . 0.579 ' HB2' ' HB ' ' A' ' 902' ' ' VAL . 68.3 mt -120.17 167.11 12.57 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.939 -174.759 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -89.29 147.06 24.32 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.143 175.875 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 925' ' ' LYS . . . . . 0.528 ' HB3' ' HD3' ' A' ' 926' ' ' PRO . 10.0 tttp -57.56 -49.05 95.99 Favored Pre-proline 0 CA--C 1.539 0.55 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 179.73 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 926' ' ' PRO . . . . . 0.528 ' HD3' ' HB3' ' A' ' 925' ' ' LYS . 11.5 Cg_exo -72.24 66.16 3.51 Favored 'Trans proline' 0 C--N 1.357 0.985 0 C-N-CA 122.245 1.963 . . . . 0.0 112.708 177.756 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 1.1 t -99.28 136.47 30.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.262 178.314 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -94.57 171.84 8.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.307 -178.179 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 929' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.43 -45.93 73.12 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 -177.105 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.8 -48.48 81.61 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.914 0.387 . . . . 0.0 110.287 -175.652 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 43.7 t -62.08 -52.39 60.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.42 179.009 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 932' ' ' ILE . . . . . 0.645 HG21 ' HG2' ' A' ' 843' ' ' GLN . 0.0 OUTLIER -63.13 -39.09 83.89 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 CA-C-O 120.647 0.261 . . . . 0.0 111.284 -175.412 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 933' ' ' LYS . . . . . 0.447 ' HE2' ' HB3' ' A' ' 933' ' ' LYS . 0.0 OUTLIER -67.26 -47.68 70.0 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-O 120.875 0.369 . . . . 0.0 110.305 -179.327 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 934' ' ' GLN . . . . . 0.604 ' O ' ' HB2' ' A' ' 938' ' ' LEU . 0.0 OUTLIER -65.62 -35.82 81.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.107 -178.455 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 935' ' ' THR . . . . . 0.502 ' N ' ' HG2' ' A' ' 934' ' ' GLN . 19.2 m -72.97 -43.86 61.75 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.621 0.248 . . . . 0.0 111.187 -179.486 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 936' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.19 -45.02 90.2 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.572 -0.285 . . . . 0.0 110.343 178.862 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 26.6 m -64.37 -40.75 96.45 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.829 178.049 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 938' ' ' LEU . . . . . 0.645 ' O ' ' HG2' ' A' ' 941' ' ' GLU . 1.4 tp -62.68 -42.38 99.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.063 179.155 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 939' ' ' TYR . . . . . 0.448 ' O ' HG13 ' A' ' 943' ' ' VAL . 2.3 m-85 -75.86 -27.09 57.66 Favored 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.974 -179.321 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -65.53 -32.65 74.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.172 0.511 . . . . 0.0 109.953 172.605 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 941' ' ' GLU . . . . . 0.645 ' HG2' ' O ' ' A' ' 938' ' ' LEU . 2.1 pt-20 -74.6 -31.46 62.03 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.161 175.621 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 942' ' ' ARG . . . . . 0.608 ' HG2' ' O ' ' A' ' 938' ' ' LEU . 4.6 mmt85 -65.34 -47.42 76.54 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-O 120.94 0.4 . . . . 0.0 110.278 177.966 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 943' ' ' VAL . . . . . 0.448 HG13 ' O ' ' A' ' 939' ' ' TYR . 5.1 m -69.01 -30.58 47.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.649 179.186 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.63 -41.76 83.38 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.422 177.042 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 2.0 pttt -74.36 -25.85 59.77 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.575 0.226 . . . . 0.0 110.906 -179.741 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 15.2 m -76.21 -34.93 59.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.225 0.536 . . . . 0.0 109.741 175.178 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -72.9 -22.92 60.67 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.315 176.93 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.267 177.751 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.064 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 80.69 -67.51 3.53 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.901 -0.666 . . . . 0.0 111.928 -178.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . 139.22 104.35 0.61 Allowed Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 121.045 -0.597 . . . . 0.0 112.015 -179.613 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.28 91.69 1.34 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.154 0.502 . . . . 0.0 111.096 -178.526 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . -127.08 119.27 3.23 Favored Glycine 0 N--CA 1.445 -0.735 0 C-N-CA 120.932 -0.652 . . . . 0.0 111.853 179.38 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 701' ' ' VAL . . . . . 0.509 ' HA ' ' OD1' ' A' ' 855' ' ' ASN . 1.5 m -115.32 145.12 21.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 120.935 0.397 . . . . 0.0 110.632 177.928 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -128.3 -87.01 0.56 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.055 178.416 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . 71.93 -116.54 6.02 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.132 179.703 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.551 HD22 HG12 ' A' ' 801' ' ' ILE . 0.4 OUTLIER -93.82 -30.94 14.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.889 0.376 . . . . 0.0 110.259 178.438 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.85 100.94 0.17 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.403 174.36 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 127.97 -6.72 6.87 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.971 -0.633 . . . . 0.0 111.751 -176.018 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 707' ' ' LYS . . . . . 0.412 ' HA ' ' HD2' ' A' ' 707' ' ' LYS . 2.9 mmmt -66.7 134.78 52.94 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 175.483 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 708' ' ' ARG . . . . . . . . . . . . . 10.5 mtt180 -102.7 146.25 28.49 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 121.473 0.654 . . . . 0.0 111.953 -171.291 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 709' ' ' CYS . . . . . 0.428 ' O ' ' HA ' ' A' ' 733' ' ' VAL . 61.8 m -134.86 119.73 18.46 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.986 -1.007 . . . . 0.0 109.019 174.146 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 710' ' ' TRP . . . . . 0.498 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 81.5 m95 -92.14 134.94 34.39 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 -177.288 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 711' ' ' LEU . . . . . 0.543 HD22 HG12 ' A' ' 733' ' ' VAL . 0.1 OUTLIER -126.16 125.55 42.67 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.611 0.72 . . . . 0.0 111.11 -177.958 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -120.9 65.59 0.86 Allowed 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.181 -0.918 . . . . 0.0 108.86 176.086 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 713' ' ' VAL . . . . . 0.829 HG13 ' HB3' ' A' ' 750' ' ' ASP . 21.1 t -114.76 113.54 43.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.348 -177.514 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 41.8 mtm180 -77.13 -23.61 51.71 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.186 0.517 . . . . 0.0 109.622 179.146 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -72.83 97.42 2.24 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.481 175.045 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -61.94 -31.52 71.85 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.897 -174.436 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.32 -48.25 78.83 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.136 0.493 . . . . 0.0 110.275 179.153 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 718' ' ' LEU . . . . . 0.502 HD12 ' HA ' ' A' ' 786' ' ' ALA . 1.4 tt -72.49 -42.53 64.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.496 178.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 719' ' ' CYS . . . . . 0.725 ' HB2' ' HB ' ' A' ' 713' ' ' VAL . 0.0 OUTLIER -58.93 -52.18 66.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.804 -177.852 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 720' ' ' GLN . . . . . 0.651 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 22.5 tt0 -62.23 -42.36 99.24 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.979 -179.124 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -59.39 -53.06 62.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.038 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 722' ' ' LEU . . . . . 0.432 ' HA ' HD22 ' A' ' 722' ' ' LEU . 0.3 OUTLIER -64.98 -44.76 88.23 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.253 -177.936 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 723' ' ' GLU . . . . . 0.651 ' HG2' ' HA ' ' A' ' 720' ' ' GLN . 2.0 pt-20 -64.55 -40.12 94.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.644 -174.535 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 724' ' ' THR . . . . . 0.526 ' N ' ' HG3' ' A' ' 723' ' ' GLU . 9.2 m -70.04 -38.61 75.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.853 0.358 . . . . 0.0 110.96 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 20.3 m -64.39 -38.28 90.47 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.507 -178.205 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 726' ' ' LEU . . . . . . . . . . . . . 5.4 mt -74.58 -36.34 63.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.055 0.455 . . . . 0.0 110.97 -178.835 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 727' ' ' GLN . . . . . 0.578 ' HG3' HG23 ' A' ' 733' ' ' VAL . 34.0 mt-30 -75.66 6.91 4.24 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.65 -178.503 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 8.3 mtm-85 -76.7 -16.51 59.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.881 0.372 . . . . 0.0 111.077 179.491 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 14.5 m -107.72 -99.68 0.36 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.759 177.613 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 730' ' ' GLY . . . . . . . . . . . . . . . -144.88 31.88 1.73 Allowed Glycine 0 N--CA 1.448 -0.514 0 N-CA-C 110.933 -0.867 . . . . 0.0 110.933 179.137 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 731' ' ' ILE . . . . . . . . . . . . . 26.6 mm -100.24 132.64 45.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.303 -0.448 . . . . 0.0 110.045 -176.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 732' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -100.72 105.4 17.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.094 0.473 . . . . 0.0 110.536 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 733' ' ' VAL . . . . . 0.578 HG23 ' HG3' ' A' ' 727' ' ' GLN . 4.5 t -84.08 126.9 40.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.624 177.121 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 734' ' ' THR . . . . . 0.434 ' HB ' ' CE3' ' A' ' 710' ' ' TRP . 0.2 OUTLIER -124.36 140.14 53.23 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.921 0.391 . . . . 0.0 111.131 -175.77 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 1.4 m -65.79 115.52 6.01 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.977 178.587 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 736' ' ' TYR . . . . . 0.498 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 70.3 t80 -89.57 114.08 25.59 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.474 -179.157 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -117.98 -49.77 2.5 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.475 178.169 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -157.32 38.86 0.55 Allowed Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.965 -0.636 . . . . 0.0 111.563 -179.424 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 15.5 mp0 -86.2 175.68 8.37 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.475 -0.362 . . . . 0.0 110.775 -177.022 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 740' ' ' GLU . . . . . 0.441 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 11.5 mt-10 -95.12 147.78 33.59 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.683 -178.526 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 741' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 740' ' ' GLU . 3.1 Cg_endo -84.77 122.45 2.66 Favored 'Trans proline' 0 N--CA 1.455 -0.774 0 C-N-CA 122.803 2.335 . . . . 0.0 112.471 -179.076 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 742' ' ' THR . . . . . 0.553 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.3 OUTLIER -103.32 138.11 19.45 Favored Pre-proline 0 C--N 1.322 -0.615 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.269 177.344 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 743' ' ' PRO . . . . . 0.553 ' HD2' HG22 ' A' ' 742' ' ' THR . 36.4 Cg_endo -66.02 -0.98 4.55 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.954 2.436 . . . . 0.0 113.131 -178.706 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -108.31 -6.51 16.26 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.088 0.47 . . . . 0.0 110.261 178.057 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 87.6 m-20 -108.49 157.66 18.25 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.596 -170.679 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 746' ' ' VAL . . . . . 0.512 HG11 HD11 ' A' ' 795' ' ' LEU . 1.3 p -123.71 137.35 57.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.484 -179.254 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 747' ' ' LEU . . . . . 0.484 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 0.6 OUTLIER -106.72 111.55 24.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.513 -179.43 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 2.9 mt -100.78 110.72 28.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 176.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 749' ' ' THR . . . . . 0.512 HG21 ' HB ' ' A' ' 753' ' ' VAL . 4.9 t -118.76 166.61 12.57 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.709 0.29 . . . . 0.0 111.012 -176.626 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 750' ' ' ASP . . . . . 0.829 ' HB3' HG13 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -111.74 136.89 50.39 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.589 177.663 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 751' ' ' GLU . . . . . 0.668 ' HG3' ' H ' ' A' ' 752' ' ' VAL . 3.0 tp10 66.51 174.74 0.24 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.917 -1.038 . . . . 0.0 111.433 -178.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 752' ' ' VAL . . . . . 0.668 ' H ' ' HG3' ' A' ' 751' ' ' GLU . 2.9 p -56.96 120.89 3.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 121.477 0.656 . . . . 0.0 111.233 -179.63 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 753' ' ' VAL . . . . . 0.512 ' HB ' HG21 ' A' ' 749' ' ' THR . 2.7 p -99.34 158.74 3.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.336 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -113.17 25.96 10.89 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.141 0.496 . . . . 0.0 110.5 -178.516 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 755' ' ' LYS . . . . . 0.403 ' H ' HG13 ' A' ' 753' ' ' VAL . 0.0 OUTLIER -120.67 169.29 10.52 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.1 -179.448 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -108.84 -39.69 5.26 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.723 -178.278 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 757' ' ' TRP . . . . . 0.484 ' CD2' ' HB2' ' A' ' 747' ' ' LEU . 76.6 t-105 61.9 85.09 0.13 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.51 0.672 . . . . 0.0 111.233 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 25.7 mm100 -78.01 67.4 3.85 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.1 176.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 759' ' ' GLY . . . . . 0.478 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -129.46 -147.12 6.23 Favored Glycine 0 N--CA 1.444 -0.801 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.291 -177.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.38 -47.22 20.4 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.717 0.294 . . . . 0.0 110.802 -179.352 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 761' ' ' ALA . . . . . 0.45 ' O ' ' HA ' ' A' ' 746' ' ' VAL . . . -166.75 158.56 13.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.689 -179.064 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 762' ' ' VAL . . . . . 0.817 HG13 ' HG2' ' A' ' 780' ' ' GLU . 1.5 p -131.69 137.37 55.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.53 175.258 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 77.7 t -115.96 121.82 68.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.04 -179.217 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 764' ' ' THR . . . . . 0.664 ' HB ' HG12 ' A' ' 782' ' ' VAL . 5.7 m -110.92 98.78 7.81 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.242 0.544 . . . . 0.0 111.468 -178.175 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 765' ' ' PHE . . . . . 0.417 ' CD1' HD11 ' A' ' 718' ' ' LEU . 20.6 m-85 -76.83 119.73 21.0 Favored 'General case' 0 C--O 1.221 -0.398 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 174.004 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -94.13 133.82 37.21 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 120.355 -0.538 . . . . 0.0 110.879 -174.103 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 767' ' ' ARG . . . . . 0.577 ' NE ' ' HA ' ' A' ' 767' ' ' ARG . 0.1 OUTLIER -110.08 -36.43 5.85 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.711 -179.374 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.37 -58.13 0.26 Allowed 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.76 0.281 . . . . 0.0 111.76 177.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 34.1 m170 -114.1 146.32 40.43 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 121.752 0.787 . . . . 0.0 112.514 -172.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 770' ' ' ILE . . . . . 0.69 HG22 ' H ' ' A' ' 771' ' ' GLY . 0.6 OUTLIER -110.37 -179.47 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.688 0 CA-C-N 114.448 -1.251 . . . . 0.0 109.644 -179.123 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 771' ' ' GLY . . . . . 0.69 ' H ' HG22 ' A' ' 770' ' ' ILE . . . 170.29 -33.56 0.16 Allowed Glycine 0 N--CA 1.451 -0.346 0 N-CA-C 110.668 -0.973 . . . . 0.0 110.668 -178.252 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 772' ' ' ILE . . . . . 1.051 HG13 ' HD2' ' A' ' 773' ' ' PRO . 1.2 tp -80.64 148.4 65.56 Favored Pre-proline 0 C--N 1.32 -0.685 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 171.503 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 773' ' ' PRO . . . . . 1.051 ' HD2' HG13 ' A' ' 772' ' ' ILE . 33.4 Cg_endo -65.45 -108.33 0.0 OUTLIER 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 122.652 2.235 . . . . 0.0 113.829 -179.433 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 774' ' ' LEU . . . . . 0.537 ' HG ' ' H ' ' A' ' 776' ' ' LYS . 1.0 OUTLIER 174.36 -154.75 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 -177.365 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 775' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -60.3 -0.01 0.21 Allowed 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 776' ' ' LYS . . . . . 0.537 ' H ' ' HG ' ' A' ' 774' ' ' LEU . 0.0 OUTLIER -75.01 -11.51 60.12 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 121.334 0.588 . . . . 0.0 109.829 171.487 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 777' ' ' ALA . . . . . 0.452 ' HB1' ' HD2' ' A' ' 778' ' ' PRO . . . -102.91 158.76 31.13 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.597 176.876 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 778' ' ' PRO . . . . . 0.452 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 54.7 Cg_endo -70.35 63.09 2.13 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.974 2.449 . . . . 0.0 113.445 -177.631 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 116.09 49.24 0.46 Allowed Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.807 176.522 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 780' ' ' GLU . . . . . 0.817 ' HG2' HG13 ' A' ' 762' ' ' VAL . 0.7 OUTLIER -130.78 140.06 50.26 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 177.165 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 45.5 m95 -141.47 112.64 7.41 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 110.487 -0.19 . . . . 0.0 110.487 -178.303 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 782' ' ' VAL . . . . . 0.664 HG12 ' HB ' ' A' ' 764' ' ' THR . 31.2 m -106.67 143.84 16.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-O 121.151 0.501 . . . . 0.0 111.063 179.138 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 783' ' ' HIS . . . . . . . . . . . . . 7.5 t-160 -165.47 121.38 1.36 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.189 174.336 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.45 100.74 9.46 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.106 176.735 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 785' ' ' VAL . . . . . 0.424 ' HB ' ' HD3' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -154.94 176.54 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.0 -0.545 . . . . 0.0 109.69 179.941 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 786' ' ' ALA . . . . . 0.502 ' HA ' HD12 ' A' ' 718' ' ' LEU . . . -115.87 39.92 2.92 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.515 178.518 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 787' ' ' ALA . . . . . 0.414 ' HB2' ' HG ' ' A' ' 718' ' ' LEU . . . 62.91 69.99 0.8 Allowed Pre-proline 0 CA--C 1.529 0.156 0 CA-C-N 115.795 -0.638 . . . . 0.0 111.595 178.841 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 788' ' ' PRO . . . . . 0.678 ' HD2' ' OE1' ' A' ' 790' ' ' GLU . 12.1 Cg_exo -70.18 -66.54 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.772 2.315 . . . . 0.0 111.529 175.608 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 789' ' ' HIS . . . . . 0.438 ' CE1' ' HA ' ' A' ' 808' ' ' PRO . 1.8 p80 177.08 -3.96 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.214 178.653 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 790' ' ' GLU . . . . . 0.678 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -84.38 -48.68 9.42 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.803 0.297 . . . . 0.0 111.803 -172.065 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 791' ' ' LEU . . . . . 0.568 ' N ' ' HD2' ' A' ' 792' ' ' PRO . 1.1 mt -70.43 -42.84 16.02 Favored Pre-proline 0 C--N 1.326 -0.438 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -177.187 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 792' ' ' PRO . . . . . 0.568 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 8.8 Cg_endo -54.23 -36.85 87.38 Favored 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 121.653 1.569 . . . . 0.0 111.713 170.83 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -69.84 -37.21 76.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.612 177.507 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -61.59 -39.02 89.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.104 176.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 795' ' ' LEU . . . . . 0.512 HD11 HG11 ' A' ' 746' ' ' VAL . 0.2 OUTLIER -63.23 -43.76 97.15 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.995 0.426 . . . . 0.0 110.658 178.531 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -66.63 -30.96 71.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.628 178.343 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.3 -44.24 65.55 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.753 178.384 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -65.55 -31.11 52.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.968 -179.078 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 799' ' ' TYR . . . . . 0.414 ' HD1' ' HA ' ' A' ' 799' ' ' TYR . 0.2 OUTLIER -83.7 -27.6 28.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.418 177.189 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 69.59 45.29 0.81 Allowed 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.169 179.454 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 801' ' ' ILE . . . . . 0.551 HG12 HD22 ' A' ' 704' ' ' LEU . 0.5 OUTLIER -85.37 -54.31 8.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 174.552 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 50.91 47.41 24.78 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 114.877 -1.056 . . . . 0.0 111.732 177.208 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 803' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.01 -30.68 17.61 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.078 0.466 . . . . 0.0 110.536 179.011 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 804' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -101.35 116.61 33.19 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.189 179.114 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.05 76.51 9.79 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.012 0.434 . . . . 0.0 110.409 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -79.47 -28.58 41.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.048 -177.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 26.2 t0 61.74 78.57 0.3 Allowed Pre-proline 0 N--CA 1.465 0.276 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.733 -172.619 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 808' ' ' PRO . . . . . 0.438 ' HA ' ' CE1' ' A' ' 789' ' ' HIS . 22.1 Cg_exo -64.78 -43.07 13.39 Favored 'Trans proline' 0 C--O 1.233 0.25 0 C-N-CA 122.915 2.41 . . . . 0.0 113.053 -175.298 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . 51.47 -120.07 1.56 Allowed 'General case' 0 CA--C 1.529 0.158 0 O-C-N 123.435 0.459 . . . . 0.0 110.313 -173.817 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 36.5 t-20 -167.83 135.53 2.3 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 174.535 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -78.3 -32.59 49.47 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.926 -178.422 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 812' ' ' LEU . . . . . 0.493 ' HA ' ' HD3' ' A' ' 813' ' ' PRO . 0.2 OUTLIER -160.28 135.57 5.78 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.292 -179.309 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 813' ' ' PRO . . . . . 0.493 ' HD3' ' HA ' ' A' ' 812' ' ' LEU . 6.4 Cg_exo -73.47 70.48 4.03 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 123.075 2.517 . . . . 0.0 111.52 177.791 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.32 -51.27 70.51 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.726 -175.654 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -140.5 138.6 34.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.86 -179.487 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -74.89 112.72 11.4 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 177.128 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -98.33 121.26 40.04 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.958 0.409 . . . . 0.0 110.797 -177.758 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -78.61 123.03 26.68 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.24 176.369 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 21.2 t -96.86 94.49 4.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 121.262 0.553 . . . . 0.0 110.787 -178.184 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -109.55 103.89 12.84 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.459 177.436 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -120.75 134.78 55.27 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.903 0.382 . . . . 0.0 110.397 -179.56 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -166.61 -42.38 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.127 177.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -88.45 70.04 8.99 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.223 176.581 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -132.07 74.86 1.61 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.721 -176.476 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 825' ' ' MET . . . . . 0.411 ' HG2' HD11 ' A' ' 827' ' ' ILE . 3.2 ttm -96.23 108.14 20.57 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.594 175.504 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 826' ' ' MET . . . . . 0.598 ' HG2' HG13 ' A' ' 869' ' ' ILE . 2.3 tpp -100.16 118.27 36.15 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.794 -178.509 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 827' ' ' ILE . . . . . 0.579 HG23 ' HB ' ' A' ' 871' ' ' ILE . 4.8 mm -108.58 128.79 63.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.657 178.129 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 828' ' ' LEU . . . . . 0.572 ' HB2' HG12 ' A' ' 869' ' ' ILE . 0.5 OUTLIER -105.41 128.76 53.69 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.424 -177.892 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 829' ' ' VAL . . . . . 0.63 ' HB ' HD12 ' A' ' 873' ' ' LEU . 1.2 p -114.77 114.87 47.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 121.084 0.469 . . . . 0.0 110.532 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 830' ' ' VAL . . . . . 0.482 HG22 ' HB3' ' A' ' 854' ' ' ALA . 80.3 t -109.23 105.45 18.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.918 177.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 831' ' ' ASP . . . . . 0.886 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 33.3 t0 -117.55 137.41 52.59 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.739 -177.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.05 -21.95 60.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.666 178.653 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 1.2 m170 -111.48 106.82 57.02 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.581 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -49.29 -44.57 33.46 Favored 'Trans proline' 0 CA--C 1.533 0.463 0 C-N-CA 123.965 3.11 . . . . 0.0 114.672 -174.047 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 835' ' ' ILE . . . . . 0.406 ' O ' ' HG3' ' A' ' 838' ' ' ARG . 0.4 OUTLIER -65.39 -36.21 77.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.862 0.363 . . . . 0.0 111.081 -178.253 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 836' ' ' ASN . . . . . 0.534 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 5.0 m120 -75.33 -35.47 61.21 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 178.186 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 837' ' ' ARG . . . . . 0.886 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 1.3 ttp180 -53.36 -45.91 69.35 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.427 175.864 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 838' ' ' ARG . . . . . 0.406 ' HG3' ' O ' ' A' ' 835' ' ' ILE . 1.2 ppt_? -72.03 -28.75 63.57 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.982 178.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.99 -53.21 27.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.53 -0.304 . . . . 0.0 111.807 -177.093 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 840' ' ' LEU . . . . . 0.538 HD12 HG21 ' A' ' 829' ' ' VAL . 0.0 OUTLIER -72.24 -27.69 62.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.944 0.402 . . . . 0.0 109.963 -179.997 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -64.63 -35.53 81.31 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.079 174.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -64.8 -43.94 91.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.211 176.397 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 843' ' ' GLN . . . . . 0.476 ' O ' HD22 ' A' ' 847' ' ' LEU . 0.9 OUTLIER -58.11 -46.45 85.54 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.128 176.526 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 844' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.5 -42.62 96.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.071 178.177 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -68.04 -22.36 74.12 Favored Glycine 0 N--CA 1.45 -0.369 0 CA-C-N 116.05 -0.523 . . . . 0.0 112.282 178.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 35.8 m -75.32 -30.34 60.29 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.515 -0.18 . . . . 0.0 110.515 177.632 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 847' ' ' LEU . . . . . 0.476 HD22 ' O ' ' A' ' 843' ' ' GLN . 0.1 OUTLIER -68.52 -44.51 74.45 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 120.911 0.386 . . . . 0.0 110.168 173.41 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 105.19 59.56 0.65 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.79 -0.719 . . . . 0.0 113.35 174.705 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -143.45 -178.59 5.95 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 122.781 -0.246 . . . . 0.0 110.348 177.51 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -74.86 122.26 23.11 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 -177.618 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -122.47 120.55 34.24 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.516 -177.056 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 852' ' ' LYS . . . . . 0.458 ' HB3' HD12 ' A' ' 828' ' ' LEU . 0.0 OUTLIER -110.85 115.26 29.23 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.405 178.84 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.78 114.84 26.61 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.026 -177.344 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 854' ' ' ALA . . . . . 0.482 ' HB3' HG22 ' A' ' 830' ' ' VAL . . . -132.42 171.81 13.27 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.112 0.482 . . . . 0.0 111.629 -179.391 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 855' ' ' ASN . . . . . 0.509 ' OD1' ' HA ' ' A' ' 701' ' ' VAL . 6.3 t-20 -160.8 97.53 1.18 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.305 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 856' ' ' ASP . . . . . 0.478 ' HB2' ' O ' ' A' ' 855' ' ' ASN . 48.8 t0 170.06 156.28 0.06 Allowed 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.293 179.354 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -88.61 -49.36 3.66 Favored Glycine 0 N--CA 1.447 -0.606 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.071 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -74.27 -34.83 38.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 O-C-N 122.773 -0.251 . . . . 0.0 111.138 -178.144 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 859' ' ' ASP . . . . . 0.453 ' HB2' ' OD2' ' A' ' 856' ' ' ASP . 3.7 t0 -69.05 -19.12 64.09 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 111.925 0.343 . . . . 0.0 111.925 -178.163 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -64.78 -53.02 53.58 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.5 0.666 . . . . 0.0 109.582 173.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 861' ' ' LEU . . . . . 0.849 HD13 ' HA ' ' A' ' 890' ' ' ILE . 9.6 tp -61.15 -41.54 96.94 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.481 -0.782 . . . . 0.0 109.731 175.183 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 862' ' ' ASN . . . . . 0.425 ' HB3' ' HA ' ' A' ' 859' ' ' ASP . 48.2 t30 -60.03 -29.23 68.36 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.742 -1.117 . . . . 0.0 110.834 178.856 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 863' ' ' VAL . . . . . 0.629 HG13 HD13 ' A' ' 869' ' ' ILE . 0.5 OUTLIER -72.92 -34.62 46.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.621 -179.211 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 864' ' ' LEU . . . . . 0.471 HD22 HD21 ' A' ' 897' ' ' LEU . 6.3 mt -64.71 -33.33 75.71 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.224 0.535 . . . . 0.0 109.774 175.305 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -78.14 -24.88 47.2 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.875 178.199 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 9.0 mtmt -77.93 -48.55 16.07 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.93 -178.569 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 2.1 p30 -156.72 176.55 12.59 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.21 -177.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 79.2 t60 -91.31 97.3 11.02 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.109 0.481 . . . . 0.0 112.01 -174.734 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 869' ' ' ILE . . . . . 0.629 HD13 HG13 ' A' ' 863' ' ' VAL . 0.7 OUTLIER -94.31 133.65 34.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 166.806 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 870' ' ' ASP . . . . . 0.408 ' O ' ' HB2' ' A' ' 897' ' ' LEU . 1.8 m-20 -86.37 -43.99 12.41 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.71 0.29 . . . . 0.0 111.143 -174.366 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 871' ' ' ILE . . . . . 0.579 ' HB ' HG23 ' A' ' 827' ' ' ILE . 43.2 mm -122.59 126.31 73.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.217 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 872' ' ' VAL . . . . . 0.437 HG21 HD21 ' A' ' 864' ' ' LEU . 3.6 t -106.46 122.48 60.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 120.683 0.278 . . . . 0.0 110.334 178.343 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 873' ' ' LEU . . . . . 0.63 HD12 ' HB ' ' A' ' 829' ' ' VAL . 0.1 OUTLIER -104.86 121.55 43.91 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.114 177.113 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -109.45 106.34 16.05 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 177.769 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 875' ' ' ASP . . . . . 0.468 ' OD1' ' HG2' ' A' ' 925' ' ' LYS . 7.0 t0 -106.13 119.92 40.46 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.491 -175.896 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 10.5 t -126.26 119.87 55.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.213 -176.773 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 877' ' ' ASN . . . . . 0.722 ' HB2' ' HE2' ' A' ' 925' ' ' LYS . 0.1 OUTLIER -109.78 -36.35 5.94 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.156 175.186 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 878' ' ' MET . . . . . 0.444 ' HA ' ' HD3' ' A' ' 879' ' ' PRO . 1.5 mmm -121.27 131.74 24.39 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-O 121.017 0.437 . . . . 0.0 111.308 -178.384 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 879' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' ' 878' ' ' MET . 4.5 Cg_exo -80.06 64.93 8.92 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 123.122 2.548 . . . . 0.0 111.986 178.699 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -81.91 -10.39 59.3 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.82 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 881' ' ' MET . . . . . 0.428 ' HG3' ' N ' ' A' ' 882' ' ' ASP . 0.0 OUTLIER -153.21 143.98 22.76 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.605 -175.483 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 882' ' ' ASP . . . . . 0.428 ' N ' ' HG3' ' A' ' 881' ' ' MET . 0.9 OUTLIER -65.25 132.64 49.59 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.458 177.506 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -104.11 2.12 44.09 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.46 -0.876 . . . . 0.0 113.711 -172.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -70.88 -43.04 69.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.442 0.639 . . . . 0.0 109.479 -177.609 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 885' ' ' ARG . . . . . 0.464 ' HG2' ' HG3' ' A' ' 889' ' ' ARG . 0.0 OUTLIER -58.21 -32.97 68.78 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.325 177.1 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.75 -56.22 19.51 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.909 -176.735 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 887' ' ' THR . . . . . 0.405 ' O ' HG22 ' A' ' 890' ' ' ILE . 0.1 OUTLIER -65.83 -44.32 85.89 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.434 -176.741 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 6.3 tp60 -61.24 -50.36 73.38 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.184 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 889' ' ' ARG . . . . . 0.464 ' HG3' ' HG2' ' A' ' 885' ' ' ARG . 2.9 mtt180 -66.51 -41.45 88.82 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.436 -176.196 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 890' ' ' ILE . . . . . 0.849 ' HA ' HD13 ' A' ' 861' ' ' LEU . 10.5 tt -64.53 -41.71 93.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 C-N-CA 121.159 -0.216 . . . . 0.0 111.398 -176.305 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 891' ' ' ARG . . . . . 0.973 ' HA ' ' HB2' ' A' ' 895' ' ' LEU . 10.5 ptt85 -76.35 -32.32 58.57 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.671 179.001 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -70.02 -45.58 66.91 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.319 -176.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 893' ' ' LEU . . . . . 0.781 HD12 HD21 ' A' ' 861' ' ' LEU . 3.9 mt -75.06 -26.91 59.72 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.865 0.321 . . . . 0.0 111.865 -175.587 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 146.48 71.88 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.027 -1.082 . . . . 0.0 113.47 175.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 895' ' ' LEU . . . . . 0.973 ' HB2' ' HA ' ' A' ' 891' ' ' ARG . 0.5 OUTLIER -85.22 127.87 34.46 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 173.977 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -129.38 -9.29 4.67 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.126 0.489 . . . . 0.0 111.367 -177.727 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 897' ' ' LEU . . . . . 0.471 HD21 HD22 ' A' ' 864' ' ' LEU . 0.4 OUTLIER -122.89 157.98 58.57 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.832 -172.368 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -71.33 140.14 36.34 Favored 'Trans proline' 0 C--O 1.241 0.643 0 C-N-CA 123.069 2.513 . . . . 0.0 112.718 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 899' ' ' VAL . . . . . 0.926 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 43.3 t -114.53 132.98 62.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.733 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 900' ' ' ILE . . . . . 0.446 HG12 ' HB2' ' A' ' 921' ' ' SER . 89.6 mt -103.5 114.33 42.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.955 175.912 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 901' ' ' GLY . . . . . 0.53 ' O ' ' HA ' ' A' ' 922' ' ' CYS . . . -94.17 109.75 3.87 Favored Glycine 0 N--CA 1.443 -0.866 0 C-N-CA 120.738 -0.744 . . . . 0.0 111.518 177.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 902' ' ' VAL . . . . . 0.812 ' HB ' HD12 ' A' ' 923' ' ' LEU . 0.1 OUTLIER -108.6 118.76 56.88 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 177.707 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.95 154.06 48.53 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.859 -171.258 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -83.0 105.76 14.26 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.018 174.723 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 69.07 104.08 0.06 Allowed 'General case' 0 N--CA 1.467 0.409 0 O-C-N 123.803 0.689 . . . . 0.0 110.944 179.707 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -81.13 53.25 1.96 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.747 -175.142 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 1.3 mt -80.79 -58.91 2.88 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.006 0.431 . . . . 0.0 110.368 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -94.0 -19.49 20.84 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.374 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.56 -54.03 50.62 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.158 -178.172 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 910' ' ' GLU . . . . . 0.465 ' HA ' ' NH1' ' A' ' 913' ' ' ARG . 9.8 tp10 -50.85 -46.44 60.15 Favored 'General case' 0 N--CA 1.463 0.189 0 O-C-N 123.581 0.551 . . . . 0.0 111.453 -176.172 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 10.1 tmtt? -64.77 -52.49 56.64 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.399 -176.434 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -69.61 -43.94 71.73 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 111.699 0.259 . . . . 0.0 111.699 -174.742 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 913' ' ' ARG . . . . . 0.465 ' NH1' ' HA ' ' A' ' 910' ' ' GLU . 0.1 OUTLIER -65.98 -27.26 68.0 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 121.184 -0.206 . . . . 0.0 111.135 -176.9 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 78.3 m -74.63 -39.8 61.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.77 0.319 . . . . 0.0 110.377 175.374 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.61 -42.92 95.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.612 179.698 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -72.72 -42.71 63.86 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.804 179.173 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 50.7 50.0 19.81 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.807 -176.339 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -123.56 16.45 7.94 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.218 -178.03 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 919' ' ' MET . . . . . 0.926 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -113.77 -113.18 0.34 Allowed 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 179.221 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 920' ' ' ASP . . . . . 0.608 ' HB2' ' O ' ' A' ' 919' ' ' MET . 5.3 t70 164.52 -58.48 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.482 0 O-C-N 124.199 0.937 . . . . 0.0 109.89 174.697 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 921' ' ' SER . . . . . 0.446 ' HB2' HG12 ' A' ' 900' ' ' ILE . 57.9 m -113.87 164.59 13.56 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.035 177.805 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 922' ' ' CYS . . . . . 0.53 ' HA ' ' O ' ' A' ' 901' ' ' GLY . 0.1 OUTLIER -148.78 140.13 23.3 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.513 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 923' ' ' LEU . . . . . 0.812 HD12 ' HB ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -147.68 177.86 8.95 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.773 0.321 . . . . 0.0 110.439 178.184 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.87 146.18 24.61 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.991 -178.674 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 925' ' ' LYS . . . . . 0.722 ' HE2' ' HB2' ' A' ' 877' ' ' ASN . 3.7 tmtm? -45.73 -51.62 28.45 Favored Pre-proline 0 N--CA 1.47 0.572 0 O-C-N 123.67 0.606 . . . . 0.0 112.308 177.375 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -72.1 64.61 3.41 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 121.742 1.628 . . . . 0.0 112.169 175.254 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 2.1 p -71.65 148.94 9.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.043 0.449 . . . . 0.0 110.633 179.199 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.82 160.25 14.76 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.552 179.298 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 929' ' ' LEU . . . . . 0.431 HD23 ' HA ' ' A' ' 929' ' ' LEU . 0.0 OUTLIER -56.67 -45.36 81.74 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.107 -179.14 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -65.99 -44.61 84.34 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.824 0.345 . . . . 0.0 110.692 -176.871 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 931' ' ' VAL . . . . . 0.458 ' O ' ' HG3' ' A' ' 934' ' ' GLN . 74.4 t -63.65 -42.94 97.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.785 -178.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 932' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -66.7 -33.9 66.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.444 178.43 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.84 -48.67 58.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.002 -178.763 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 934' ' ' GLN . . . . . 0.458 ' HG3' ' O ' ' A' ' 931' ' ' VAL . 0.6 OUTLIER -65.7 -40.97 92.82 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 121.132 -0.227 . . . . 0.0 111.161 -177.573 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 12.4 m -64.41 -43.77 93.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.731 0.301 . . . . 0.0 111.087 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 936' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.78 -41.94 91.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.856 178.887 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 39.6 m -65.43 -44.46 87.29 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.229 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.15 -40.34 89.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.081 0.467 . . . . 0.0 110.503 178.868 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 939' ' ' TYR . . . . . 0.488 ' HD1' ' HA ' ' A' ' 939' ' ' TYR . 0.5 OUTLIER -72.85 -36.3 67.4 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.879 -178.902 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -62.15 -39.07 91.4 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.068 0.461 . . . . 0.0 110.905 177.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 941' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.31 -24.11 43.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.349 178.319 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 942' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.6 -47.75 68.8 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.418 178.512 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 943' ' ' VAL . . . . . 0.432 HG22 ' O ' ' A' ' 939' ' ' TYR . 5.8 m -69.51 -28.76 39.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.042 176.582 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -58.57 -33.52 70.05 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.195 173.763 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 3.3 mmtp -69.1 -48.77 61.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.842 177.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.1 -42.39 72.76 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.835 -0.62 . . . . 0.0 112.658 -175.174 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 11.1 mtm-85 -89.18 -33.74 16.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.755 0.312 . . . . 0.0 111.202 -175.842 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 1.2 t0 59.54 -168.4 0.15 Allowed 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.369 -177.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.795 -0.621 . . . . 0.0 110.057 178.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 3.1 ttp . . . . . 0 N--CA 1.48 1.031 0 CA-C-O 120.642 0.258 . . . . 0.0 110.506 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . -155.47 99.47 0.19 Allowed Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 121.158 -0.544 . . . . 0.0 112.009 177.707 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . 176.64 91.73 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 121.031 -0.604 . . . . 0.0 111.694 -179.564 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.87 -73.33 0.45 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.587 0.232 . . . . 0.0 111.104 -175.787 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . 93.06 -40.34 2.84 Favored Glycine 0 CA--C 1.519 0.309 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.621 -178.336 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 2.0 t 57.12 26.92 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 123.007 0.523 . . . . 0.0 111.554 177.849 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 702' ' ' GLU . . . . . 0.627 ' HA ' ' HB2' ' A' ' 796' ' ' ALA . 0.0 OUTLIER 54.97 31.31 15.74 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.515 -176.147 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . 130.18 146.57 6.0 Favored Glycine 0 N--CA 1.442 -0.956 0 C-N-CA 120.855 -0.688 . . . . 0.0 111.884 178.414 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.783 ' HB2' HD12 ' A' ' 801' ' ' ILE . 2.8 mm? -117.06 -141.37 0.37 Allowed 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 179.391 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -127.03 139.27 53.14 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.547 0.213 . . . . 0.0 111.034 179.224 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 80.99 45.84 7.41 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.848 -0.691 . . . . 0.0 113.473 173.564 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 4.4 tptt -145.59 153.74 41.39 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 176.452 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 708' ' ' ARG . . . . . 0.703 ' HG2' HG13 ' A' ' 732' ' ' VAL . 0.0 OUTLIER -118.59 156.39 29.26 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.216 0.532 . . . . 0.0 111.849 -172.716 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 709' ' ' CYS . . . . . 0.459 ' SG ' HD13 ' A' ' 726' ' ' LEU . 0.5 OUTLIER -142.19 145.25 33.95 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.794 173.741 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 710' ' ' TRP . . . . . . . . . . . . . 66.4 m95 -114.26 131.99 56.3 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 177.862 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 711' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -122.86 131.31 53.69 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.476 0.655 . . . . 0.0 111.658 -175.898 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -126.81 65.56 1.27 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.816 -1.084 . . . . 0.0 109.128 174.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 713' ' ' VAL . . . . . 0.865 ' HA ' ' HB2' ' A' ' 750' ' ' ASP . 13.4 t -113.1 134.3 56.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.681 -175.085 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -100.97 -27.6 13.2 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.68 -174.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 -74.57 124.97 27.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.942 173.507 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -70.37 -40.26 74.12 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.173 -173.536 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.66 -41.49 95.14 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.164 0.507 . . . . 0.0 110.479 178.63 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 718' ' ' LEU . . . . . 0.673 HD11 ' HD2' ' A' ' 765' ' ' PHE . 0.4 OUTLIER -71.87 -49.37 38.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.704 -179.41 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 719' ' ' CYS . . . . . 0.673 ' HB2' ' HB ' ' A' ' 713' ' ' VAL . 0.0 OUTLIER -60.25 -52.21 66.24 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.824 -177.752 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 720' ' ' GLN . . . . . 0.694 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 0.1 OUTLIER -63.49 -40.29 96.7 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -175.957 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -64.11 -43.48 95.22 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.808 0.337 . . . . 0.0 110.58 -179.241 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.4 -48.41 64.75 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.789 -179.261 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 723' ' ' GLU . . . . . 0.694 ' HG2' ' HA ' ' A' ' 720' ' ' GLN . 1.5 pt-20 -63.05 -42.49 99.74 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.379 -176.493 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 724' ' ' THR . . . . . 0.582 ' N ' ' HG3' ' A' ' 723' ' ' GLU . 20.1 m -70.84 -34.18 71.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.445 0.164 . . . . 0.0 111.359 -178.059 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 72.6 m -68.87 -37.76 79.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.775 0.321 . . . . 0.0 110.927 179.329 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 726' ' ' LEU . . . . . 0.524 HD21 HD12 ' A' ' 795' ' ' LEU . 14.1 mt -73.41 -42.49 62.02 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.081 0.467 . . . . 0.0 110.493 179.333 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -75.77 10.08 1.99 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.532 178.129 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.81 -35.14 64.85 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.809 0.338 . . . . 0.0 110.183 179.069 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 13.1 m -100.25 -94.22 0.27 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.677 177.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 730' ' ' GLY . . . . . . . . . . . . . . . -152.28 38.21 0.78 Allowed Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 111.336 -0.705 . . . . 0.0 111.336 -179.125 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 731' ' ' ILE . . . . . 0.619 HD11 ' H ' ' A' ' 704' ' ' LEU . 42.9 mm -101.42 128.31 53.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 178.857 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 732' ' ' VAL . . . . . 0.703 HG13 ' HG2' ' A' ' 708' ' ' ARG . 0.9 OUTLIER -98.02 114.73 36.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.368 0.604 . . . . 0.0 110.84 -176.403 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 733' ' ' VAL . . . . . . . . . . . . . 5.2 p -98.22 147.79 6.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.023 177.557 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 22.3 m -141.67 137.3 31.67 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.849 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -54.9 125.34 19.83 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.727 174.669 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 736' ' ' TYR . . . . . 0.414 ' CE2' ' HD3' ' A' ' 755' ' ' LYS . 21.8 t80 -74.74 83.76 2.12 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.172 0.51 . . . . 0.0 111.059 -179.294 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -70.24 -60.46 2.27 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.133 175.071 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 179.99 49.02 0.08 OUTLIER Glycine 0 N--CA 1.445 -0.734 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.513 179.495 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.89 147.07 23.97 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.86 0.362 . . . . 0.0 110.278 -178.703 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 34.7 mp0 -68.63 143.93 95.63 Favored Pre-proline 0 C--N 1.32 -0.71 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.765 -178.829 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 741' ' ' PRO . . . . . 0.483 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 40.4 Cg_endo -66.14 135.0 38.7 Favored 'Trans proline' 0 C--O 1.234 0.305 0 C-N-CA 122.931 2.421 . . . . 0.0 113.417 -176.429 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 742' ' ' THR . . . . . 0.547 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.0 OUTLIER -117.92 139.59 26.69 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.416 177.491 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 743' ' ' PRO . . . . . 0.578 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 33.5 Cg_endo -64.15 -17.12 58.55 Favored 'Trans proline' 0 N--CA 1.476 0.481 0 C-N-CA 123.042 2.495 . . . . 0.0 113.633 -176.076 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 744' ' ' GLU . . . . . 0.407 ' HG2' ' CG ' ' A' ' 834' ' ' PRO . 0.9 OUTLIER -97.97 -2.89 39.44 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.915 0.388 . . . . 0.0 110.645 179.492 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -109.56 155.28 21.59 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.232 -170.59 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 746' ' ' VAL . . . . . 0.883 HG21 HD11 ' A' ' 795' ' ' LEU . 17.3 m -120.09 148.16 23.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.518 -0.764 . . . . 0.0 110.878 -178.266 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 747' ' ' LEU . . . . . 0.501 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 0.2 OUTLIER -117.73 106.03 12.62 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.142 178.296 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 10.4 mt -95.28 108.84 21.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 177.532 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -114.31 147.38 39.18 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.168 0.509 . . . . 0.0 111.625 -171.433 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 750' ' ' ASP . . . . . 0.865 ' HB2' ' HA ' ' A' ' 713' ' ' VAL . 31.0 t0 -98.1 121.75 40.4 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.427 179.573 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 751' ' ' GLU . . . . . 0.408 ' HA ' ' HB3' ' A' ' 766' ' ' CYS . 1.0 OUTLIER 57.1 -150.54 0.44 Allowed 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.063 -176.677 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 752' ' ' VAL . . . . . 0.641 HG13 HG13 ' A' ' 772' ' ' ILE . 6.6 t -97.61 106.21 18.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 O-C-N 122.015 -0.428 . . . . 0.0 112.13 -173.571 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 2.1 t -103.42 -8.12 9.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.433 169.829 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 3.9 m 52.59 45.48 28.54 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.82 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 755' ' ' LYS . . . . . 0.414 ' HD3' ' CE2' ' A' ' 736' ' ' TYR . 0.0 OUTLIER -96.13 116.83 29.58 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.254 177.547 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 756' ' ' LYS . . . . . 0.458 ' HD3' ' HA ' ' A' ' 756' ' ' LYS . 1.8 mmpt? -81.98 81.78 7.83 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.445 0.641 . . . . 0.0 109.801 176.213 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 757' ' ' TRP . . . . . 0.623 ' HB3' ' HB ' ' A' ' 762' ' ' VAL . 74.2 t-105 -72.03 103.46 3.26 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.222 -177.469 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.62 87.94 7.53 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 175.514 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 759' ' ' GLY . . . . . 0.578 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -161.91 -139.18 2.58 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.159 -179.017 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 14.8 ttt85 -70.04 -59.49 2.88 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.809 0.338 . . . . 0.0 110.455 -179.308 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -163.86 144.43 8.57 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.264 -178.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 762' ' ' VAL . . . . . 0.623 ' HB ' ' HB3' ' A' ' 757' ' ' TRP . 2.0 p -118.66 119.53 61.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.519 174.671 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 763' ' ' VAL . . . . . 0.643 HG11 HD21 ' A' ' 791' ' ' LEU . 45.6 t -107.88 108.34 25.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.642 -178.475 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 764' ' ' THR . . . . . 0.825 ' HB ' HG12 ' A' ' 782' ' ' VAL . 84.9 m -96.89 116.35 29.03 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.511 179.113 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 765' ' ' PHE . . . . . 0.673 ' HD2' HD11 ' A' ' 718' ' ' LEU . 1.6 m-30 -99.74 93.7 5.95 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 177.343 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 766' ' ' CYS . . . . . 0.408 ' HB3' ' HA ' ' A' ' 751' ' ' GLU . 1.3 p -118.67 132.51 56.17 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.679 -177.271 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 767' ' ' ARG . . . . . 0.823 ' HA ' ' HB3' ' A' ' 784' ' ' SER . 0.4 OUTLIER -109.46 -58.94 1.97 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.753 0.311 . . . . 0.0 110.945 -173.278 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -102.33 -25.87 13.5 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.195 -178.494 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -109.59 92.77 4.18 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.034 0.445 . . . . 0.0 110.079 179.607 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 3.1 mp -101.09 109.08 24.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.607 -179.065 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -133.44 -9.92 1.98 Allowed Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.927 -179.841 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 772' ' ' ILE . . . . . 0.641 HG13 HG13 ' A' ' 752' ' ' VAL . 14.2 mt -104.84 138.39 19.49 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.741 0.27 . . . . 0.0 110.379 -178.936 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 773' ' ' PRO . . . . . 0.486 ' HD3' ' HA ' ' A' ' 772' ' ' ILE . 14.6 Cg_exo -69.14 162.81 40.23 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 123.315 2.677 . . . . 0.0 112.725 -179.854 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 774' ' ' LEU . . . . . 0.504 ' CB ' HG22 ' A' ' 782' ' ' VAL . 0.7 OUTLIER -98.89 -156.29 0.54 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.97 -178.399 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 775' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 1.4 mp0 -61.42 72.43 0.01 OUTLIER 'General case' 0 C--O 1.234 0.251 0 CA-C-O 122.161 0.981 . . . . 0.0 112.343 176.262 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 5.2 ptmt -131.4 -25.12 2.21 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 114.067 -1.424 . . . . 0.0 108.541 170.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 777' ' ' ALA . . . . . 0.686 ' HB3' ' HB2' ' A' ' 780' ' ' GLU . . . -95.81 163.98 19.88 Favored Pre-proline 0 C--O 1.235 0.34 0 CA-C-N 114.812 -1.086 . . . . 0.0 109.511 175.644 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 778' ' ' PRO . . . . . 0.579 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 43.2 Cg_endo -68.04 70.82 0.85 Allowed 'Trans proline' 0 CA--C 1.533 0.463 0 C-N-CA 122.726 2.284 . . . . 0.0 113.237 -178.289 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 117.44 18.08 5.46 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.672 -0.775 . . . . 0.0 113.162 175.704 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 780' ' ' GLU . . . . . 0.686 ' HB2' ' HB3' ' A' ' 777' ' ' ALA . 2.2 tt0 -94.28 125.83 39.15 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 179.608 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 22.4 m95 -133.38 136.77 45.51 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 782' ' ' VAL . . . . . 0.825 HG12 ' HB ' ' A' ' 764' ' ' THR . 27.9 m -134.35 161.71 40.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.824 174.523 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 783' ' ' HIS . . . . . . . . . . . . . 4.6 t-160 -172.98 146.34 1.5 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.582 174.344 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 784' ' ' SER . . . . . 0.823 ' HB3' ' HA ' ' A' ' 767' ' ' ARG . 0.9 OUTLIER -100.22 100.36 11.18 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 173.52 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 785' ' ' VAL . . . . . 0.411 HG11 ' HG3' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -162.65 177.43 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.53 -179.716 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -121.03 63.43 0.87 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.483 177.551 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 54.75 68.44 2.62 Favored Pre-proline 0 N--CA 1.468 0.427 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.75 178.382 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 788' ' ' PRO . . . . . 0.843 ' HG2' ' HG2' ' A' ' 790' ' ' GLU . 76.5 Cg_endo -89.08 41.24 0.54 Allowed 'Trans proline' 0 N--CA 1.46 -0.443 0 C-N-CA 122.936 2.424 . . . . 0.0 112.978 -177.601 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 73.78 -28.17 0.19 Allowed 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 175.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 790' ' ' GLU . . . . . 0.843 ' HG2' ' HG2' ' A' ' 788' ' ' PRO . 1.2 pt-20 -65.68 -37.88 87.7 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.084 0.402 . . . . 0.0 112.084 -176.295 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 791' ' ' LEU . . . . . 0.643 HD21 HG11 ' A' ' 763' ' ' VAL . 0.2 OUTLIER -67.04 -55.0 17.31 Favored Pre-proline 0 C--N 1.327 -0.375 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -177.491 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 792' ' ' PRO . . . . . 0.43 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 9.7 Cg_endo -55.35 -34.1 87.61 Favored 'Trans proline' 0 C--N 1.354 0.856 0 C-N-CA 121.854 1.703 . . . . 0.0 112.238 176.837 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -67.86 -44.45 77.06 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 120.96 0.41 . . . . 0.0 110.725 177.553 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 794' ' ' LEU . . . . . 0.405 ' O ' ' HB ' ' A' ' 798' ' ' ILE . 0.1 OUTLIER -63.36 -39.63 95.06 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.364 178.505 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 795' ' ' LEU . . . . . 0.883 HD11 HG21 ' A' ' 746' ' ' VAL . 0.0 OUTLIER -62.06 -34.68 76.71 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.812 179.646 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 796' ' ' ALA . . . . . 0.627 ' HB2' ' HA ' ' A' ' 702' ' ' GLU . . . -62.85 -53.42 54.4 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.297 179.052 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 797' ' ' ARG . . . . . 0.613 ' HA ' HD13 ' A' ' 800' ' ' LEU . 0.0 OUTLIER -72.04 -21.56 61.52 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.944 0.402 . . . . 0.0 111.2 -179.449 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 798' ' ' ILE . . . . . 0.405 ' HB ' ' O ' ' A' ' 794' ' ' LEU . 0.1 OUTLIER -69.25 -28.42 38.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 121.186 0.517 . . . . 0.0 109.893 175.758 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -80.85 -61.14 2.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.663 173.667 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 800' ' ' LEU . . . . . 0.613 HD13 ' HA ' ' A' ' 797' ' ' ARG . 2.5 tp 50.34 79.6 0.08 Allowed 'General case' 0 N--CA 1.468 0.432 0 O-C-N 124.233 0.958 . . . . 0.0 111.819 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 801' ' ' ILE . . . . . 0.783 HD12 ' HB2' ' A' ' 704' ' ' LEU . 13.5 mt -112.34 -38.17 2.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.837 177.4 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 802' ' ' GLU . . . . . 0.443 ' H ' ' HG ' ' A' ' 704' ' ' LEU . 0.5 OUTLIER 41.64 50.85 3.9 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 124.194 0.934 . . . . 0.0 111.467 177.681 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 803' ' ' MET . . . . . 0.66 ' HB2' HG22 ' A' ' 801' ' ' ILE . 0.8 OUTLIER -105.26 -178.4 3.64 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.232 -0.895 . . . . 0.0 111.288 -172.307 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 804' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 69.21 -167.28 0.18 Allowed 'General case' 0 C--O 1.233 0.233 0 O-C-N 123.819 0.699 . . . . 0.0 111.306 175.558 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -68.83 103.1 1.7 Allowed 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 121.076 0.465 . . . . 0.0 110.097 176.123 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -68.81 102.08 1.47 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.354 179.156 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -64.12 135.33 96.27 Favored Pre-proline 0 C--N 1.322 -0.594 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.718 177.014 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 808' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -72.71 48.59 1.37 Allowed 'Trans proline' 0 CA--C 1.529 0.257 0 C-N-CA 122.716 2.278 . . . . 0.0 112.84 -179.385 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -89.93 25.07 2.21 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.118 0.485 . . . . 0.0 110.556 179.215 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -62.2 125.27 23.31 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.833 -0.622 . . . . 0.0 110.038 178.308 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -69.41 158.43 35.14 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.211 -176.731 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -100.65 106.5 43.73 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.56 176.822 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -79.15 55.01 5.44 Favored 'Trans proline' 0 N--CA 1.459 -0.505 0 C-N-CA 123.31 2.674 . . . . 0.0 112.19 -177.366 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.07 77.22 2.24 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.26 0.552 . . . . 0.0 110.302 178.388 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 2.2 t -157.59 11.45 0.2 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.864 -179.254 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 816' ' ' ASP . . . . . 0.491 ' HB3' ' H ' ' A' ' 817' ' ' LYS . 0.8 OUTLIER 59.95 -101.58 0.12 Allowed 'General case' 0 C--O 1.233 0.218 0 CA-C-N 114.733 -1.121 . . . . 0.0 111.316 -178.217 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 817' ' ' LYS . . . . . 0.491 ' H ' ' HB3' ' A' ' 816' ' ' ASP . 0.3 OUTLIER 57.25 32.59 21.99 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.255 0.55 . . . . 0.0 111.156 -179.481 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -79.53 79.06 6.04 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.128 178.146 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -77.62 25.23 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.782 -177.872 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 1.2 m 52.75 73.23 0.36 Allowed 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.081 0.467 . . . . 0.0 110.418 -176.437 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -56.63 123.15 13.89 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.385 -178.21 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 19.6 t30 -68.81 -47.72 65.38 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.612 -173.085 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -116.87 148.27 41.44 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.262 0.553 . . . . 0.0 112.098 -172.593 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -144.9 30.22 1.18 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.777 -1.101 . . . . 0.0 108.849 171.295 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 9.3 ttt -88.04 111.77 21.9 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.591 178.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 826' ' ' MET . . . . . 0.57 ' HG2' ' O ' ' A' ' 868' ' ' HIS . 0.9 OUTLIER -94.82 122.76 37.77 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.516 0.674 . . . . 0.0 111.367 -172.192 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 827' ' ' ILE . . . . . 0.524 HG23 ' HB ' ' A' ' 871' ' ' ILE . 1.5 mm -115.11 125.39 72.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.529 176.018 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 828' ' ' LEU . . . . . 0.511 HD22 HG22 ' A' ' 830' ' ' VAL . 0.8 OUTLIER -93.42 115.95 28.49 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.625 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 829' ' ' VAL . . . . . 0.686 HG13 HD12 ' A' ' 873' ' ' LEU . 0.0 OUTLIER -103.02 97.51 5.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.93 179.944 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 830' ' ' VAL . . . . . 0.511 HG22 HD22 ' A' ' 828' ' ' LEU . 0.0 OUTLIER -113.54 112.65 41.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.17 -179.476 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 831' ' ' ASP . . . . . 0.688 ' HB2' ' HB3' ' A' ' 875' ' ' ASP . 0.0 OUTLIER -127.22 161.98 27.27 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.942 -175.534 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 832' ' ' ASP . . . . . 0.475 ' CG ' ' H ' ' A' ' 877' ' ' ASN . 1.6 p-10 -96.24 -13.64 23.27 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -175.904 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 833' ' ' HIS . . . . . 0.431 ' H ' ' CG ' ' A' ' 831' ' ' ASP . 0.0 OUTLIER -122.25 102.49 39.95 Favored Pre-proline 0 C--N 1.322 -0.601 0 O-C-N 122.343 -0.223 . . . . 0.0 110.778 -175.456 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 834' ' ' PRO . . . . . 0.491 ' HB2' ' HB2' ' A' ' 743' ' ' PRO . 92.7 Cg_exo -42.82 -37.31 5.83 Favored 'Trans proline' 0 CA--C 1.533 0.47 0 C-N-CA 124.054 3.169 . . . . 0.0 114.776 -172.3 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -65.18 -36.54 78.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-O 121.096 0.474 . . . . 0.0 110.904 179.265 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 836' ' ' ASN . . . . . 0.63 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 0.7 OUTLIER -74.86 -40.72 60.83 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 179.039 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 837' ' ' ARG . . . . . 0.61 ' HB2' ' OD1' ' A' ' 831' ' ' ASP . 3.9 ttt-85 -52.36 -41.25 62.92 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.431 177.363 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 1.3 tmm_? -67.4 -41.76 84.38 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.448 177.004 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 839' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 839' ' ' LEU . 2.7 mt -63.8 -50.82 67.46 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.351 -176.412 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 840' ' ' LEU . . . . . 0.63 ' HG ' ' O ' ' A' ' 836' ' ' ASN . 0.0 OUTLIER -69.15 -32.21 71.41 Favored 'General case' 0 CA--C 1.517 -0.302 0 O-C-N 121.997 -0.439 . . . . 0.0 110.623 -178.621 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 841' ' ' ALA . . . . . 0.822 ' HB2' HG21 ' A' ' 853' ' ' THR . . . -65.08 -45.99 83.0 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 120.957 0.408 . . . . 0.0 110.49 177.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -62.75 -42.43 99.67 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.403 178.138 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 843' ' ' GLN . . . . . 0.42 ' HG2' HD23 ' A' ' 929' ' ' LEU . 8.6 mt-30 -62.68 -40.97 98.76 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.886 178.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 844' ' ' LEU . . . . . 0.461 ' HA ' HD13 ' A' ' 844' ' ' LEU . 0.0 OUTLIER -65.52 -32.55 74.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.155 0.503 . . . . 0.0 109.762 176.667 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -66.9 -36.56 91.25 Favored Glycine 0 N--CA 1.446 -0.638 0 CA-C-N 115.489 -0.778 . . . . 0.0 112.027 174.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.24 -29.34 70.45 Favored 'General case' 0 N--CA 1.456 -0.138 0 CA-C-O 120.952 0.406 . . . . 0.0 110.494 176.748 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 5.8 mt -74.62 -52.01 12.9 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.214 -0.448 . . . . 0.0 109.938 174.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 103.6 42.82 1.93 Allowed Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.641 176.728 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 1.7 m-30 -113.32 165.94 11.95 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -73.74 129.75 38.56 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 176.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.61 147.86 41.68 Favored 'General case' 0 C--N 1.321 -0.665 0 C-N-CA 120.584 -0.446 . . . . 0.0 111.35 -176.59 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 852' ' ' LYS . . . . . 0.439 ' O ' HD23 ' A' ' 828' ' ' LEU . 0.1 OUTLIER -127.84 109.59 11.77 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 173.54 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 853' ' ' THR . . . . . 0.822 HG21 ' HB2' ' A' ' 841' ' ' ALA . 0.2 OUTLIER -102.42 114.73 29.17 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -173.053 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 854' ' ' ALA . . . . . . . . . . . . . . . -134.24 178.83 6.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.156 179.344 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 20.1 p-10 -139.52 75.26 1.5 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.804 0.812 . . . . 0.0 111.239 179.377 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 856' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -172.17 159.13 4.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.577 176.146 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -94.14 -44.66 3.49 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.421 -0.895 . . . . 0.0 113.098 -177.841 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 2.0 p -75.22 -34.03 30.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 117.173 0.487 . . . . 0.0 111.947 -173.75 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.51 -20.34 62.85 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 120.94 -0.304 . . . . 0.0 110.687 179.266 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -63.66 -38.65 91.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.02 0.438 . . . . 0.0 109.971 174.682 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 861' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' A' ' 861' ' ' LEU . 0.0 OUTLIER -69.13 -38.41 78.83 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.975 176.373 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 14.1 t30 -59.07 -52.88 63.82 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.028 177.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -65.73 -31.59 54.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.855 179.022 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 864' ' ' LEU . . . . . 0.753 HD23 HD12 ' A' ' 869' ' ' ILE . 0.8 OUTLIER -58.42 -34.32 70.65 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.176 0.512 . . . . 0.0 110.763 177.017 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 1.3 m -92.15 -17.06 25.44 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.604 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 1.1 mmmm -101.88 -2.76 29.2 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -174.751 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -162.04 161.04 28.22 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 -178.833 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 868' ' ' HIS . . . . . 0.57 ' O ' ' HG2' ' A' ' 826' ' ' MET . 0.0 OUTLIER -78.96 137.8 37.77 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 110.344 -0.243 . . . . 0.0 110.344 -178.306 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 869' ' ' ILE . . . . . 0.753 HD12 HD23 ' A' ' 864' ' ' LEU . 6.7 mt -135.27 142.47 39.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.525 178.572 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -99.6 -62.95 1.17 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.829 177.779 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 871' ' ' ILE . . . . . 0.524 ' HB ' HG23 ' A' ' 827' ' ' ILE . 18.0 mm -121.61 140.74 44.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.215 178.234 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 872' ' ' VAL . . . . . . . . . . . . . 55.5 t -119.13 122.04 68.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 175.628 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 873' ' ' LEU . . . . . 0.686 HD12 HG13 ' A' ' 829' ' ' VAL . 0.0 OUTLIER -112.15 122.49 47.89 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 178.982 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -109.83 104.19 13.1 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.05 179.729 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 875' ' ' ASP . . . . . 0.688 ' HB3' ' HB2' ' A' ' 831' ' ' ASP . 37.5 t0 -97.46 112.09 24.08 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.061 -176.901 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 876' ' ' VAL . . . . . 0.409 ' O ' ' HA ' ' A' ' 903' ' ' THR . 1.1 t -128.38 124.89 62.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.48 0.657 . . . . 0.0 112.223 -172.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 877' ' ' ASN . . . . . 0.475 ' H ' ' CG ' ' A' ' 832' ' ' ASP . 1.3 t30 -98.94 -38.87 8.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.098 -0.955 . . . . 0.0 109.24 171.631 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 878' ' ' MET . . . . . 0.884 ' HG2' ' HD2' ' A' ' 879' ' ' PRO . 0.1 OUTLIER -116.6 145.75 36.02 Favored Pre-proline 0 C--N 1.323 -0.571 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.642 177.31 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 879' ' ' PRO . . . . . 0.884 ' HD2' ' HG2' ' A' ' 878' ' ' MET . 18.1 Cg_endo -60.62 -7.99 8.28 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.869 2.38 . . . . 0.0 112.929 177.332 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 880' ' ' ASN . . . . . 0.46 ' HB3' ' O ' ' A' ' 879' ' ' PRO . 5.4 t30 75.29 -62.77 0.44 Allowed 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.493 0.717 . . . . 0.0 111.318 175.384 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 21.7 ttm -172.7 -69.07 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 -178.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -81.09 -117.94 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.368 175.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . 135.54 -3.46 3.93 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.353 -0.927 . . . . 0.0 113.173 173.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 23.2 p90 -126.51 -33.2 2.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 117.289 0.544 . . . . 0.0 111.077 -177.547 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 885' ' ' ARG . . . . . 0.695 ' O ' ' HB2' ' A' ' 889' ' ' ARG . 0.0 OUTLIER -60.22 -32.67 71.34 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.12 -178.777 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.32 -46.95 75.13 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.675 0.274 . . . . 0.0 110.694 -177.79 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.22 -37.48 61.08 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.063 0.459 . . . . 0.0 111.236 -176.701 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 -70.95 -47.24 60.1 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.823 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 889' ' ' ARG . . . . . 0.695 ' HB2' ' O ' ' A' ' 885' ' ' ARG . 0.0 OUTLIER -62.88 -39.12 93.49 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.394 -178.708 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 890' ' ' ILE . . . . . . . . . . . . . 4.3 tt -67.63 -40.38 83.99 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 C-N-CA 120.769 -0.373 . . . . 0.0 111.116 -178.837 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 891' ' ' ARG . . . . . 0.501 ' HA ' ' CB ' ' A' ' 895' ' ' LEU . 2.5 ptm180 -75.82 -23.87 55.81 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 120.74 0.305 . . . . 0.0 110.807 178.715 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -74.44 -44.3 52.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.868 -179.771 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 893' ' ' LEU . . . . . 0.435 HD23 ' HA ' ' A' ' 893' ' ' LEU . 1.2 mt -67.85 -44.52 76.94 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.953 -178.198 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 155.76 67.41 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.399 178.862 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 895' ' ' LEU . . . . . 0.501 ' CB ' ' HA ' ' A' ' 891' ' ' ARG . 3.6 tp -76.12 111.27 11.35 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.794 0.331 . . . . 0.0 110.556 179.296 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -134.62 25.01 3.73 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.244 0.545 . . . . 0.0 110.339 177.295 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 897' ' ' LEU . . . . . 0.41 ' HA ' ' HD3' ' A' ' 898' ' ' PRO . 0.4 OUTLIER -135.76 150.13 70.91 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.863 -177.857 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 898' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 897' ' ' LEU . 14.4 Cg_exo -69.47 118.4 5.66 Favored 'Trans proline' 0 C--O 1.236 0.396 0 C-N-CA 122.812 2.341 . . . . 0.0 112.742 -178.641 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 899' ' ' VAL . . . . . 0.803 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 94.6 t -104.15 117.8 50.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 121.087 0.47 . . . . 0.0 109.905 175.567 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 900' ' ' ILE . . . . . 0.684 HG23 ' HB2' ' A' ' 921' ' ' SER . 5.9 mt -90.69 107.58 18.69 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.241 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 901' ' ' GLY . . . . . 0.566 ' O ' ' HA ' ' A' ' 922' ' ' CYS . . . -91.19 113.95 4.4 Favored Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.835 -0.698 . . . . 0.0 111.828 179.38 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 902' ' ' VAL . . . . . 0.673 ' HB ' HD12 ' A' ' 923' ' ' LEU . 0.3 OUTLIER -113.47 130.63 67.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 -179.9 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 903' ' ' THR . . . . . 0.523 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.3 OUTLIER -131.08 160.97 33.11 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.7 -177.422 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 904' ' ' ALA . . . . . 0.727 ' HB2' ' HB2' ' A' ' 925' ' ' LYS . . . -121.58 105.28 10.3 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.68 0.276 . . . . 0.0 111.582 -178.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 8.3 t30 61.14 51.33 4.45 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.559 172.642 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 906' ' ' ALA . . . . . 0.494 ' HB3' ' HG3' ' A' ' 909' ' ' GLU . . . -90.46 -27.09 19.48 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 175.308 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER 65.57 20.48 11.64 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.883 174.26 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -161.63 30.76 0.13 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.246 -0.888 . . . . 0.0 108.785 178.229 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 909' ' ' GLU . . . . . 0.494 ' HG3' ' HB3' ' A' ' 906' ' ' ALA . 0.7 OUTLIER -64.31 -34.36 77.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.884 -1.053 . . . . 0.0 111.182 -173.279 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 910' ' ' GLU . . . . . 0.586 ' HG2' ' N ' ' A' ' 911' ' ' LYS . 1.6 pm0 -67.6 -45.0 76.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.978 0.418 . . . . 0.0 110.52 -179.434 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 911' ' ' LYS . . . . . 0.586 ' N ' ' HG2' ' A' ' 910' ' ' GLU . 0.1 OUTLIER -72.29 -31.85 66.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.914 -177.926 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.02 -43.23 79.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.106 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 913' ' ' ARG . . . . . 0.489 ' HG3' ' N ' ' A' ' 914' ' ' CYS . 0.0 OUTLIER -66.64 -35.3 79.84 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 121.144 -0.222 . . . . 0.0 110.747 -179.663 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 914' ' ' CYS . . . . . 0.489 ' N ' ' HG3' ' A' ' 913' ' ' ARG . 91.3 m -72.4 -35.93 68.54 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.868 0.366 . . . . 0.0 110.648 178.343 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 1.1 tp -65.87 -41.42 91.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.102 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -75.2 -40.1 59.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.019 -179.38 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 50.45 45.16 26.7 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.909 177.758 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -145.09 25.59 1.9 Allowed Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.422 -178.427 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 919' ' ' MET . . . . . 0.803 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -119.4 -111.46 0.34 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.559 0.179 . . . . 0.0 110.814 -177.832 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 920' ' ' ASP . . . . . 0.512 ' HB2' ' O ' ' A' ' 919' ' ' MET . 13.8 t70 167.0 -53.95 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.971 0.908 . . . . 0.0 109.673 176.653 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 921' ' ' SER . . . . . 0.684 ' HB2' HG23 ' A' ' 900' ' ' ILE . 0.0 OUTLIER -118.32 172.13 7.66 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.052 -177.717 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 922' ' ' CYS . . . . . 0.566 ' HA ' ' O ' ' A' ' 901' ' ' GLY . 0.5 OUTLIER -154.18 139.1 17.2 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.019 -179.513 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 923' ' ' LEU . . . . . 0.673 HD12 ' HB ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -156.92 -175.47 5.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.772 175.178 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 924' ' ' SER . . . . . 0.523 ' HA ' ' O ' ' A' ' 903' ' ' THR . 0.5 OUTLIER -105.05 160.27 15.18 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.608 -179.059 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 925' ' ' LYS . . . . . 0.727 ' HB2' ' HB2' ' A' ' 904' ' ' ALA . 2.1 tttp -53.59 -48.36 93.34 Favored Pre-proline 0 CA--C 1.544 0.715 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 926' ' ' PRO . . . . . 0.532 ' HD3' ' HB3' ' A' ' 925' ' ' LYS . 31.8 Cg_exo -60.6 98.5 0.13 Allowed 'Trans proline' 0 C--N 1.357 0.981 0 C-N-CA 122.101 1.867 . . . . 0.0 112.53 175.774 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 927' ' ' VAL . . . . . 0.59 HG13 ' HB ' ' A' ' 931' ' ' VAL . 19.8 t -134.74 125.7 46.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.825 179.224 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -88.7 173.84 8.36 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.696 -0.229 . . . . 0.0 110.751 177.619 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 929' ' ' LEU . . . . . 0.42 HD23 ' HG2' ' A' ' 843' ' ' GLN . 0.5 OUTLIER -61.13 -32.67 72.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.621 0.248 . . . . 0.0 110.76 -179.129 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -70.9 -39.03 73.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.883 0.373 . . . . 0.0 110.38 -178.752 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 931' ' ' VAL . . . . . 0.59 ' HB ' HG13 ' A' ' 927' ' ' VAL . 46.8 t -70.59 -41.24 77.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.306 178.173 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 932' ' ' ILE . . . . . 0.494 HG12 HG11 ' A' ' 927' ' ' VAL . 0.3 OUTLIER -61.77 -41.46 90.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 109.97 -0.382 . . . . 0.0 109.97 177.308 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.87 -48.9 67.37 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.213 -177.776 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 934' ' ' GLN . . . . . 0.531 ' O ' ' HB2' ' A' ' 938' ' ' LEU . 0.0 OUTLIER -64.02 -31.71 73.0 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 121.22 -0.192 . . . . 0.0 111.225 -176.751 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 15.8 m -74.52 -46.41 39.36 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 120.687 0.279 . . . . 0.0 111.008 178.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 936' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' A' ' 936' ' ' LEU . 0.0 OUTLIER -63.5 -43.18 97.99 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.496 -179.943 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 37.6 m -66.61 -41.09 88.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.544 179.057 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 938' ' ' LEU . . . . . 0.531 ' HB2' ' O ' ' A' ' 934' ' ' GLN . 0.3 OUTLIER -59.53 -46.11 89.83 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.333 0.587 . . . . 0.0 110.607 179.251 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -77.76 -25.36 49.06 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.245 -177.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -62.86 -39.72 95.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.903 0.382 . . . . 0.0 110.386 174.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 941' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.26 -34.85 71.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.137 177.965 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 942' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.06 -47.89 75.72 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.772 179.133 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 35.4 m -71.25 -28.49 32.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.651 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.74 -50.54 71.92 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.827 177.359 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.31 -22.67 51.6 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.789 0.328 . . . . 0.0 111.392 -178.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 49.3 m -73.6 -29.86 62.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.921 0.391 . . . . 0.0 110.724 177.796 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -95.83 -61.51 1.44 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.675 -178.749 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -88.19 122.14 31.4 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.785 -178.548 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 3.4 m . . . . . 0 C--O 1.251 1.152 0 CA-C-O 118.326 -0.845 . . . . 0.0 110.229 -178.374 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.048 0 CA-C-O 120.905 0.383 . . . . 0.0 110.367 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 162.12 -167.21 36.68 Favored Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 120.998 -0.62 . . . . 0.0 112.156 177.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . -86.03 77.03 2.08 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.8 -0.714 . . . . 0.0 111.974 179.565 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.77 136.64 58.13 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.554 0.216 . . . . 0.0 110.894 179.743 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . -59.34 111.59 3.54 Favored Glycine 0 N--CA 1.451 -0.35 0 CA-C-N 115.969 -0.559 . . . . 0.0 112.553 -178.534 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 2.6 p -88.92 112.82 24.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.355 0.598 . . . . 0.0 110.902 -178.085 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -162.8 160.23 24.99 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.912 177.623 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . 158.01 -71.33 0.25 Allowed Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.928 -0.653 . . . . 0.0 111.615 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.444 HD22 HG12 ' A' ' 801' ' ' ILE . 13.7 mt 53.56 35.0 19.78 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 122.845 0.458 . . . . 0.0 111.582 178.613 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 705' ' ' SER . . . . . 0.439 ' HA ' ' HA3' ' A' ' 730' ' ' GLY . 0.5 OUTLIER -112.64 135.45 53.35 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.719 0.295 . . . . 0.0 110.665 -179.33 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 116.1 -25.94 9.07 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.148 177.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 707' ' ' LYS . . . . . 0.516 ' HA ' ' HD2' ' A' ' 707' ' ' LYS . 10.2 mmmt -69.78 132.75 46.56 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 176.51 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 708' ' ' ARG . . . . . 0.511 ' HA ' HG23 ' A' ' 732' ' ' VAL . 24.9 mtt85 -100.61 161.56 13.51 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.478 0.656 . . . . 0.0 111.33 -173.542 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 1.1 m -136.78 113.85 10.59 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.253 -0.885 . . . . 0.0 108.722 173.038 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 710' ' ' TRP . . . . . 0.463 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 87.8 m95 -90.5 112.57 24.28 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.401 0.619 . . . . 0.0 110.153 -173.899 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 711' ' ' LEU . . . . . 0.482 HD21 ' HB2' ' A' ' 719' ' ' CYS . 0.4 OUTLIER -111.83 119.84 39.93 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.109 -0.95 . . . . 0.0 111.061 -170.194 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -126.66 63.84 1.28 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.825 177.086 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 713' ' ' VAL . . . . . 0.78 HG13 ' HB3' ' A' ' 750' ' ' ASP . 90.4 t -117.27 121.42 67.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.273 -179.239 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 13.8 mtt85 -71.81 -34.0 68.98 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.589 -179.748 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -69.7 108.01 3.71 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.525 178.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 716' ' ' ALA . . . . . 0.6 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -65.15 -32.31 73.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.829 -174.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.11 -44.97 78.58 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.304 0.573 . . . . 0.0 110.344 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 718' ' ' LEU . . . . . 0.41 ' HB3' HG11 ' A' ' 713' ' ' VAL . 0.3 OUTLIER -67.93 -49.04 64.17 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.774 177.854 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 719' ' ' CYS . . . . . 0.6 ' SG ' ' HA ' ' A' ' 716' ' ' ALA . 3.0 p -63.73 -42.46 97.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.999 -175.744 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 720' ' ' GLN . . . . . 0.586 ' HB2' ' O ' ' A' ' 716' ' ' ALA . 0.1 OUTLIER -65.47 -36.73 84.76 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 111.568 0.21 . . . . 0.0 111.568 -179.26 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -55.44 -59.27 5.05 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.925 0.393 . . . . 0.0 110.508 178.641 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 722' ' ' LEU . . . . . 0.524 HD13 HG21 ' A' ' 748' ' ' ILE . 6.9 mt -65.38 -47.26 77.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.28 -178.443 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 723' ' ' GLU . . . . . 0.594 ' HA ' HG21 ' A' ' 733' ' ' VAL . 0.1 OUTLIER -60.11 -48.47 81.57 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.337 -174.411 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 724' ' ' THR . . . . . . . . . . . . . 45.7 m -67.36 -36.4 81.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.186 -177.109 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 42.9 m -68.27 -37.34 80.62 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.787 0.327 . . . . 0.0 111.297 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 726' ' ' LEU . . . . . . . . . . . . . 14.2 mt -76.51 -38.13 55.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.443 -175.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 2.5 pp0? -74.77 0.44 15.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.621 0.248 . . . . 0.0 111.531 -178.048 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 2.2 mtm180 -64.27 -35.18 80.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.824 0.345 . . . . 0.0 110.204 178.032 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 729' ' ' SER . . . . . 0.49 ' HB2' ' H ' ' A' ' 730' ' ' GLY . 0.0 OUTLIER -93.32 -100.24 0.14 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.26 177.418 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 730' ' ' GLY . . . . . 0.49 ' H ' ' HB2' ' A' ' 729' ' ' SER . . . -143.46 20.97 2.23 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.802 -0.713 . . . . 0.0 111.717 178.721 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 731' ' ' ILE . . . . . . . . . . . . . 20.6 mm -83.32 116.21 27.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.925 0.393 . . . . 0.0 110.226 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 732' ' ' VAL . . . . . 0.511 HG23 ' HA ' ' A' ' 708' ' ' ARG . 0.0 OUTLIER -87.19 97.29 6.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.118 0.485 . . . . 0.0 110.966 -176.64 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 733' ' ' VAL . . . . . 0.594 HG21 ' HA ' ' A' ' 723' ' ' GLU . 6.1 t -77.34 135.85 25.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.556 176.134 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -143.98 135.33 25.77 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.823 0.344 . . . . 0.0 111.219 -173.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.17 112.61 1.59 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.937 176.536 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 736' ' ' TYR . . . . . 0.463 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 66.7 t80 -90.24 99.33 12.37 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.984 -176.889 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.23 -51.21 3.29 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 173.167 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -160.41 75.57 0.19 Allowed Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.907 -0.663 . . . . 0.0 111.91 175.33 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 739' ' ' GLN . . . . . 0.44 ' HG2' ' CZ3' ' A' ' 710' ' ' TRP . 1.2 mp0 -111.93 -161.39 0.75 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.475 0.178 . . . . 0.0 110.74 -178.24 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -104.48 136.54 19.16 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.364 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 741' ' ' PRO . . . . . 0.433 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 64.8 Cg_endo -84.04 123.35 3.12 Favored 'Trans proline' 0 N--CA 1.454 -0.845 0 C-N-CA 122.473 2.115 . . . . 0.0 111.894 176.421 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 742' ' ' THR . . . . . 0.624 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.1 OUTLIER -96.77 140.64 22.24 Favored Pre-proline 0 C--N 1.316 -0.889 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.863 176.886 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 743' ' ' PRO . . . . . 0.624 ' HD2' HG22 ' A' ' 742' ' ' THR . 28.3 Cg_endo -61.87 -13.67 32.19 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 123.171 2.581 . . . . 0.0 113.306 -173.818 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 744' ' ' GLU . . . . . 0.551 ' HG2' ' H ' ' A' ' 819' ' ' VAL . 0.0 OUTLIER -116.36 5.87 13.6 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.031 178.888 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -102.09 153.78 19.6 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 120.979 0.419 . . . . 0.0 110.458 -177.564 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 746' ' ' VAL . . . . . 0.882 HG21 HD11 ' A' ' 795' ' ' LEU . 26.9 m -117.49 147.98 20.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 121.323 0.583 . . . . 0.0 111.927 -175.085 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 747' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -106.53 125.5 51.08 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.861 175.833 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 748' ' ' ILE . . . . . 0.524 HG21 HD13 ' A' ' 722' ' ' LEU . 2.5 mm -113.97 107.11 22.08 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 175.456 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 1.8 t -118.1 153.26 34.07 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.73 -0.214 . . . . 0.0 110.747 -176.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 750' ' ' ASP . . . . . 0.78 ' HB3' HG13 ' A' ' 713' ' ' VAL . 1.6 p-10 -100.9 146.76 26.94 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.587 -0.279 . . . . 0.0 110.475 175.146 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 61.88 -170.88 0.16 Allowed 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.768 178.263 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 752' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 769' ' ' HIS . 9.7 t -82.44 126.65 40.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.161 177.081 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 5.4 m -132.36 157.53 43.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.059 -179.599 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.57 76.09 10.21 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.911 0.386 . . . . 0.0 110.168 176.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.5 149.58 36.17 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.005 -177.696 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 11.6 tptt -121.55 -36.13 3.11 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.595 175.076 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 757' ' ' TRP . . . . . 0.433 ' CH2' ' HA ' ' A' ' 741' ' ' PRO . 68.0 t-105 69.27 95.89 0.07 Allowed 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.342 176.661 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -83.96 51.12 1.97 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.255 0.55 . . . . 0.0 110.402 177.681 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 759' ' ' GLY . . . . . . . . . . . . . . . -121.26 -135.07 4.72 Favored Glycine 0 N--CA 1.444 -0.778 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.667 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 3.3 ttt-85 -81.58 -60.94 2.08 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.94 0.4 . . . . 0.0 111.24 178.006 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -158.31 148.34 19.93 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.947 -176.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 4.5 p -117.9 127.47 75.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-O 121.41 0.624 . . . . 0.0 110.234 176.431 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 763' ' ' VAL . . . . . 0.562 HG11 HD21 ' A' ' 791' ' ' LEU . 46.2 t -111.27 122.23 65.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.761 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.722 177.443 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 764' ' ' THR . . . . . . . . . . . . . 3.9 m -107.7 116.54 32.13 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.436 -176.189 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 765' ' ' PHE . . . . . 0.653 ' HE1' HG23 ' A' ' 785' ' ' VAL . 12.3 m-85 -90.24 83.86 6.02 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.609 174.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -96.38 131.34 43.03 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 -177.431 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.25 -30.24 5.66 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.886 0.374 . . . . 0.0 110.787 -175.576 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 13.2 mmm180 -102.09 -59.02 1.77 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.928 -179.078 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 769' ' ' HIS . . . . . 0.411 ' O ' HG23 ' A' ' 752' ' ' VAL . 0.6 OUTLIER -116.56 133.35 56.12 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.87 -176.818 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 3.2 mp -117.71 91.27 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 121.203 0.525 . . . . 0.0 109.739 176.646 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -135.02 11.56 4.47 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.03 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 772' ' ' ILE . . . . . 0.653 HG12 ' HD2' ' A' ' 773' ' ' PRO . 0.1 OUTLIER -96.49 152.56 38.72 Favored Pre-proline 0 C--N 1.324 -0.521 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 -178.536 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 773' ' ' PRO . . . . . 0.653 ' HD2' HG12 ' A' ' 772' ' ' ILE . 84.7 Cg_exo -49.63 118.62 3.89 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 123.105 2.537 . . . . 0.0 113.005 178.521 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 774' ' ' LEU . . . . . 0.544 ' HB2' HG22 ' A' ' 782' ' ' VAL . 0.6 OUTLIER -98.19 -168.22 1.62 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.534 178.98 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 775' ' ' GLU . . . . . 0.569 ' HG3' ' HA ' ' A' ' 781' ' ' TRP . 1.3 mp0 -63.96 72.99 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 121.793 0.806 . . . . 0.0 112.874 178.339 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -129.62 6.09 5.16 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 114.751 -1.113 . . . . 0.0 108.532 169.199 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 777' ' ' ALA . . . . . 0.477 ' HB1' ' HD2' ' A' ' 778' ' ' PRO . . . -139.96 162.99 47.43 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 114.296 -1.32 . . . . 0.0 108.751 179.338 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 778' ' ' PRO . . . . . 0.477 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 88.0 Cg_endo -80.13 36.11 0.6 Allowed 'Trans proline' 0 CA--C 1.53 0.323 0 C-N-CA 122.414 2.076 . . . . 0.0 113.255 -175.117 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 177.32 31.53 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.246 -0.978 . . . . 0.0 112.72 -179.359 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 780' ' ' GLU . . . . . 0.49 ' HG2' ' HB2' ' A' ' 773' ' ' PRO . 0.9 OUTLIER -137.68 123.37 19.86 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 179.798 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 781' ' ' TRP . . . . . 0.569 ' HA ' ' HG3' ' A' ' 775' ' ' GLU . 25.2 m95 -137.55 143.86 41.79 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 123.188 0.305 . . . . 0.0 110.243 -177.336 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 782' ' ' VAL . . . . . 0.544 HG22 ' HB2' ' A' ' 774' ' ' LEU . 35.7 m -126.34 146.96 31.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 120.872 0.367 . . . . 0.0 110.516 171.802 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 783' ' ' HIS . . . . . 0.462 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 2.1 t-160 -160.64 138.73 9.79 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.828 0.347 . . . . 0.0 110.71 175.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 1.7 m -105.33 100.64 10.22 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.579 174.822 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 785' ' ' VAL . . . . . 0.653 HG23 ' HE1' ' A' ' 765' ' ' PHE . 0.0 OUTLIER -165.93 -176.76 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 178.323 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -111.66 31.65 6.01 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.867 0.365 . . . . 0.0 110.212 176.178 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 55.01 67.93 2.89 Favored Pre-proline 0 N--CA 1.467 0.383 0 CA-C-N 115.084 -0.962 . . . . 0.0 112.441 178.085 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 788' ' ' PRO . . . . . 0.564 ' HD2' ' OE1' ' A' ' 790' ' ' GLU . 16.9 Cg_exo -67.29 -66.21 0.04 OUTLIER 'Trans proline' 0 CA--C 1.529 0.255 0 C-N-CA 122.461 2.108 . . . . 0.0 111.955 179.096 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -170.39 24.32 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.937 0.399 . . . . 0.0 111.403 179.721 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 790' ' ' GLU . . . . . 0.564 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -104.45 -48.38 3.84 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.952 0.406 . . . . 0.0 110.212 -178.983 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 791' ' ' LEU . . . . . 0.562 HD21 HG11 ' A' ' 763' ' ' VAL . 0.4 OUTLIER -67.34 -47.54 48.6 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.622 179.794 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 792' ' ' PRO . . . . . 0.52 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 9.6 Cg_endo -57.98 -27.3 78.63 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 121.698 1.599 . . . . 0.0 111.952 175.192 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -76.19 -44.05 39.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.792 0.329 . . . . 0.0 110.599 177.718 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -60.54 -42.69 97.02 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 121.166 0.507 . . . . 0.0 110.136 176.053 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 795' ' ' LEU . . . . . 0.882 HD11 HG21 ' A' ' 746' ' ' VAL . 0.2 OUTLIER -63.87 -39.06 93.32 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.602 179.343 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 796' ' ' ALA . . . . . 0.563 ' HA ' HD12 ' A' ' 801' ' ' ILE . . . -61.41 -47.3 86.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.362 175.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 797' ' ' ARG . . . . . 0.419 ' CZ ' ' HB2' ' A' ' 797' ' ' ARG . 0.0 OUTLIER -59.43 -41.92 90.68 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.058 179.375 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -75.56 -17.72 15.75 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.709 -177.361 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 2.3 m-30 -103.6 9.8 37.23 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.677 0.275 . . . . 0.0 110.66 178.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 95.4 mt 62.28 32.13 17.2 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.452 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 801' ' ' ILE . . . . . 0.563 HD12 ' HA ' ' A' ' 796' ' ' ALA . 59.8 mt -89.78 96.76 6.44 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.661 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 176.671 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -72.27 84.11 1.05 Allowed 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.406 -179.144 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 803' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.79 -0.86 11.66 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.235 -178.756 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 804' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -71.03 126.39 29.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.746 0.308 . . . . 0.0 110.301 178.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.46 -55.37 6.43 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.121 0.486 . . . . 0.0 110.314 178.875 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -158.95 -36.31 0.06 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.671 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -44.75 113.09 1.63 Allowed Pre-proline 0 N--CA 1.465 0.323 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.622 177.611 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 808' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -77.68 58.68 6.5 Favored 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 123.454 2.77 . . . . 0.0 112.125 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -66.95 99.17 0.61 Allowed 'General case' 0 C--O 1.237 0.397 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.929 175.678 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -158.22 168.57 26.69 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.015 -175.1 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -145.99 -56.56 0.29 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.397 176.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 2.6 mt -130.49 116.95 17.51 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.321 174.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -63.35 89.7 0.14 Allowed 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.988 2.458 . . . . 0.0 112.176 -178.35 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 2.9 m -102.75 115.17 30.06 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.738 -179.276 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -124.08 94.06 4.11 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.047 178.731 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 816' ' ' ASP . . . . . 0.445 ' HB2' ' H ' ' A' ' 817' ' ' LYS . 1.0 OUTLIER -104.21 -140.04 0.36 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.736 -178.303 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 817' ' ' LYS . . . . . 0.445 ' H ' ' HB2' ' A' ' 816' ' ' ASP . 5.1 mptt -135.34 159.86 40.22 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 -175.881 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -150.03 152.66 35.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.722 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 819' ' ' VAL . . . . . 0.551 ' H ' ' HG2' ' A' ' 744' ' ' GLU . 1.0 OUTLIER -131.65 176.14 9.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 179.832 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 820' ' ' SER . . . . . 0.484 ' H ' HG22 ' A' ' 819' ' ' VAL . 0.0 OUTLIER -120.33 165.63 14.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.693 0.282 . . . . 0.0 110.812 179.965 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 48.3 t0 -73.62 159.32 33.25 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.412 178.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -78.46 -68.5 0.64 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.343 -178.507 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -159.83 154.69 24.54 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.27 176.577 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -130.03 77.56 1.79 Allowed 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.072 0.463 . . . . 0.0 110.357 -171.744 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 825' ' ' MET . . . . . 0.438 ' HA ' ' OD2' ' A' ' 870' ' ' ASP . 0.0 OUTLIER -105.26 139.73 39.47 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.516 -179.852 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 826' ' ' MET . . . . . 0.68 ' HB2' ' HA ' ' A' ' 869' ' ' ILE . 0.0 OUTLIER -123.31 135.51 54.24 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.904 0.383 . . . . 0.0 110.75 177.574 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 827' ' ' ILE . . . . . 0.885 ' HB ' HD21 ' A' ' 844' ' ' LEU . 2.3 mm -120.02 120.34 62.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 176.781 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 828' ' ' LEU . . . . . 0.487 ' HB2' HG21 ' A' ' 869' ' ' ILE . 0.9 OUTLIER -105.2 123.48 47.91 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.78 0.324 . . . . 0.0 110.705 -178.759 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 829' ' ' VAL . . . . . 0.603 HG21 HD12 ' A' ' 840' ' ' LEU . 1.0 OUTLIER -102.29 118.81 49.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.092 0.472 . . . . 0.0 110.441 177.332 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 830' ' ' VAL . . . . . 0.485 HG11 ' HB2' ' A' ' 860' ' ' ALA . 0.2 OUTLIER -109.22 86.98 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.75 177.594 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 831' ' ' ASP . . . . . 0.696 ' HA ' ' O ' ' A' ' 875' ' ' ASP . 0.1 OUTLIER -106.7 147.47 29.55 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.873 0.368 . . . . 0.0 110.883 -176.101 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -89.24 -25.64 21.62 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -175.743 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 833' ' ' HIS . . . . . 0.447 ' HA ' ' HD2' ' A' ' 834' ' ' PRO . 0.6 OUTLIER -114.71 106.21 52.39 Favored Pre-proline 0 N--CA 1.464 0.275 0 O-C-N 121.941 -0.475 . . . . 0.0 111.681 -174.167 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 834' ' ' PRO . . . . . 0.447 ' HD2' ' HA ' ' A' ' 833' ' ' HIS . 1.7 Cg_endo -40.75 -47.07 4.75 Favored 'Trans proline' 0 C--N 1.349 0.555 1 C-N-CA 125.319 4.013 . . . . 0.0 115.604 -169.59 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 1.1 pp -59.32 -38.78 76.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 CA-C-O 121.243 0.544 . . . . 0.0 111.164 -176.335 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 836' ' ' ASN . . . . . 0.575 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 3.2 m-80 -68.63 -46.46 69.18 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.669 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 837' ' ' ARG . . . . . 0.557 ' HB2' ' OD2' ' A' ' 831' ' ' ASP . 0.0 OUTLIER -52.49 -45.73 66.31 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.495 178.262 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -59.06 -41.81 88.83 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.166 -179.563 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.02 -53.55 25.02 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -176.484 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 840' ' ' LEU . . . . . 0.603 HD12 HG21 ' A' ' 829' ' ' VAL . 0.0 OUTLIER -73.78 -27.95 61.41 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.583 -175.824 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -69.45 -29.9 67.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.963 0.411 . . . . 0.0 110.091 177.076 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -69.49 -41.16 76.49 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.961 175.241 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 843' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -62.84 -39.15 93.47 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.849 176.129 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 844' ' ' LEU . . . . . 0.885 HD21 ' HB ' ' A' ' 827' ' ' ILE . 0.0 OUTLIER -63.61 -31.31 72.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.636 174.957 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -69.78 -27.35 73.33 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.154 176.424 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.06 -45.64 17.94 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.653 0.263 . . . . 0.0 110.683 177.876 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -152.77 84.5 1.23 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.122 0.487 . . . . 0.0 110.345 176.732 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . -155.03 23.57 0.6 Allowed Glycine 0 N--CA 1.443 -0.835 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.029 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 11.2 m-85 55.52 -128.06 2.12 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.67 108.42 18.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.801 0.334 . . . . 0.0 110.225 176.58 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -80.97 125.97 30.8 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.597 -177.526 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 852' ' ' LYS . . . . . 0.432 ' HB3' HD12 ' A' ' 828' ' ' LEU . 0.0 OUTLIER -122.42 146.75 47.07 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 174.827 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -131.51 142.81 50.03 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -173.687 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 854' ' ' ALA . . . . . 0.464 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -156.46 165.48 36.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.011 175.612 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 855' ' ' ASN . . . . . 0.434 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 0.9 OUTLIER -148.76 74.04 1.25 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.887 0.375 . . . . 0.0 111.23 176.598 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 856' ' ' ASP . . . . . 0.478 ' OD1' HG23 ' A' ' 858' ' ' VAL . 7.1 t70 172.73 145.27 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.916 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -66.0 -39.5 94.84 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.034 177.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 858' ' ' VAL . . . . . 0.478 HG23 ' OD1' ' A' ' 856' ' ' ASP . 1.5 t -73.53 -32.28 35.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 O-C-N 122.713 -0.287 . . . . 0.0 110.87 -178.737 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -70.52 -34.02 71.82 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.005 0.431 . . . . 0.0 110.271 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 860' ' ' ALA . . . . . 0.485 ' HB2' HG11 ' A' ' 830' ' ' VAL . . . -64.72 -37.42 87.52 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.192 176.117 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 861' ' ' LEU . . . . . . . . . . . . . 1.4 mt -71.18 -35.31 71.54 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.42 176.607 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 40.8 t30 -65.8 -49.81 66.93 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.105 -179.474 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 10.7 p -64.93 -32.26 57.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.361 178.664 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 864' ' ' LEU . . . . . 0.515 HD21 HD22 ' A' ' 897' ' ' LEU . 0.5 OUTLIER -64.59 -42.75 95.39 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.624 175.642 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 16.5 m -69.08 -22.19 64.02 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.859 -179.26 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -79.16 -27.77 42.72 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.924 175.419 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 19.4 t30 62.61 94.66 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.133 -0.94 . . . . 0.0 112.644 175.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -171.18 53.08 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.251 170.771 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 869' ' ' ILE . . . . . 0.68 ' HA ' ' HB2' ' A' ' 826' ' ' MET . 0.1 OUTLIER -152.11 154.66 7.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.525 179.316 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 870' ' ' ASP . . . . . 0.438 ' OD2' ' HA ' ' A' ' 825' ' ' MET . 13.7 m-20 -112.11 -49.46 2.97 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.568 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 871' ' ' ILE . . . . . . . . . . . . . 41.8 mm -118.62 133.86 64.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.023 177.789 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 872' ' ' VAL . . . . . 0.696 HG23 HD11 ' A' ' 897' ' ' LEU . 13.5 t -116.72 128.48 74.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.954 -0.388 . . . . 0.0 109.954 177.034 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 873' ' ' LEU . . . . . 0.413 HD12 ' HB ' ' A' ' 829' ' ' VAL . 0.2 OUTLIER -109.74 113.24 25.84 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.875 0.369 . . . . 0.0 110.686 179.835 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.81 96.32 9.71 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 175.408 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 875' ' ' ASP . . . . . 0.726 ' CG ' ' HZ3' ' A' ' 925' ' ' LYS . 48.0 t0 -105.83 117.9 35.21 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.005 -173.376 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 2.4 t -141.58 133.31 27.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.114 0.483 . . . . 0.0 111.517 -175.019 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 877' ' ' ASN . . . . . 0.459 ' HB2' ' CE ' ' A' ' 925' ' ' LYS . 40.4 t-20 -127.47 54.77 1.65 Allowed 'General case' 0 C--O 1.234 0.273 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 171.92 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -163.26 108.18 0.99 Allowed Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.915 -179.535 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 879' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -59.55 109.17 0.53 Allowed 'Trans proline' 0 C--O 1.231 0.144 0 C-N-CA 122.496 2.131 . . . . 0.0 111.406 176.652 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -146.09 169.94 17.67 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.031 -174.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 42.9 mtp -62.78 -34.31 77.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.545 178.631 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 882' ' ' ASP . . . . . 0.51 ' OD1' ' HB3' ' A' ' 885' ' ' ARG . 24.3 t0 -85.44 61.83 7.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.408 0.623 . . . . 0.0 111.233 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -123.2 22.84 7.01 Favored Glycine 0 N--CA 1.447 -0.614 0 N-CA-C 110.264 -1.134 . . . . 0.0 110.264 172.064 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -177.66 -24.05 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -173.212 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 885' ' ' ARG . . . . . 0.51 ' HB3' ' OD1' ' A' ' 882' ' ' ASP . 2.1 tmm_? -55.2 -49.6 71.53 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.989 -178.602 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 886' ' ' LEU . . . . . 0.515 ' HG ' ' N ' ' A' ' 887' ' ' THR . 0.2 OUTLIER -65.51 -34.22 77.75 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.359 -177.652 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 887' ' ' THR . . . . . 0.833 HG21 ' HG2' ' A' ' 919' ' ' MET . 0.0 OUTLIER -75.81 -33.33 60.1 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-O 120.742 0.306 . . . . 0.0 111.502 -178.413 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -57.26 -41.81 80.35 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 173.636 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.07 -33.53 72.04 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.2 177.344 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 890' ' ' ILE . . . . . 0.578 HG22 ' O ' ' A' ' 887' ' ' THR . 1.5 tp -68.09 -36.97 77.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 N-CA-C 111.798 0.295 . . . . 0.0 111.798 -177.654 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 891' ' ' ARG . . . . . 0.602 ' HA ' HD23 ' A' ' 895' ' ' LEU . 1.9 ptm180 -75.39 -28.58 59.52 Favored 'General case' 0 N--CA 1.46 0.067 0 C-N-CA 120.289 -0.564 . . . . 0.0 110.459 177.605 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -69.99 -34.61 73.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.061 0.458 . . . . 0.0 110.797 175.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 893' ' ' LEU . . . . . 0.488 HD23 ' HA ' ' A' ' 893' ' ' LEU . 2.7 mt -74.64 -45.72 42.91 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.808 179.423 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 122.61 70.23 0.25 Allowed Glycine 0 N--CA 1.448 -0.513 0 N-CA-C 111.386 -0.685 . . . . 0.0 111.386 -178.735 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 895' ' ' LEU . . . . . 0.602 HD23 ' HA ' ' A' ' 891' ' ' ARG . 0.6 OUTLIER -64.45 117.36 7.19 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.393 0.616 . . . . 0.0 110.843 -176.883 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.57 0.5 24.58 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.26 -178.257 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 897' ' ' LEU . . . . . 0.696 HD11 HG23 ' A' ' 872' ' ' VAL . 1.0 OUTLIER -126.81 154.02 75.98 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.788 -175.595 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -73.09 127.79 12.41 Favored 'Trans proline' 0 C--O 1.239 0.533 0 C-N-CA 123.084 2.522 . . . . 0.0 112.326 179.175 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 899' ' ' VAL . . . . . 0.812 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 3.2 t -108.42 116.07 50.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.365 178.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 900' ' ' ILE . . . . . 0.421 ' CG2' ' HG ' ' A' ' 923' ' ' LEU . 42.0 mt -95.09 106.67 18.48 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.887 178.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -86.94 93.32 1.87 Allowed Glycine 0 N--CA 1.445 -0.762 0 C-N-CA 120.867 -0.682 . . . . 0.0 112.341 -177.705 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 902' ' ' VAL . . . . . 0.617 ' O ' ' HA ' ' A' ' 875' ' ' ASP . 0.2 OUTLIER -91.0 108.76 20.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-O 121.663 0.744 . . . . 0.0 109.603 178.007 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -126.33 152.86 45.66 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.919 -179.014 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -71.23 105.39 3.42 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 168.742 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -48.31 110.76 0.37 Allowed 'General case' 0 CA--C 1.515 -0.376 0 O-C-N 124.073 0.858 . . . . 0.0 110.96 -171.606 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -85.52 -56.96 3.26 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.199 -175.325 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -166.84 -50.04 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 178.054 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -134.48 42.65 2.84 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.012 0.434 . . . . 0.0 111.335 -174.023 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.03 -31.72 72.44 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.394 -178.483 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 910' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -39.65 94.96 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.163 176.375 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.47 -36.61 79.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.109 178.293 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -60.39 -47.9 84.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.169 176.609 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.85 -43.77 90.86 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.147 179.761 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 75.6 m -63.99 -32.5 74.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.807 0.337 . . . . 0.0 110.794 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 2.5 tp -70.59 -51.57 27.42 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.454 -179.128 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.54 -44.08 45.38 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.708 -175.392 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 51.19 42.48 28.86 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.208 0.528 . . . . 0.0 111.143 -176.226 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -119.59 -25.75 2.55 Favored Glycine 0 N--CA 1.447 -0.629 0 CA-C-N 115.716 -0.674 . . . . 0.0 112.225 -177.423 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 919' ' ' MET . . . . . 0.833 ' HG2' HG21 ' A' ' 887' ' ' THR . 2.1 mtt -78.41 -102.83 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.774 0.321 . . . . 0.0 110.158 177.12 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 920' ' ' ASP . . . . . 0.498 ' HB2' ' O ' ' A' ' 919' ' ' MET . 19.6 t70 170.3 -65.31 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 123.699 0.8 . . . . 0.0 109.772 175.196 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -113.26 158.32 20.66 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.802 -177.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 922' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -116.72 118.99 34.08 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 175.553 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 923' ' ' LEU . . . . . 0.421 ' HG ' ' CG2' ' A' ' 900' ' ' ILE . 0.3 OUTLIER -116.02 161.23 19.17 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.119 -178.858 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 2.6 m -102.15 137.62 40.17 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.313 178.215 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 925' ' ' LYS . . . . . 0.726 ' HZ3' ' CG ' ' A' ' 875' ' ' ASP . 0.0 OUTLIER -52.0 -41.46 79.86 Favored Pre-proline 0 CA--C 1.541 0.597 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 177.726 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -67.78 65.94 0.88 Allowed 'Trans proline' 0 C--N 1.357 1.004 0 C-N-CA 121.975 1.783 . . . . 0.0 112.417 171.643 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 5.3 p -99.19 145.65 9.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.139 179.053 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 34.0 p -102.91 174.06 6.04 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.586 0.231 . . . . 0.0 110.441 179.227 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 929' ' ' LEU . . . . . 0.429 HD23 ' HA ' ' A' ' 929' ' ' LEU . 0.0 OUTLIER -60.85 -34.74 75.06 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 175.141 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -74.45 -45.62 45.17 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.209 -177.69 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 79.0 t -67.4 -38.99 81.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 120.905 0.383 . . . . 0.0 110.735 -179.153 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 932' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -63.47 -37.59 79.96 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 175.583 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 20.2 ttmt -63.66 -48.38 77.43 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.579 177.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -55.04 -54.97 36.2 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.346 178.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 1.5 m -62.11 -46.29 89.69 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.725 -176.65 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 936' ' ' LEU . . . . . 0.4 ' HA ' HD12 ' A' ' 936' ' ' LEU . 0.9 OUTLIER -62.7 -44.51 96.06 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.61 -0.268 . . . . 0.0 110.797 -179.507 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 56.1 m -64.33 -48.24 76.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.307 -179.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 3.1 tp -63.1 -37.38 86.97 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.433 -176.883 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -79.43 -34.2 41.87 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.779 -0.368 . . . . 0.0 111.034 -179.186 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 940' ' ' ALA . . . . . 0.454 ' O ' ' HB2' ' A' ' 944' ' ' ARG . . . -66.43 -38.85 88.35 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.841 178.085 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 941' ' ' GLU . . . . . 0.532 ' HG3' ' N ' ' A' ' 942' ' ' ARG . 0.0 OUTLIER -70.3 -33.82 72.0 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 177.001 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 942' ' ' ARG . . . . . 0.532 ' N ' ' HG3' ' A' ' 941' ' ' GLU . 1.6 tpm_? -64.84 -48.17 75.31 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.85 179.565 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 31.4 m -69.2 -29.57 43.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 178.118 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 944' ' ' ARG . . . . . 0.454 ' HB2' ' O ' ' A' ' 940' ' ' ALA . 0.0 OUTLIER -64.58 -35.13 79.98 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.78 176.814 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 945' ' ' LYS . . . . . 0.402 ' HG2' ' O ' ' A' ' 941' ' ' GLU . 1.1 mmtp -65.08 -42.34 94.22 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.296 0.57 . . . . 0.0 110.362 176.565 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 5.0 m -72.18 -17.68 61.92 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.297 179.069 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.4 -61.15 1.76 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.863 0.364 . . . . 0.0 110.972 -179.497 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -111.89 68.91 0.68 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.055 -177.469 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.758 -0.639 . . . . 0.0 110.787 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 0.992 0 CA-C-O 120.65 0.262 . . . . 0.0 110.341 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . -104.24 166.51 15.37 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.203 -179.273 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . -87.39 98.41 2.38 Favored Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 121.011 -0.614 . . . . 0.0 111.689 179.602 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -93.54 73.12 4.4 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.885 0.374 . . . . 0.0 111.17 -176.375 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . 172.91 120.5 0.57 Allowed Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.542 -0.837 . . . . 0.0 112.707 178.524 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 21.4 t -125.33 -47.22 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 177.278 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 62.39 -162.47 0.28 Allowed 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.837 177.625 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . 161.63 139.6 2.68 Favored Glycine 0 N--CA 1.45 -0.399 0 N-CA-C 111.084 -0.807 . . . . 0.0 111.084 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.519 HD13 HD13 ' A' ' 801' ' ' ILE . 0.1 OUTLIER -100.9 53.57 0.85 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.524 0.678 . . . . 0.0 111.565 -174.654 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -114.25 122.99 48.42 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.899 174.598 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 122.85 -11.23 8.84 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.482 -179.713 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 4.1 mmtt -74.41 147.0 42.46 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 178.085 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 708' ' ' ARG . . . . . 0.471 ' HA ' HG23 ' A' ' 732' ' ' VAL . 2.7 mtm180 -102.81 156.47 17.63 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.078 0.466 . . . . 0.0 111.754 -172.128 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 709' ' ' CYS . . . . . 0.431 ' SG ' ' HE2' ' A' ' 799' ' ' TYR . 1.0 OUTLIER -142.37 115.04 8.58 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.973 174.794 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 710' ' ' TRP . . . . . 0.491 ' CZ3' ' HB ' ' A' ' 734' ' ' THR . 91.1 m95 -91.41 118.12 30.27 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 -178.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 711' ' ' LEU . . . . . 0.573 HD22 HG12 ' A' ' 733' ' ' VAL . 1.9 pt? -118.72 127.61 53.72 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.496 0.665 . . . . 0.0 111.605 -177.423 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -127.05 58.73 1.43 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.541 175.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 713' ' ' VAL . . . . . 0.801 HG13 ' HB2' ' A' ' 750' ' ' ASP . 21.2 t -96.93 121.42 47.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.628 -179.547 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 714' ' ' ARG . . . . . 0.603 ' H ' ' HB3' ' A' ' 750' ' ' ASP . 38.0 mtp85 -66.96 -46.86 73.39 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.193 -175.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 715' ' ' ASN . . . . . 0.487 ' O ' ' HB2' ' A' ' 719' ' ' CYS . 7.6 p30 -78.96 133.39 36.88 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.236 179.131 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -77.69 -17.39 57.7 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.529 -175.093 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.43 -56.58 19.64 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.098 0.475 . . . . 0.0 110.182 178.382 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 718' ' ' LEU . . . . . 0.557 ' HB3' HG11 ' A' ' 713' ' ' VAL . 0.6 OUTLIER -72.58 -39.47 67.37 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.552 178.579 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 719' ' ' CYS . . . . . 0.734 ' SG ' ' HB ' ' A' ' 713' ' ' VAL . 0.1 OUTLIER -55.48 -52.64 62.97 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.12 -178.905 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 720' ' ' GLN . . . . . 0.525 ' O ' ' HG2' ' A' ' 723' ' ' GLU . 0.6 OUTLIER -67.85 -42.85 80.75 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.392 -177.705 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 721' ' ' PHE . . . . . 0.462 ' HE2' ' HG3' ' A' ' 792' ' ' PRO . 57.2 t80 -58.18 -54.76 43.31 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.734 0.302 . . . . 0.0 110.738 -179.476 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 722' ' ' LEU . . . . . 0.443 HD21 HD12 ' A' ' 791' ' ' LEU . 0.7 OUTLIER -60.09 -44.36 94.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.892 -177.72 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 723' ' ' GLU . . . . . 0.525 ' HG2' ' O ' ' A' ' 720' ' ' GLN . 6.3 pt-20 -62.64 -36.3 82.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.881 -178.233 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 724' ' ' THR . . . . . . . . . . . . . 87.8 m -65.12 -44.56 88.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.178 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.98 -37.66 85.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.987 0.422 . . . . 0.0 111.173 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 726' ' ' LEU . . . . . 0.5 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 23.7 mt -74.49 -48.09 29.34 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.988 -177.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.71 -5.74 44.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.733 -177.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.13 -27.65 59.87 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 175.424 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 729' ' ' SER . . . . . 0.445 ' HB2' ' H ' ' A' ' 730' ' ' GLY . 0.3 OUTLIER -90.03 -104.15 0.09 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.897 175.796 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 730' ' ' GLY . . . . . 0.445 ' H ' ' HB2' ' A' ' 729' ' ' SER . . . -148.26 31.24 1.3 Allowed Glycine 0 N--CA 1.446 -0.691 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 175.216 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 731' ' ' ILE . . . . . 0.5 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 15.3 mm -95.77 126.0 48.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.736 0.303 . . . . 0.0 110.369 -177.307 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 732' ' ' VAL . . . . . 0.471 HG23 ' HA ' ' A' ' 708' ' ' ARG . 0.0 OUTLIER -85.86 98.53 6.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 121.275 0.559 . . . . 0.0 110.553 179.629 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 733' ' ' VAL . . . . . 0.573 HG12 HD22 ' A' ' 711' ' ' LEU . 0.1 OUTLIER -71.59 113.33 8.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.159 177.867 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 734' ' ' THR . . . . . 0.491 ' HB ' ' CZ3' ' A' ' 710' ' ' TRP . 0.2 OUTLIER -118.46 127.03 53.26 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.19 0.519 . . . . 0.0 110.824 -178.408 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -55.66 124.61 17.97 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.972 174.889 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 736' ' ' TYR . . . . . 0.663 ' HE2' ' HD3' ' A' ' 755' ' ' LYS . 9.4 t80 -81.19 70.07 7.95 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.622 0.725 . . . . 0.0 109.846 177.063 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 737' ' ' GLU . . . . . 0.482 ' HG3' ' H ' ' A' ' 737' ' ' GLU . 3.5 mt-10 -75.51 -25.04 56.91 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.788 -177.667 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 154.3 60.9 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.344 0 N-CA-C 111.431 -0.668 . . . . 0.0 111.431 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 26.7 mp0 -112.55 -178.84 3.5 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.77 0.319 . . . . 0.0 110.89 -175.646 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 740' ' ' GLU . . . . . 0.432 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 0.0 OUTLIER -81.6 143.99 51.96 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.941 -177.497 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 741' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 740' ' ' GLU . 1.3 Cg_endo -82.32 123.17 3.84 Favored 'Trans proline' 0 N--CA 1.452 -0.925 0 C-N-CA 122.644 2.229 . . . . 0.0 111.701 175.837 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 742' ' ' THR . . . . . 0.419 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.1 OUTLIER -110.73 136.18 20.71 Favored Pre-proline 0 C--N 1.32 -0.703 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.755 178.966 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 743' ' ' PRO . . . . . 0.419 ' HD2' HG22 ' A' ' 742' ' ' THR . 37.8 Cg_endo -66.5 -1.91 6.46 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 123.053 2.502 . . . . 0.0 112.883 -179.279 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.27 -9.63 18.44 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.498 178.279 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -109.27 152.18 25.56 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.415 -0.812 . . . . 0.0 111.204 -170.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 16.2 m -116.68 147.85 19.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.429 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 747' ' ' LEU . . . . . 0.665 HD22 HG23 ' A' ' 749' ' ' THR . 0.4 OUTLIER -108.14 135.22 49.85 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.001 177.813 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 1.7 mt -117.77 118.09 57.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 173.531 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 749' ' ' THR . . . . . 0.665 HG23 HD22 ' A' ' 747' ' ' LEU . 2.5 p -125.18 150.19 47.19 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -167.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 750' ' ' ASP . . . . . 0.801 ' HB2' HG13 ' A' ' 713' ' ' VAL . 34.8 t0 -113.54 116.59 29.78 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.773 175.005 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 751' ' ' GLU . . . . . 0.678 ' HG3' ' H ' ' A' ' 752' ' ' VAL . 1.8 tp10 68.17 -177.85 0.21 Allowed 'General case' 0 CA--C 1.536 0.432 0 O-C-N 123.868 0.73 . . . . 0.0 111.063 -177.173 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 752' ' ' VAL . . . . . 0.678 ' H ' ' HG3' ' A' ' 751' ' ' GLU . 15.2 t -75.19 100.2 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.298 -176.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 753' ' ' VAL . . . . . 0.422 HG21 HG21 ' A' ' 749' ' ' THR . 19.5 m -90.33 -0.29 8.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.483 176.38 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 58.31 41.35 23.38 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.351 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 755' ' ' LYS . . . . . 0.663 ' HD3' ' HE2' ' A' ' 736' ' ' TYR . 0.1 OUTLIER -120.03 126.97 52.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.318 180.0 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 2.1 tmtm? -81.43 -42.27 20.63 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.06 -179.57 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 76.0 t-105 62.46 90.44 0.07 Allowed 'General case' 0 CA--C 1.53 0.21 0 O-C-N 123.71 0.631 . . . . 0.0 111.657 179.388 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -83.23 58.82 4.66 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.148 0.499 . . . . 0.0 109.822 175.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 759' ' ' GLY . . . . . . . . . . . . . . . -117.62 -144.28 7.68 Favored Glycine 0 N--CA 1.444 -0.791 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.901 -178.056 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 760' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 760' ' ' ARG . 0.7 OUTLIER -75.81 -53.27 8.74 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.96 0.41 . . . . 0.0 110.242 179.217 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -161.49 156.56 23.7 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.386 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 762' ' ' VAL . . . . . 0.597 HG23 ' HB3' ' A' ' 747' ' ' LEU . 3.0 p -140.75 126.87 20.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-O 121.126 0.489 . . . . 0.0 109.852 179.004 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 18.6 t -111.65 105.29 18.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.05 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 764' ' ' THR . . . . . 0.482 ' HA ' ' OG1' ' A' ' 749' ' ' THR . 33.4 m -97.66 119.68 36.66 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.219 0.533 . . . . 0.0 110.607 178.749 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 765' ' ' PHE . . . . . 0.757 ' HZ ' ' HG ' ' A' ' 791' ' ' LEU . 33.0 m-85 -76.98 123.88 26.97 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.633 175.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 766' ' ' CYS . . . . . 0.494 ' SG ' ' HB ' ' A' ' 782' ' ' VAL . 0.0 OUTLIER -95.58 131.64 41.57 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 176.925 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.72 -69.34 0.74 Allowed 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.902 0.382 . . . . 0.0 110.672 -177.034 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 768' ' ' ARG . . . . . 0.439 ' HA ' ' HD2' ' A' ' 768' ' ' ARG . 0.0 OUTLIER -118.69 -30.09 5.21 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.261 -177.988 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -114.77 134.06 55.41 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.312 0.577 . . . . 0.0 110.965 -178.568 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 2.7 mp -97.51 156.28 3.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 173.131 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . 175.45 -43.37 0.12 Allowed Glycine 0 CA--C 1.505 -0.571 0 N-CA-C 110.612 -0.995 . . . . 0.0 110.612 -177.474 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 772' ' ' ILE . . . . . 0.456 ' HA ' ' HD3' ' A' ' 773' ' ' PRO . 17.5 mm -87.03 123.4 70.3 Favored Pre-proline 0 C--N 1.321 -0.643 0 N-CA-C 108.374 -0.972 . . . . 0.0 108.374 169.358 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 773' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' A' ' 772' ' ' ILE . 23.7 Cg_exo -62.63 -85.62 0.01 OUTLIER 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.982 2.455 . . . . 0.0 112.673 -175.371 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 774' ' ' LEU . . . . . 0.603 ' O ' ' HB3' ' A' ' 780' ' ' GLU . 0.9 OUTLIER 171.53 -155.41 0.01 OUTLIER 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 -179.901 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 775' ' ' GLU . . . . . 0.575 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 2.6 mp0 -60.3 75.13 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 122.082 0.944 . . . . 0.0 112.269 174.242 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 12.5 mmmt -119.19 -45.71 2.54 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 114.17 -1.377 . . . . 0.0 109.008 171.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 777' ' ' ALA . . . . . 0.689 ' HB1' ' HD2' ' A' ' 778' ' ' PRO . . . -91.57 165.88 19.66 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 115.333 -0.848 . . . . 0.0 110.233 179.771 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 778' ' ' PRO . . . . . 0.689 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 24.0 Cg_endo -60.91 91.81 0.1 OUTLIER 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.829 2.352 . . . . 0.0 113.18 -178.325 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 99.05 15.06 34.37 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.797 176.406 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 780' ' ' GLU . . . . . 0.603 ' HB3' ' O ' ' A' ' 774' ' ' LEU . 2.2 tt0 -84.23 122.01 28.29 Favored 'General case' 0 C--O 1.218 -0.589 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 -179.138 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 17.6 m95 -133.49 143.54 48.85 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.626 0.25 . . . . 0.0 110.344 178.874 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 782' ' ' VAL . . . . . 0.578 HG13 ' HA ' ' A' ' 774' ' ' LEU . 17.1 m -134.66 156.57 40.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 172.782 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 783' ' ' HIS . . . . . 0.466 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.1 OUTLIER -176.22 144.34 0.56 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.725 0.298 . . . . 0.0 110.896 178.228 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 4.9 m -105.74 102.77 12.19 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.354 175.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 785' ' ' VAL . . . . . 0.517 HG23 ' HE2' ' A' ' 765' ' ' PHE . 0.1 OUTLIER -150.57 155.28 7.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.67 0.271 . . . . 0.0 110.543 178.191 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -86.73 7.41 26.86 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.428 174.229 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 787' ' ' ALA . . . . . 0.469 ' H ' ' HB ' ' A' ' 785' ' ' VAL . . . 57.8 63.6 4.51 Favored Pre-proline 0 N--CA 1.464 0.251 0 CA-C-N 115.22 -0.9 . . . . 0.0 112.2 179.109 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 788' ' ' PRO . . . . . 0.42 ' HD3' ' N ' ' A' ' 787' ' ' ALA . 21.2 Cg_exo -66.58 -54.84 0.41 Allowed 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.135 1.89 . . . . 0.0 111.725 176.83 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 7.3 p-80 -161.05 -22.12 0.05 Allowed 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 176.418 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 790' ' ' GLU . . . . . 0.428 ' CD ' ' H ' ' A' ' 790' ' ' GLU . 2.0 pm0 -72.83 -38.6 67.08 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -175.454 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 791' ' ' LEU . . . . . 0.757 ' HG ' ' HZ ' ' A' ' 765' ' ' PHE . 1.2 tm? -62.21 -54.62 47.96 Favored Pre-proline 0 CA--C 1.536 0.438 0 N-CA-C 111.65 0.241 . . . . 0.0 111.65 -178.067 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 792' ' ' PRO . . . . . 0.462 ' HG3' ' HE2' ' A' ' 721' ' ' PHE . 11.2 Cg_endo -58.37 -26.6 78.17 Favored 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 121.523 1.482 . . . . 0.0 112.201 176.594 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -71.79 -40.56 69.15 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.789 176.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 794' ' ' LEU . . . . . 0.435 HD22 ' HD2' ' A' ' 797' ' ' ARG . 1.9 tm? -59.62 -47.17 86.66 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.107 0.48 . . . . 0.0 109.784 176.818 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 795' ' ' LEU . . . . . 0.496 ' HA ' ' HB ' ' A' ' 798' ' ' ILE . 0.2 OUTLIER -70.89 -29.7 65.85 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.13 -178.755 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 796' ' ' ALA . . . . . 0.447 ' HB1' ' HB ' ' A' ' 801' ' ' ILE . . . -62.67 -46.51 87.84 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 174.581 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 797' ' ' ARG . . . . . 0.435 ' HD2' HD22 ' A' ' 794' ' ' LEU . 0.1 OUTLIER -64.3 -33.51 76.0 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.06 177.054 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 798' ' ' ILE . . . . . 0.496 ' HB ' ' HA ' ' A' ' 795' ' ' LEU . 0.3 OUTLIER -62.01 -32.28 53.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.879 178.771 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 799' ' ' TYR . . . . . 0.435 ' HD1' ' HA ' ' A' ' 799' ' ' TYR . 0.6 OUTLIER -103.91 15.54 28.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.155 179.6 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 9.7 mt 61.04 41.15 14.27 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 115.878 -0.601 . . . . 0.0 112.127 176.34 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 801' ' ' ILE . . . . . 0.58 HG22 ' HG2' ' A' ' 803' ' ' MET . 2.6 mm -88.33 66.78 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.58 0.705 . . . . 0.0 109.134 176.07 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 802' ' ' GLU . . . . . 0.418 ' H ' ' HG3' ' A' ' 802' ' ' GLU . 0.2 OUTLIER -74.71 72.47 1.99 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.082 -0.963 . . . . 0.0 111.148 -175.992 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 803' ' ' MET . . . . . 0.58 ' HG2' HG22 ' A' ' 801' ' ' ILE . 12.0 ptp -134.58 33.73 3.24 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.193 0.521 . . . . 0.0 110.818 176.853 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 804' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -150.97 179.37 8.3 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.546 179.73 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 1.2 m -75.84 42.94 0.25 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.126 0.488 . . . . 0.0 111.118 177.435 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 806' ' ' ASP . . . . . 0.414 ' OD2' ' HB2' ' A' ' 797' ' ' ARG . 24.2 t70 -75.32 112.57 11.76 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.097 -0.501 . . . . 0.0 109.69 179.324 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 807' ' ' ASP . . . . . 0.498 ' HA ' ' HD3' ' A' ' 808' ' ' PRO . 0.0 OUTLIER -79.17 120.96 82.48 Favored Pre-proline 0 C--N 1.317 -0.833 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.868 -179.104 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 808' ' ' PRO . . . . . 0.498 ' HD3' ' HA ' ' A' ' 807' ' ' ASP . 13.3 Cg_exo -69.93 68.97 1.76 Allowed 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 123.323 2.682 . . . . 0.0 112.483 -177.089 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -144.98 138.14 26.59 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.563 176.712 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 2.4 t30 62.97 43.73 6.48 Favored 'General case' 0 C--N 1.33 -0.253 0 O-C-N 123.698 0.624 . . . . 0.0 110.075 -175.795 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -151.13 73.89 1.12 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.38 -178.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -80.38 115.34 54.22 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.22 178.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -74.79 140.21 25.81 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.488 2.126 . . . . 0.0 112.185 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -80.14 162.77 24.56 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.47 178.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.48 105.46 0.52 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.902 0.382 . . . . 0.0 110.999 179.024 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.31 60.06 4.84 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.183 -176.036 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.51 43.97 1.67 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.49 -179.568 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -148.63 172.89 13.82 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.994 0.426 . . . . 0.0 111.204 -178.124 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 3.7 p -127.97 158.27 39.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.293 177.297 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -88.38 -64.38 1.15 Allowed 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -175.842 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -159.6 -165.84 1.63 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.075 0.464 . . . . 0.0 111.236 -173.288 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 21.3 t30 -127.51 -43.82 1.57 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.875 177.116 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 30.3 t70 59.83 103.71 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.709 0 O-C-N 123.888 0.743 . . . . 0.0 111.107 -176.676 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 824' ' ' ASP . . . . . 0.436 ' HB3' ' H ' ' A' ' 825' ' ' MET . 0.9 OUTLIER -122.66 -123.53 0.27 Allowed 'General case' 0 N--CA 1.445 -0.686 0 CA-C-O 121.14 0.495 . . . . 0.0 111.13 -174.274 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 825' ' ' MET . . . . . 0.436 ' H ' ' HB3' ' A' ' 824' ' ' ASP . 2.7 ttm -151.53 140.86 21.44 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.004 -175.336 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 826' ' ' MET . . . . . 0.736 ' HG3' ' HA ' ' A' ' 869' ' ' ILE . 1.6 ptp -135.05 123.34 23.09 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.155 0.502 . . . . 0.0 110.841 178.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 827' ' ' ILE . . . . . 0.534 HG23 ' HB ' ' A' ' 871' ' ' ILE . 5.5 mm -108.25 140.72 25.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.816 -179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 828' ' ' LEU . . . . . 0.422 HD23 HG22 ' A' ' 872' ' ' VAL . 16.2 tp -106.55 118.33 36.39 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.139 0.495 . . . . 0.0 110.615 -178.179 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 829' ' ' VAL . . . . . 0.673 HG12 HD11 ' A' ' 873' ' ' LEU . 0.0 OUTLIER -106.27 109.88 29.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.257 -179.803 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 830' ' ' VAL . . . . . 0.487 HG22 ' HB3' ' A' ' 854' ' ' ALA . 13.4 t -109.54 100.39 10.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.232 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 831' ' ' ASP . . . . . 0.497 ' HA ' ' O ' ' A' ' 875' ' ' ASP . 7.2 t0 -112.34 149.2 32.79 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 -177.75 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -91.02 -22.13 20.93 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.841 179.76 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 833' ' ' HIS . . . . . 0.417 ' HA ' ' HD2' ' A' ' 834' ' ' PRO . 1.7 m80 -111.93 113.68 52.19 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.553 -176.053 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 834' ' ' PRO . . . . . 0.417 ' HD2' ' HA ' ' A' ' 833' ' ' HIS . 5.4 Cg_endo -48.22 -46.46 22.65 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 124.106 3.204 . . . . 0.0 114.173 -174.385 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -56.35 -46.6 81.86 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 120.961 0.41 . . . . 0.0 111.395 -178.868 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 836' ' ' ASN . . . . . 0.615 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 3.0 m120 -75.75 -35.13 60.28 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 -178.476 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 837' ' ' ARG . . . . . 0.464 HH11 ' HB ' ' A' ' 853' ' ' THR . 0.8 OUTLIER -53.09 -46.26 68.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.44 176.996 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 1.7 tmm_? -65.66 -39.95 91.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.448 177.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.71 -53.57 55.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.112 -176.655 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 840' ' ' LEU . . . . . 0.615 ' HG ' ' O ' ' A' ' 836' ' ' ASN . 0.0 OUTLIER -73.64 -33.31 64.46 Favored 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 120.603 -0.439 . . . . 0.0 111.144 -177.281 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -63.75 -45.43 89.89 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.967 0.413 . . . . 0.0 110.866 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -65.99 -38.99 89.91 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.52 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 843' ' ' GLN . . . . . 0.443 ' HG3' ' CD2' ' A' ' 929' ' ' LEU . 0.0 OUTLIER -70.67 -32.41 69.66 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.985 -178.514 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 844' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.2 -37.12 81.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.037 0.446 . . . . 0.0 109.842 173.631 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -64.57 -37.33 94.28 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.303 176.041 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -67.07 -26.69 66.86 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.953 0.406 . . . . 0.0 111.044 178.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.25 -13.17 61.09 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.572 177.864 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 84.68 30.04 27.86 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.877 -0.677 . . . . 0.0 112.849 176.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -124.61 144.45 50.16 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 20.6 mm-40 -65.92 134.75 53.65 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.903 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.06 133.63 55.73 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.131 -172.744 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.05 126.17 51.76 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 174.17 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 853' ' ' THR . . . . . 0.464 ' HB ' HH11 ' A' ' 837' ' ' ARG . 0.0 OUTLIER -106.66 138.62 42.5 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.926 0.393 . . . . 0.0 111.747 -174.593 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 854' ' ' ALA . . . . . 0.487 ' HB3' HG22 ' A' ' 830' ' ' VAL . . . -140.4 145.22 36.79 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.277 175.558 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 855' ' ' ASN . . . . . 0.467 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 0.6 OUTLIER -121.89 72.63 1.04 Allowed 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 176.146 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 856' ' ' ASP . . . . . 0.517 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 35.0 t70 164.25 141.06 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.007 0.923 . . . . 0.0 109.544 178.195 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 857' ' ' GLY . . . . . 0.514 ' HA3' ' HB2' ' A' ' 886' ' ' LEU . . . -67.18 -49.61 51.72 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.972 -0.632 . . . . 0.0 113.228 -177.516 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -73.73 -31.31 31.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.135 0.493 . . . . 0.0 110.728 -177.021 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 859' ' ' ASP . . . . . 0.517 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 18.9 t0 -58.91 -31.16 68.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.824 177.425 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 860' ' ' ALA . . . . . 0.408 ' O ' HG12 ' A' ' 863' ' ' VAL . . . -62.85 -33.79 75.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.79 177.329 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 861' ' ' LEU . . . . . 0.677 HD21 ' HA ' ' A' ' 890' ' ' ILE . 0.3 OUTLIER -69.01 -40.77 78.5 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.022 0.439 . . . . 0.0 110.261 178.794 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -59.35 -49.67 76.91 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.634 177.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 863' ' ' VAL . . . . . 0.408 HG12 ' O ' ' A' ' 860' ' ' ALA . 0.8 OUTLIER -66.42 -31.66 54.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.778 179.789 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 864' ' ' LEU . . . . . 0.476 ' HA ' HD22 ' A' ' 864' ' ' LEU . 0.6 OUTLIER -63.38 -41.93 98.81 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.012 0.434 . . . . 0.0 110.52 177.13 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 3.5 m -76.02 -22.68 55.51 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.578 -176.453 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.46 -44.61 9.51 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.388 -178.595 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -96.11 -133.03 0.2 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.405 -177.774 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 3.5 m170 -136.69 -76.9 0.42 Allowed 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 178.758 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 869' ' ' ILE . . . . . 0.736 ' HA ' ' HG3' ' A' ' 826' ' ' MET . 3.0 mt 69.35 134.6 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 O-C-N 123.792 0.682 . . . . 0.0 111.405 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -98.28 -47.95 5.25 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.485 -178.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 871' ' ' ILE . . . . . 0.611 HD12 ' HD2' ' A' ' 939' ' ' TYR . 36.3 mm -121.62 131.51 72.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.298 -179.607 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 872' ' ' VAL . . . . . 0.752 HG23 HD11 ' A' ' 897' ' ' LEU . 17.0 t -111.82 135.38 51.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 110.125 -0.324 . . . . 0.0 110.125 177.47 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 873' ' ' LEU . . . . . 0.673 HD11 HG12 ' A' ' 829' ' ' VAL . 1.2 pp -139.99 141.72 36.35 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.937 0.399 . . . . 0.0 110.382 174.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -119.72 102.06 8.34 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.639 -179.024 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 875' ' ' ASP . . . . . 0.595 ' OD1' ' HG2' ' A' ' 925' ' ' LYS . 0.4 OUTLIER -89.1 106.28 18.33 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.896 -179.583 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -119.16 125.7 74.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-O 121.165 0.507 . . . . 0.0 111.654 -173.939 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 877' ' ' ASN . . . . . 0.425 ' CB ' ' HD2' ' A' ' 925' ' ' LYS . 0.1 OUTLIER -96.47 -35.61 11.08 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 172.418 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -119.74 133.18 23.85 Favored Pre-proline 0 C--N 1.319 -0.749 0 CA-C-N 114.882 -1.054 . . . . 0.0 108.741 172.427 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 879' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -55.0 -14.63 8.63 Favored 'Trans proline' 0 CA--C 1.532 0.379 0 C-N-CA 123.156 2.571 . . . . 0.0 113.864 -177.778 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 61.64 70.67 0.58 Allowed 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 -179.336 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 72.19 -62.68 0.46 Allowed 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.344 -171.332 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -152.91 130.7 11.65 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.073 178.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -95.97 38.07 3.23 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.859 -175.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -131.15 -28.07 1.96 Allowed 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 177.773 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.51 -39.82 67.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.704 -178.538 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 886' ' ' LEU . . . . . 0.604 ' HG ' ' N ' ' A' ' 887' ' ' THR . 0.0 OUTLIER -70.8 -44.19 67.11 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 121.123 -0.231 . . . . 0.0 110.949 -176.852 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 887' ' ' THR . . . . . 0.604 ' N ' ' HG ' ' A' ' 886' ' ' LEU . 0.0 OUTLIER -67.14 -41.78 85.49 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.972 0.415 . . . . 0.0 110.46 -178.964 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 888' ' ' GLN . . . . . 0.47 ' O ' ' HB2' ' A' ' 892' ' ' GLN . 8.6 tp60 -58.18 -41.01 82.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.15 176.846 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 11.0 mmt-85 -70.99 -35.03 71.93 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.941 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 890' ' ' ILE . . . . . 0.677 ' HA ' HD21 ' A' ' 861' ' ' LEU . 0.0 OUTLIER -66.75 -41.5 88.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 C-N-CA 121.175 -0.21 . . . . 0.0 110.914 -179.018 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 891' ' ' ARG . . . . . 0.492 ' HD2' ' HA3' ' A' ' 918' ' ' GLY . 0.0 OUTLIER -75.32 -24.11 57.37 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 120.711 -0.396 . . . . 0.0 110.502 175.843 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 892' ' ' GLN . . . . . 0.47 ' HB2' ' O ' ' A' ' 888' ' ' GLN . 0.0 OUTLIER -65.45 -38.87 91.12 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.796 178.274 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -83.81 -11.47 57.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.664 -179.581 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 87.04 85.92 1.11 Allowed Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.798 -0.715 . . . . 0.0 111.778 -178.58 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 895' ' ' LEU . . . . . 0.595 ' O ' ' HG ' ' A' ' 895' ' ' LEU . 0.5 OUTLIER -71.83 111.59 7.22 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.46 0.648 . . . . 0.0 110.827 -177.388 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -88.15 -12.61 43.5 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.011 179.74 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 897' ' ' LEU . . . . . 0.752 HD11 HG23 ' A' ' 872' ' ' VAL . 1.8 pt? -124.34 147.83 56.25 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.121 -177.634 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 898' ' ' PRO . . . . . 0.78 ' HB2' ' HE2' ' A' ' 939' ' ' TYR . 57.2 Cg_endo -71.28 141.19 38.65 Favored 'Trans proline' 0 C--O 1.242 0.701 0 C-N-CA 122.648 2.232 . . . . 0.0 112.748 -178.105 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 899' ' ' VAL . . . . . 0.877 HG13 ' HA ' ' A' ' 919' ' ' MET . 0.2 OUTLIER -127.28 144.74 36.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.409 0.623 . . . . 0.0 110.548 179.783 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 900' ' ' ILE . . . . . . . . . . . . . 2.5 mt -108.61 119.05 57.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.155 177.406 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -94.74 98.78 2.34 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.858 -0.686 . . . . 0.0 111.542 179.028 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 902' ' ' VAL . . . . . 0.843 ' HB ' HD12 ' A' ' 923' ' ' LEU . 0.1 OUTLIER -99.56 101.46 12.12 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 CA-C-O 121.717 0.77 . . . . 0.0 109.203 178.769 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 903' ' ' THR . . . . . 0.493 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.1 OUTLIER -105.12 173.73 6.18 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.812 -174.269 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -79.76 103.84 9.94 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.807 -0.357 . . . . 0.0 110.713 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 45.7 t30 18.82 91.78 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.76 0 O-C-N 125.219 1.574 . . . . 0.0 114.787 177.031 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -95.29 8.46 43.05 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.246 -0.434 . . . . 0.0 109.884 172.645 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 3.1 tp 69.25 -67.89 0.21 Allowed 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.596 -176.447 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -99.22 67.89 1.61 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.128 0.49 . . . . 0.0 109.814 176.406 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.42 -27.88 67.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.676 -178.44 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 910' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.84 -40.87 94.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.638 176.359 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 3.9 tttt -70.53 -32.83 70.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.269 -179.153 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.5 -44.29 94.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.715 174.641 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 913' ' ' ARG . . . . . 0.839 ' HA ' ' HE1' ' A' ' 919' ' ' MET . 1.0 OUTLIER -59.93 -42.54 94.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.905 177.211 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 66.6 m -68.38 -34.73 76.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.282 -179.03 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.47 -44.69 74.27 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.817 -178.78 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 916' ' ' GLU . . . . . 0.573 ' OE1' ' HB ' ' A' ' 887' ' ' THR . 0.3 OUTLIER -77.14 -50.93 11.9 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.505 -177.701 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 2.1 m 50.24 47.88 23.04 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.568 -174.014 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 918' ' ' GLY . . . . . 0.492 ' HA3' ' HD2' ' A' ' 891' ' ' ARG . . . -132.67 7.37 5.24 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.166 -1.016 . . . . 0.0 112.965 -179.165 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 919' ' ' MET . . . . . 0.877 ' HA ' HG13 ' A' ' 899' ' ' VAL . 0.0 OUTLIER -121.89 -89.32 0.6 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.734 0.302 . . . . 0.0 110.296 -178.143 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 920' ' ' ASP . . . . . 0.527 ' HB2' ' O ' ' A' ' 919' ' ' MET . 25.5 t70 165.74 -54.79 0.0 OUTLIER 'General case' 0 CA--C 1.516 -0.347 0 O-C-N 124.404 1.065 . . . . 0.0 108.562 176.639 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 921' ' ' SER . . . . . 0.519 ' HA ' ' NH1' ' A' ' 913' ' ' ARG . 20.7 m -129.68 166.61 19.45 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.348 177.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 922' ' ' CYS . . . . . 0.405 ' HB2' ' HB2' ' A' ' 913' ' ' ARG . 0.8 OUTLIER -144.74 147.63 33.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.829 -178.898 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 923' ' ' LEU . . . . . 0.843 HD12 ' HB ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -150.2 -176.82 5.61 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 175.176 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 924' ' ' SER . . . . . 0.493 ' HA ' ' O ' ' A' ' 903' ' ' THR . 1.5 m -108.67 147.49 31.83 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 121.255 -0.178 . . . . 0.0 110.553 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 925' ' ' LYS . . . . . 0.595 ' HG2' ' OD1' ' A' ' 875' ' ' ASP . 0.0 OUTLIER -51.56 -40.79 72.67 Favored Pre-proline 0 CA--C 1.54 0.558 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 -175.577 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 926' ' ' PRO . . . . . 0.554 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 10.9 Cg_endo -57.18 84.86 0.04 OUTLIER 'Trans proline' 0 C--N 1.358 1.035 0 C-N-CA 121.915 1.744 . . . . 0.0 112.1 171.843 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 927' ' ' VAL . . . . . 0.621 HG13 ' HB ' ' A' ' 931' ' ' VAL . 2.3 t -122.55 129.2 75.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.341 -177.09 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.86 172.12 10.32 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.97 178.379 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 929' ' ' LEU . . . . . 0.443 ' CD2' ' HG3' ' A' ' 843' ' ' GLN . 1.0 OUTLIER -60.93 -41.9 97.11 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.416 -175.837 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.67 -29.07 68.26 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.989 0.424 . . . . 0.0 110.584 -179.105 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 931' ' ' VAL . . . . . 0.621 ' HB ' HG13 ' A' ' 927' ' ' VAL . 60.2 t -70.55 -51.11 40.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.956 -178.507 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 932' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -63.45 -37.52 79.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-O 120.842 0.353 . . . . 0.0 110.107 179.075 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.36 -45.76 92.35 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.32 175.78 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 934' ' ' GLN . . . . . 0.514 ' O ' ' HB2' ' A' ' 938' ' ' LEU . 47.5 mt-30 -67.54 -32.88 73.97 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.086 -178.812 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 8.6 m -64.67 -48.03 76.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.801 0.334 . . . . 0.0 110.438 178.076 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 936' ' ' LEU . . . . . . . . . . . . . 1.4 mp -62.93 -48.23 79.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.569 178.217 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 28.3 m -60.56 -44.83 95.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.548 -178.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 938' ' ' LEU . . . . . 0.514 ' HB2' ' O ' ' A' ' 934' ' ' GLN . 0.1 OUTLIER -58.5 -43.17 88.98 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.253 -177.989 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 939' ' ' TYR . . . . . 0.78 ' HE2' ' HB2' ' A' ' 898' ' ' PRO . 4.5 m-85 -79.17 -35.95 41.12 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.097 -177.37 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -62.3 -44.32 96.79 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.864 0.364 . . . . 0.0 110.717 178.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 941' ' ' GLU . . . . . 0.486 ' O ' ' HE2' ' A' ' 945' ' ' LYS . 4.1 pt-20 -70.41 -33.36 71.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.448 178.515 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 942' ' ' ARG . . . . . 0.428 ' N ' ' HG3' ' A' ' 941' ' ' GLU . 0.3 OUTLIER -64.34 -48.19 76.51 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.822 -179.336 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 28.6 m -71.15 -29.71 37.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.828 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.85 -47.15 86.36 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.237 178.679 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 945' ' ' LYS . . . . . 0.486 ' HE2' ' O ' ' A' ' 941' ' ' GLU . 0.1 OUTLIER -77.23 -22.47 52.22 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.901 -0.32 . . . . 0.0 111.124 -177.685 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 69.5 m -76.71 -32.84 58.11 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.809 0.338 . . . . 0.0 110.621 175.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.4 -42.59 18.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.079 -178.733 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -101.75 104.48 15.28 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.235 0.541 . . . . 0.0 110.312 178.756 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.252 1.198 0 CA-C-O 117.858 -1.068 . . . . 0.0 109.512 177.658 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.943 0 CA-C-O 121.001 0.429 . . . . 0.0 110.588 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . -112.36 143.33 17.55 Favored Glycine 0 N--CA 1.447 -0.624 0 C-N-CA 120.894 -0.669 . . . . 0.0 111.601 178.7 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . -160.3 120.6 0.97 Allowed Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.317 -0.944 . . . . 0.0 112.742 -177.455 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -115.56 -42.82 3.09 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.1 0.476 . . . . 0.0 110.103 175.336 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . 72.89 -113.64 4.45 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.422 178.195 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 5.7 t 58.12 68.21 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.249 0 CA-C-O 121.354 0.597 . . . . 0.0 110.361 -178.212 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 702' ' ' GLU . . . . . 0.428 ' H ' ' CD ' ' A' ' 702' ' ' GLU . 0.0 OUTLIER -79.36 -82.71 0.1 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.489 -179.459 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . 147.8 40.86 0.04 OUTLIER Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.575 -0.821 . . . . 0.0 112.838 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.861 HD21 ' HA ' ' A' ' 801' ' ' ILE . 0.2 OUTLIER -96.18 -172.23 2.5 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 176.44 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 52.02 77.27 0.15 Allowed 'General case' 0 N--CA 1.464 0.253 0 O-C-N 123.698 0.624 . . . . 0.0 111.976 176.077 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 145.24 -11.9 1.82 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.199 -1.001 . . . . 0.0 112.644 -178.244 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 11.3 mmtt -67.27 140.03 57.34 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 175.313 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 708' ' ' ARG . . . . . 0.448 ' HG2' HG23 ' A' ' 732' ' ' VAL . 0.8 OUTLIER -105.31 141.89 36.04 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.037 0.446 . . . . 0.0 111.464 -174.759 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 1.5 m -121.94 110.24 15.61 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.275 174.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 710' ' ' TRP . . . . . 0.583 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 70.0 m95 -91.85 134.21 34.97 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 -178.467 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 711' ' ' LEU . . . . . 0.483 HD22 HG23 ' A' ' 733' ' ' VAL . 2.2 pt? -131.79 137.94 48.35 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 121.355 0.598 . . . . 0.0 111.264 -177.465 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -126.05 37.38 4.35 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.902 -1.044 . . . . 0.0 109.161 175.274 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 713' ' ' VAL . . . . . 0.832 ' HB ' ' HB3' ' A' ' 719' ' ' CYS . 2.1 t -87.75 116.34 29.69 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.833 177.751 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 714' ' ' ARG . . . . . 0.427 ' NH2' ' HB2' ' A' ' 751' ' ' GLU . 15.4 mtm180 -84.41 -16.2 43.57 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.439 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 54.9 t-20 -70.57 105.71 3.21 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.214 172.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 716' ' ' ALA . . . . . 0.644 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -60.92 -41.92 97.08 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.677 -174.759 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.69 -41.3 94.87 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.31 0.576 . . . . 0.0 110.376 179.21 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 718' ' ' LEU . . . . . 0.416 ' HB3' HG11 ' A' ' 713' ' ' VAL . 0.3 OUTLIER -73.74 -49.19 26.79 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.347 -177.891 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 719' ' ' CYS . . . . . 0.832 ' HB3' ' HB ' ' A' ' 713' ' ' VAL . 31.8 p -68.42 -40.68 81.11 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.013 -175.487 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 720' ' ' GLN . . . . . 0.587 ' O ' ' HG3' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -66.44 -39.75 89.09 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.46 -178.947 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -63.17 -46.58 86.43 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 121.165 0.507 . . . . 0.0 110.586 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.72 -47.42 78.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.921 -179.408 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 723' ' ' GLU . . . . . 0.587 ' HG3' ' O ' ' A' ' 720' ' ' GLN . 0.3 OUTLIER -60.12 -42.17 94.2 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.151 -176.75 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 724' ' ' THR . . . . . 0.61 ' O ' ' HG3' ' A' ' 728' ' ' ARG . 91.8 m -64.12 -36.87 85.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.881 0.372 . . . . 0.0 110.784 -179.553 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 725' ' ' SER . . . . . 0.441 ' HA ' ' HE ' ' A' ' 728' ' ' ARG . 19.5 m -70.47 -48.02 57.79 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.665 -179.674 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 726' ' ' LEU . . . . . 0.444 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 16.3 mt -66.35 -38.92 88.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.905 0.383 . . . . 0.0 111.548 -176.888 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 727' ' ' GLN . . . . . 0.438 ' HG2' ' O ' ' A' ' 723' ' ' GLU . 6.8 pt20 -72.58 -7.39 49.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.545 -177.629 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 728' ' ' ARG . . . . . 0.61 ' HG3' ' O ' ' A' ' 724' ' ' THR . 33.4 mtm180 -79.16 -34.63 42.98 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.112 0.482 . . . . 0.0 110.467 178.681 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -86.25 -24.52 25.98 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.658 -176.57 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 730' ' ' GLY . . . . . . . . . . . . . . . 120.36 14.9 5.22 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.525 -0.845 . . . . 0.0 111.855 -177.761 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 731' ' ' ILE . . . . . 0.444 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 9.6 mm -91.49 114.11 28.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 175.603 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 732' ' ' VAL . . . . . 0.448 HG23 ' HG2' ' A' ' 708' ' ' ARG . 0.0 OUTLIER -77.93 100.52 3.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 121.309 0.575 . . . . 0.0 110.963 -176.492 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 733' ' ' VAL . . . . . 0.483 HG23 HD22 ' A' ' 711' ' ' LEU . 1.3 p -74.31 133.12 32.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.056 176.86 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 734' ' ' THR . . . . . 0.414 ' O ' ' HA ' ' A' ' 710' ' ' TRP . 7.7 m -141.96 132.16 24.84 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.936 0.398 . . . . 0.0 110.399 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.22 124.89 20.96 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.754 176.721 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 736' ' ' TYR . . . . . 0.583 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 31.7 t80 -85.39 81.53 8.71 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.058 0.456 . . . . 0.0 110.536 -179.252 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -58.05 -45.76 86.49 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.503 174.596 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 149.33 41.83 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.547 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.944 178.089 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.19 -87.52 0.06 Allowed 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 120.396 0.141 . . . . 0.0 111.263 -176.897 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 740' ' ' GLU . . . . . 0.483 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 1.1 mt-10 -149.59 141.38 14.95 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-O 120.546 0.212 . . . . 0.0 111.23 -175.904 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 741' ' ' PRO . . . . . 0.587 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 5.3 Cg_endo -88.25 123.32 1.61 Allowed 'Trans proline' 0 N--CA 1.455 -0.744 0 C-N-CA 123.424 2.749 . . . . 0.0 112.239 175.713 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 742' ' ' THR . . . . . 0.493 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.2 OUTLIER -104.27 138.65 19.58 Favored Pre-proline 0 C--N 1.322 -0.622 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.929 179.073 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 743' ' ' PRO . . . . . 0.493 ' HD2' HG22 ' A' ' 742' ' ' THR . 37.0 Cg_endo -67.43 -7.13 18.24 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.882 2.388 . . . . 0.0 112.764 179.595 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -102.87 -8.72 20.5 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.114 0.483 . . . . 0.0 110.455 177.052 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -111.8 158.97 18.75 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.774 -171.608 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 746' ' ' VAL . . . . . 0.655 HG21 HD11 ' A' ' 795' ' ' LEU . 27.3 m -120.76 148.55 23.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.173 -176.879 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 747' ' ' LEU . . . . . 0.568 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 1.0 OUTLIER -117.64 112.24 20.24 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.036 177.766 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 748' ' ' ILE . . . . . 0.825 HG23 ' HB ' ' A' ' 763' ' ' VAL . 0.2 OUTLIER -99.37 107.15 20.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.906 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 176.151 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 12.6 t -107.39 158.33 17.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.289 0.566 . . . . 0.0 112.079 -173.77 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 750' ' ' ASP . . . . . 0.455 ' HB2' HG13 ' A' ' 713' ' ' VAL . 3.5 t70 -106.22 129.05 54.34 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.027 175.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 751' ' ' GLU . . . . . 0.427 ' HB2' ' NH2' ' A' ' 714' ' ' ARG . 3.8 mm-40 66.94 -175.75 0.19 Allowed 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.514 0.726 . . . . 0.0 111.988 178.337 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 752' ' ' VAL . . . . . 0.561 HG23 ' HB2' ' A' ' 769' ' ' HIS . 55.9 t -69.88 130.43 34.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.743 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -123.01 158.47 27.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.68 -178.543 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.89 -36.34 25.43 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.208 0.527 . . . . 0.0 110.185 178.533 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 755' ' ' LYS . . . . . 0.471 ' HE2' ' HE2' ' A' ' 736' ' ' TYR . 0.0 OUTLIER -113.24 110.38 20.29 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 176.937 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 756' ' ' LYS . . . . . 0.496 ' O ' ' HB2' ' A' ' 757' ' ' TRP . 0.0 OUTLIER -73.2 -57.59 3.91 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.432 -178.815 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 757' ' ' TRP . . . . . 0.667 ' HB2' ' HB ' ' A' ' 762' ' ' VAL . 2.3 t-105 164.31 162.58 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.459 -169.351 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -147.1 53.27 1.08 Allowed 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 174.057 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 759' ' ' GLY . . . . . 0.414 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -146.53 -133.98 2.54 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.884 -175.621 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.22 -57.69 5.02 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.722 0.296 . . . . 0.0 111.316 -176.531 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -162.61 145.89 11.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.032 0.444 . . . . 0.0 111.298 -178.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 762' ' ' VAL . . . . . 0.667 ' HB ' ' HB2' ' A' ' 757' ' ' TRP . 2.0 p -118.58 123.23 71.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.838 175.472 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 763' ' ' VAL . . . . . 0.825 ' HB ' HG23 ' A' ' 748' ' ' ILE . 48.0 t -103.74 108.99 25.82 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-O 121.058 0.456 . . . . 0.0 109.812 178.457 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 764' ' ' THR . . . . . . . . . . . . . 5.5 m -93.14 112.53 24.51 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.156 -178.554 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 765' ' ' PHE . . . . . 0.489 ' CZ ' ' HG ' ' A' ' 791' ' ' LEU . 34.0 m-85 -83.97 125.99 32.59 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 175.071 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 766' ' ' CYS . . . . . 0.412 ' HB3' HG12 ' A' ' 770' ' ' ILE . 0.0 OUTLIER -95.28 133.85 38.71 Favored 'General case' 0 C--N 1.314 -0.944 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.106 -179.453 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.76 -74.3 0.64 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.37 -0.377 . . . . 0.0 109.986 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 1.7 mmt85 -106.86 -35.38 6.96 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 175.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 769' ' ' HIS . . . . . 0.561 ' HB2' HG23 ' A' ' 752' ' ' VAL . 5.7 m80 -117.77 155.38 30.14 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.382 175.661 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 770' ' ' ILE . . . . . 0.449 ' O ' HG22 ' A' ' 752' ' ' VAL . 52.1 mt -107.8 -55.01 5.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 176.026 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . 70.7 -74.28 0.6 Allowed Glycine 0 C--N 1.33 0.231 0 CA-C-N 115.749 -0.659 . . . . 0.0 112.373 177.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 772' ' ' ILE . . . . . 0.417 ' HA ' ' HD3' ' A' ' 773' ' ' PRO . 14.6 mm -65.24 122.78 81.78 Favored Pre-proline 0 C--N 1.324 -0.53 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 177.419 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 773' ' ' PRO . . . . . 0.508 ' HB2' ' HG3' ' A' ' 776' ' ' LYS . 41.6 Cg_exo -56.91 -72.06 0.03 OUTLIER 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.679 2.252 . . . . 0.0 112.672 -176.107 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 774' ' ' LEU . . . . . 0.604 ' O ' ' HB3' ' A' ' 780' ' ' GLU . 1.1 pt? 169.83 -153.12 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.277 0 N-CA-C 108.65 -0.871 . . . . 0.0 108.65 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 775' ' ' GLU . . . . . 0.566 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 1.5 mp0 -59.47 69.14 0.01 OUTLIER 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.306 0.574 . . . . 0.0 111.869 170.47 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 776' ' ' LYS . . . . . 0.508 ' HG3' ' HB2' ' A' ' 773' ' ' PRO . 0.0 OUTLIER -106.28 -38.38 6.25 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.1 174.863 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -103.0 153.21 38.45 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.398 171.825 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -61.3 98.4 0.15 Allowed 'Trans proline' 0 CA--C 1.529 0.252 0 C-N-CA 122.494 2.129 . . . . 0.0 112.258 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 116.63 -1.24 20.19 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.265 179.266 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 780' ' ' GLU . . . . . 0.604 ' HB3' ' O ' ' A' ' 774' ' ' LEU . 0.9 OUTLIER -87.69 122.77 31.78 Favored 'General case' 0 C--O 1.219 -0.519 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 -179.546 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 28.2 m95 -132.82 146.78 52.12 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 177.295 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 782' ' ' VAL . . . . . 0.558 HG13 ' HA ' ' A' ' 774' ' ' LEU . 33.6 m -136.34 158.26 37.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 176.375 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 783' ' ' HIS . . . . . 0.46 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.0 OUTLIER -172.86 120.27 0.37 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.746 175.044 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.63 101.52 14.2 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 172.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 785' ' ' VAL . . . . . 0.675 HG13 ' H ' ' A' ' 787' ' ' ALA . 4.9 p -175.42 158.01 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.191 -176.55 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -86.85 9.66 18.48 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.038 178.748 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 787' ' ' ALA . . . . . 0.675 ' H ' HG13 ' A' ' 785' ' ' VAL . . . 58.33 71.87 0.95 Allowed Pre-proline 0 N--CA 1.468 0.427 0 CA-C-N 115.647 -0.706 . . . . 0.0 112.262 177.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 788' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -66.27 -61.8 0.08 OUTLIER 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.35 2.033 . . . . 0.0 111.589 178.062 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -141.25 -31.68 0.57 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.937 0.399 . . . . 0.0 111.153 176.105 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 790' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -61.8 -44.49 96.77 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.802 -0.636 . . . . 0.0 112.659 -170.322 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 791' ' ' LEU . . . . . 0.489 ' HG ' ' CZ ' ' A' ' 765' ' ' PHE . 0.6 OUTLIER -68.93 -53.47 14.47 Favored Pre-proline 0 C--N 1.326 -0.437 0 C-N-CA 120.601 -0.44 . . . . 0.0 111.67 -176.87 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 792' ' ' PRO . . . . . 0.43 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 9.6 Cg_endo -57.03 -32.47 93.23 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 121.554 1.503 . . . . 0.0 112.048 175.736 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -69.58 -40.99 76.4 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.784 0.326 . . . . 0.0 110.85 177.072 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -59.63 -44.76 93.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.152 0.501 . . . . 0.0 109.751 177.042 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 795' ' ' LEU . . . . . 0.655 HD11 HG21 ' A' ' 746' ' ' VAL . 0.7 OUTLIER -63.32 -48.56 77.53 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.904 -179.768 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -61.99 -41.61 98.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.352 -179.638 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.17 -33.92 76.52 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.88 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -69.31 -32.97 55.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.695 179.57 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -96.29 3.16 53.22 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.4 -179.053 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 800' ' ' LEU . . . . . 0.436 ' O ' ' HB ' ' A' ' 801' ' ' ILE . 1.2 mp 70.99 -62.83 0.44 Allowed 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.611 0.764 . . . . 0.0 112.482 175.36 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 801' ' ' ILE . . . . . 0.861 ' HA ' HD21 ' A' ' 704' ' ' LEU . 1.7 mp 73.89 -51.47 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 123.454 0.702 . . . . 0.0 111.255 -177.81 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 73.19 -49.96 0.7 Allowed 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 172.084 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 803' ' ' MET . . . . . . . . . . . . . 6.4 mmt -61.23 -61.56 2.47 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.374 -174.422 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 804' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -90.6 121.87 32.9 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.261 -0.427 . . . . 0.0 109.909 178.779 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.92 134.61 44.85 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.837 -176.259 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -76.76 -22.62 53.5 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 174.137 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 21.5 t70 72.27 111.25 0.03 OUTLIER Pre-proline 0 N--CA 1.463 0.183 0 CA-C-N 114.578 -1.192 . . . . 0.0 112.701 171.401 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 808' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -93.04 24.2 0.47 Allowed 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 123.389 2.726 . . . . 0.0 111.611 173.425 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . 62.76 49.14 3.85 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.747 -177.496 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -120.38 89.82 3.2 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.9 179.431 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -83.83 108.96 17.17 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.57 -179.262 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -162.32 108.55 1.11 Allowed Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.385 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -81.53 143.02 13.36 Favored 'Trans proline' 0 N--CA 1.461 -0.392 0 C-N-CA 122.494 2.129 . . . . 0.0 112.263 179.125 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.1 115.72 3.98 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.082 176.655 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -118.38 104.65 10.94 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 112.115 0.413 . . . . 0.0 112.115 -173.589 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -138.34 110.81 7.49 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 173.449 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -134.68 53.77 1.98 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.025 0.441 . . . . 0.0 110.082 -179.528 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -74.04 -35.52 64.33 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.162 -179.198 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 76.5 t -88.34 115.01 27.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.457 -177.339 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -157.69 150.72 23.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.87 174.751 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 6.1 t0 58.39 71.36 0.59 Allowed 'General case' 0 N--CA 1.466 0.351 0 O-C-N 123.605 0.565 . . . . 0.0 111.914 174.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -103.03 62.73 0.8 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.13 0.49 . . . . 0.0 110.286 178.528 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -115.88 111.03 19.85 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.764 179.677 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -127.48 -57.12 1.29 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.806 -176.522 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 825' ' ' MET . . . . . 0.517 ' HE1' HG12 ' A' ' 871' ' ' ILE . 0.0 OUTLIER -100.19 109.1 21.35 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.747 178.198 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 826' ' ' MET . . . . . 0.567 ' HG3' ' HA ' ' A' ' 869' ' ' ILE . 0.0 OUTLIER -115.37 129.17 56.51 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.113 0.482 . . . . 0.0 110.952 -176.071 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 827' ' ' ILE . . . . . . . . . . . . . 2.9 mm -118.02 127.29 75.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.58 -0.737 . . . . 0.0 109.52 179.371 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 828' ' ' LEU . . . . . 0.507 ' HB2' HG12 ' A' ' 869' ' ' ILE . 7.7 tp -104.53 130.19 52.5 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.523 0.202 . . . . 0.0 110.748 -177.672 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 829' ' ' VAL . . . . . 0.58 HG21 HD11 ' A' ' 840' ' ' LEU . 0.3 OUTLIER -112.92 121.78 65.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.98 177.452 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 830' ' ' VAL . . . . . 0.56 HG11 ' HB2' ' A' ' 860' ' ' ALA . 0.2 OUTLIER -115.74 86.85 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.112 178.552 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 831' ' ' ASP . . . . . 0.887 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 55.0 t0 -108.94 134.02 52.16 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.434 -176.598 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -73.99 -13.72 60.91 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.866 178.547 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 1.1 m80 -109.24 92.65 11.66 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.179 177.546 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 834' ' ' PRO . . . . . 0.577 ' HA ' ' HD3' ' A' ' 837' ' ' ARG . 2.5 Cg_endo -46.33 -37.66 19.36 Favored 'Trans proline' 0 CA--C 1.534 0.521 0 C-N-CA 123.733 2.955 . . . . 0.0 114.167 -175.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 1.1 pp -65.3 -42.7 94.44 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 CA-C-O 120.921 0.391 . . . . 0.0 111.74 -178.168 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 836' ' ' ASN . . . . . 0.614 ' HB3' ' OD2' ' A' ' 831' ' ' ASP . 26.9 t-20 -69.62 -43.87 71.81 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.506 -0.554 . . . . 0.0 109.506 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 837' ' ' ARG . . . . . 0.887 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 1.1 ttt-85 -55.64 -40.6 72.41 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.872 -1.058 . . . . 0.0 111.032 177.077 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 838' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 838' ' ' ARG . 0.0 OUTLIER -64.75 -39.85 94.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.586 178.768 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.48 -49.16 67.53 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.211 -177.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 840' ' ' LEU . . . . . 0.58 HD11 HG21 ' A' ' 829' ' ' VAL . 2.3 pp -73.95 -27.68 61.13 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.933 -0.307 . . . . 0.0 111.173 -177.138 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -66.15 -32.69 74.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.987 0.422 . . . . 0.0 110.061 174.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -63.62 -45.73 88.95 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.928 176.119 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 843' ' ' GLN . . . . . 0.63 ' HG2' HD23 ' A' ' 929' ' ' LEU . 3.1 mt-30 -60.25 -42.21 94.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.283 175.564 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 844' ' ' LEU . . . . . . . . . . . . . 1.2 mp -58.88 -44.61 91.18 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.004 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -63.72 -41.43 98.97 Favored Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.905 -0.588 . . . . 0.0 112.326 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 68.8 m -73.19 -13.74 61.22 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.687 0.279 . . . . 0.0 111.331 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 847' ' ' LEU . . . . . 0.565 HD21 ' HA ' ' A' ' 933' ' ' LYS . 0.1 OUTLIER -83.62 -4.93 59.0 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.872 0.368 . . . . 0.0 110.691 176.828 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 87.86 17.06 58.72 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.943 -0.646 . . . . 0.0 112.884 177.091 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 849' ' ' TYR . . . . . 0.415 ' CD2' HD23 ' A' ' 936' ' ' LEU . 30.1 m-85 -112.11 144.06 42.11 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.726 0.298 . . . . 0.0 110.475 -178.873 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -75.69 108.25 8.4 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.108 0.48 . . . . 0.0 109.726 -179.723 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -87.61 122.03 30.8 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.55 -174.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 852' ' ' LYS . . . . . 0.4 ' O ' HD12 ' A' ' 828' ' ' LEU . 7.0 mptt -107.73 120.58 42.63 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 174.543 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -99.77 137.79 37.76 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 120.904 0.383 . . . . 0.0 111.852 -173.42 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 854' ' ' ALA . . . . . 0.411 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -150.41 157.97 43.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.056 176.294 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -149.19 75.56 1.29 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.708 179.701 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 856' ' ' ASP . . . . . . . . . . . . . 24.4 t70 175.16 136.95 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.828 179.338 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 857' ' ' GLY . . . . . 0.45 ' HA2' HD13 ' A' ' 886' ' ' LEU . . . -65.1 -44.4 94.23 Favored Glycine 0 CA--C 1.519 0.309 0 C-N-CA 120.985 -0.626 . . . . 0.0 113.307 -179.001 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 37.7 t -73.91 -44.98 50.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.029 0.442 . . . . 0.0 110.597 -177.847 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -66.36 -19.72 65.88 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.154 -176.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 860' ' ' ALA . . . . . 0.56 ' HB2' HG11 ' A' ' 830' ' ' VAL . . . -61.72 -39.56 91.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.905 0.383 . . . . 0.0 110.403 174.324 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 861' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.52 -34.07 65.07 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.226 178.006 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 19.9 t30 -63.28 -41.99 99.06 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.247 176.316 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -70.92 -31.48 45.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.374 177.6 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 864' ' ' LEU . . . . . 0.691 HD21 HD11 ' A' ' 897' ' ' LEU . 0.9 OUTLIER -58.89 -36.0 73.93 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.776 176.151 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -83.58 -38.27 21.87 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.847 179.828 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.69 -52.73 63.88 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.078 0.466 . . . . 0.0 110.645 179.274 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 867' ' ' ASN . . . . . 0.552 ' HB3' ' H ' ' A' ' 868' ' ' HIS . 0.1 OUTLIER -106.19 -127.35 0.25 Allowed 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.798 -0.816 . . . . 0.0 108.798 176.292 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 868' ' ' HIS . . . . . 0.552 ' H ' ' HB3' ' A' ' 867' ' ' ASN . 0.2 OUTLIER -165.19 -56.17 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 110.07 -0.345 . . . . 0.0 110.07 174.371 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 869' ' ' ILE . . . . . 0.567 ' HA ' ' HG3' ' A' ' 826' ' ' MET . 2.4 mp 74.24 140.55 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 O-C-N 123.758 0.661 . . . . 0.0 111.562 174.73 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -87.43 -57.99 2.75 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.417 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 871' ' ' ILE . . . . . 0.517 HG12 ' HE1' ' A' ' 825' ' ' MET . 41.4 mm -111.82 126.99 69.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.323 -179.823 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 872' ' ' VAL . . . . . 0.659 ' HB ' ' HB ' ' A' ' 899' ' ' VAL . 0.1 OUTLIER -105.11 137.02 36.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.788 -178.689 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 873' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -125.0 124.76 42.68 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 173.809 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -121.89 101.79 7.78 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 120.989 0.423 . . . . 0.0 109.993 178.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 875' ' ' ASP . . . . . 0.67 ' HB2' ' HE2' ' A' ' 925' ' ' LYS . 0.5 OUTLIER -107.48 115.67 30.56 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 122.013 0.911 . . . . 0.0 110.907 -178.673 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 3.1 p -137.33 128.87 41.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 114.951 -1.022 . . . . 0.0 110.213 -176.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 877' ' ' ASN . . . . . 0.582 ' ND2' ' HB3' ' A' ' 904' ' ' ALA . 1.8 t30 -155.96 64.28 0.58 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.43 0.633 . . . . 0.0 110.393 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 6.8 mmt -154.9 164.12 22.1 Favored Pre-proline 0 C--N 1.32 -0.699 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 176.401 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 879' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -65.3 66.54 0.33 Allowed 'Trans proline' 0 CA--C 1.532 0.395 0 C-N-CA 122.59 2.194 . . . . 0.0 112.016 174.168 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -78.08 -41.76 34.32 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.694 -0.684 . . . . 0.0 109.742 179.128 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 10.1 mtp 66.97 11.74 8.55 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.447 176.223 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -113.76 16.24 18.55 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.248 0.546 . . . . 0.0 110.485 179.139 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -81.79 39.9 2.59 Favored Glycine 0 N--CA 1.451 -0.34 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.406 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 884' ' ' TYR . . . . . 0.432 ' O ' ' HB2' ' A' ' 888' ' ' GLN . 2.7 t80 -138.5 -50.91 0.56 Allowed 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 177.641 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -66.05 -46.54 77.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.64 179.43 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 886' ' ' LEU . . . . . 0.524 ' HG ' ' N ' ' A' ' 887' ' ' THR . 0.0 OUTLIER -62.97 -45.94 90.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.67 -177.974 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 887' ' ' THR . . . . . 0.524 ' N ' ' HG ' ' A' ' 886' ' ' LEU . 0.0 OUTLIER -65.39 -42.37 92.72 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.075 -179.469 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 888' ' ' GLN . . . . . 0.432 ' HB2' ' O ' ' A' ' 884' ' ' TYR . 0.3 OUTLIER -64.69 -47.3 78.87 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.889 -178.712 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 889' ' ' ARG . . . . . 0.532 ' HD3' ' OE1' ' A' ' 892' ' ' GLN . 13.1 mmt180 -66.54 -32.41 73.75 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.532 -0.303 . . . . 0.0 111.074 -177.537 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 890' ' ' ILE . . . . . 0.499 HG23 HD13 ' A' ' 895' ' ' LEU . 5.3 mt -60.55 -51.17 76.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.964 0.412 . . . . 0.0 110.718 178.616 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 891' ' ' ARG . . . . . 0.632 ' HB3' ' HA2' ' A' ' 918' ' ' GLY . 0.1 OUTLIER -74.67 -31.16 61.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.859 -178.997 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 892' ' ' GLN . . . . . 0.532 ' OE1' ' HD3' ' A' ' 889' ' ' ARG . 7.5 mt-30 -65.61 -41.99 92.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.589 179.313 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.14 -29.21 68.86 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.009 177.218 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 92.7 64.03 1.11 Allowed Glycine 0 N--CA 1.443 -0.842 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.736 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 895' ' ' LEU . . . . . 0.499 HD13 HG23 ' A' ' 890' ' ' ILE . 0.3 OUTLIER -67.26 111.09 3.79 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 178.173 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.66 0.58 56.28 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.14 -176.167 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 897' ' ' LEU . . . . . 0.691 HD11 HD21 ' A' ' 864' ' ' LEU . 0.0 OUTLIER -107.95 135.78 19.82 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.436 176.806 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -67.96 124.78 12.23 Favored 'Trans proline' 0 C--O 1.235 0.338 0 C-N-CA 122.653 2.235 . . . . 0.0 112.32 -177.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 899' ' ' VAL . . . . . 0.659 ' HB ' ' HB ' ' A' ' 872' ' ' VAL . 0.2 OUTLIER -113.62 131.8 64.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 121.573 0.702 . . . . 0.0 110.526 179.783 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 900' ' ' ILE . . . . . 0.679 HG23 ' HB2' ' A' ' 921' ' ' SER . 0.4 OUTLIER -101.09 117.85 46.95 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.161 178.873 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -91.68 117.06 5.13 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.809 -0.71 . . . . 0.0 111.496 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 902' ' ' VAL . . . . . 0.713 ' HB ' ' HB2' ' A' ' 923' ' ' LEU . 0.5 OUTLIER -105.66 134.4 47.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.717 0 CA-C-O 121.425 0.631 . . . . 0.0 110.699 -175.921 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -139.73 159.32 42.44 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.344 -175.741 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 904' ' ' ALA . . . . . 0.612 ' HB2' ' HB2' ' A' ' 925' ' ' LYS . . . -109.95 114.33 27.79 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 122.35 -0.219 . . . . 0.0 110.485 179.157 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 61.02 54.66 3.31 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.667 -178.807 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -104.33 93.28 4.73 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.36 177.166 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.37 125.66 21.76 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.598 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . 59.59 48.08 9.97 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.143 -178.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.22 -30.03 70.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.153 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 910' ' ' GLU . . . . . 0.49 ' HA ' ' SG ' ' A' ' 922' ' ' CYS . 0.0 OUTLIER -65.01 -43.99 90.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.014 175.646 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -63.33 -43.25 98.28 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.341 177.826 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -61.46 -42.38 98.69 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.977 179.17 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.97 -41.52 91.07 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.145 -179.662 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 69.4 m -69.5 -31.67 70.05 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.862 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.65 -46.25 89.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.94 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 916' ' ' GLU . . . . . 0.546 ' HG2' ' H ' ' A' ' 918' ' ' GLY . 0.0 OUTLIER -77.71 -32.29 52.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.557 178.615 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 917' ' ' SER . . . . . 0.488 ' N ' ' HG2' ' A' ' 916' ' ' GLU . 0.1 OUTLIER 47.03 46.82 16.06 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.383 -178.664 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 918' ' ' GLY . . . . . 0.632 ' HA2' ' HB3' ' A' ' 891' ' ' ARG . . . -122.56 -32.2 0.98 Allowed Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.605 -178.361 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 919' ' ' MET . . . . . 0.651 ' HA ' HG13 ' A' ' 899' ' ' VAL . 3.3 mtt -83.16 -86.87 0.1 Allowed 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 121.206 -0.198 . . . . 0.0 110.5 179.819 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 920' ' ' ASP . . . . . 0.555 ' HB2' ' O ' ' A' ' 919' ' ' MET . 43.8 t0 161.18 -67.72 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.616 0 O-C-N 124.183 0.927 . . . . 0.0 109.276 177.295 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 921' ' ' SER . . . . . 0.679 ' HB2' HG23 ' A' ' 900' ' ' ILE . 66.3 m -127.06 -177.87 4.21 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.502 -178.578 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 922' ' ' CYS . . . . . 0.49 ' SG ' ' HA ' ' A' ' 910' ' ' GLU . 0.5 OUTLIER -139.59 145.44 38.58 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.897 0.379 . . . . 0.0 111.094 -177.021 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 923' ' ' LEU . . . . . 0.713 ' HB2' ' HB ' ' A' ' 902' ' ' VAL . 58.4 mt -130.04 166.73 19.53 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.041 179.346 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 924' ' ' SER . . . . . 0.508 ' O ' HG23 ' A' ' 927' ' ' VAL . 0.7 OUTLIER -91.52 144.75 25.23 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.016 173.971 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 925' ' ' LYS . . . . . 0.67 ' HE2' ' HB2' ' A' ' 875' ' ' ASP . 2.7 tmtt? -58.72 -46.71 99.55 Favored Pre-proline 0 N--CA 1.467 0.38 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 926' ' ' PRO . . . . . 0.496 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 46.7 Cg_endo -69.69 55.38 1.24 Allowed 'Trans proline' 0 C--N 1.355 0.908 0 C-N-CA 122.055 1.837 . . . . 0.0 112.592 174.296 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 927' ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' ' 924' ' ' SER . 0.9 OUTLIER -67.97 129.19 32.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.789 176.786 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.57 167.89 10.86 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.824 179.841 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 929' ' ' LEU . . . . . 0.63 HD23 ' HG2' ' A' ' 843' ' ' GLN . 0.0 OUTLIER -54.9 -45.38 74.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.872 0.367 . . . . 0.0 110.764 179.201 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -64.06 -40.22 95.8 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.912 0.387 . . . . 0.0 110.721 -178.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 13.6 t -65.27 -49.98 75.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.802 -178.743 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 932' ' ' ILE . . . . . 0.591 ' O ' ' HB2' ' A' ' 936' ' ' LEU . 2.9 tp -66.23 -31.4 53.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.812 0.339 . . . . 0.0 110.659 -179.123 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 933' ' ' LYS . . . . . 0.565 ' HA ' HD21 ' A' ' 847' ' ' LEU . 0.3 OUTLIER -66.21 -49.17 68.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.983 178.936 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 934' ' ' GLN . . . . . 0.467 ' HG3' ' N ' ' A' ' 935' ' ' THR . 0.1 OUTLIER -75.22 -42.31 55.75 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.648 -174.375 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 935' ' ' THR . . . . . 0.467 ' N ' ' HG3' ' A' ' 934' ' ' GLN . 3.3 m -70.14 -42.2 72.89 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.531 0.197 . . . . 0.0 111.531 -175.832 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 936' ' ' LEU . . . . . 0.591 ' HB2' ' O ' ' A' ' 932' ' ' ILE . 0.7 OUTLIER -67.17 -44.54 79.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.695 0.283 . . . . 0.0 110.788 -179.985 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 80.4 m -68.17 -38.66 82.3 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.226 -178.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 938' ' ' LEU . . . . . 0.505 ' O ' ' HB2' ' A' ' 942' ' ' ARG . 0.0 OUTLIER -63.52 -42.18 98.46 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.907 0.384 . . . . 0.0 110.423 178.078 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 939' ' ' TYR . . . . . 0.492 ' O ' HG22 ' A' ' 943' ' ' VAL . 0.4 OUTLIER -69.28 -40.91 77.48 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.91 179.311 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -59.15 -47.83 83.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.588 -178.175 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 941' ' ' GLU . . . . . 0.441 ' HG3' ' N ' ' A' ' 942' ' ' ARG . 3.8 pt-20 -71.53 -32.96 68.74 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.759 0.314 . . . . 0.0 110.598 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 942' ' ' ARG . . . . . 0.505 ' HB2' ' O ' ' A' ' 938' ' ' LEU . 2.3 ttp180 -65.23 -48.26 73.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.315 -178.016 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 943' ' ' VAL . . . . . 0.492 HG22 ' O ' ' A' ' 939' ' ' TYR . 18.1 m -70.92 -36.67 64.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 120.962 0.411 . . . . 0.0 111.367 -178.112 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.3 -38.68 63.27 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.494 -176.83 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 8.5 pttp -70.76 -35.39 72.6 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.657 0.265 . . . . 0.0 110.669 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 19.8 m -73.03 -23.26 60.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.13 0.491 . . . . 0.0 110.423 177.287 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.22 -21.57 33.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.371 176.647 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 32.3 t0 55.36 50.82 14.07 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 123.874 0.733 . . . . 0.0 110.826 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 2.1 m . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.532 -0.747 . . . . 0.0 109.807 178.717 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.863 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 109.45 -94.84 0.85 Allowed Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.831 -0.7 . . . . 0.0 112.39 178.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . 90.32 18.57 48.95 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.503 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -119.86 114.15 21.66 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.897 0.38 . . . . 0.0 110.603 -179.31 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 700' ' ' GLY . . . . . 0.406 ' HA2' ' SD ' ' A' ' 803' ' ' MET . . . -108.31 135.3 12.75 Favored Glycine 0 N--CA 1.444 -0.798 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.943 -178.242 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 1.5 t -92.91 -32.26 4.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 174.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 702' ' ' GLU . . . . . 0.409 ' HB3' ' H ' ' A' ' 703' ' ' GLY . 26.4 mp0 -125.91 -158.74 0.86 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.237 -0.892 . . . . 0.0 109.219 175.394 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 703' ' ' GLY . . . . . 0.409 ' H ' ' HB3' ' A' ' 702' ' ' GLU . . . 81.55 -58.19 4.89 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.444 -0.884 . . . . 0.0 111.726 -177.86 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.418 ' H ' ' HG ' ' A' ' 704' ' ' LEU . 0.0 OUTLIER -78.95 92.2 4.91 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 175.017 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -137.0 94.4 2.95 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.547 -174.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 88.8 3.31 77.26 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.832 -0.699 . . . . 0.0 113.402 171.1 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.87 137.83 57.46 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 178.326 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 708' ' ' ARG . . . . . . . . . . . . . 3.8 mtt85 -103.02 156.29 17.78 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.215 0.531 . . . . 0.0 111.615 -177.354 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -138.74 128.78 25.34 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.02 -0.991 . . . . 0.0 108.741 174.167 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 710' ' ' TRP . . . . . 0.823 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 96.5 m95 -92.26 129.31 38.24 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.408 0.623 . . . . 0.0 110.468 -176.263 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 711' ' ' LEU . . . . . 0.636 HD21 ' HB2' ' A' ' 719' ' ' CYS . 0.9 OUTLIER -118.1 125.95 51.3 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.668 -172.657 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -126.15 52.7 1.67 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.311 0.577 . . . . 0.0 110.045 177.681 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 713' ' ' VAL . . . . . 0.699 ' HA ' ' HB3' ' A' ' 750' ' ' ASP . 87.5 t -111.95 120.96 63.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.917 179.434 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 714' ' ' ARG . . . . . 0.471 ' NH2' ' HB3' ' A' ' 751' ' ' GLU . 1.9 mtm180 -81.34 -19.57 42.52 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.081 0.467 . . . . 0.0 110.461 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -75.62 100.17 4.54 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.853 176.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 716' ' ' ALA . . . . . 0.622 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -61.68 -35.29 77.57 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.714 -173.936 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -65.07 -46.79 79.74 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.008 0.433 . . . . 0.0 110.44 177.923 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 2.3 tt -69.27 -45.17 70.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.762 -179.504 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 719' ' ' CYS . . . . . 0.636 ' HB2' HD21 ' A' ' 711' ' ' LEU . 8.3 p -66.82 -40.68 88.12 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.941 -177.325 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 720' ' ' GLN . . . . . 0.456 ' HB2' ' O ' ' A' ' 716' ' ' ALA . 0.1 OUTLIER -59.95 -41.33 91.63 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-O 120.586 0.232 . . . . 0.0 110.811 177.925 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -56.71 -52.82 63.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.899 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 722' ' ' LEU . . . . . 0.443 HD13 HG21 ' A' ' 748' ' ' ILE . 3.2 mt -67.08 -47.46 71.17 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.094 -178.44 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 723' ' ' GLU . . . . . 0.909 ' HA ' HG21 ' A' ' 733' ' ' VAL . 0.3 OUTLIER -61.42 -39.29 90.25 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.278 -174.386 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 724' ' ' THR . . . . . 0.558 ' HA ' ' CG ' ' A' ' 727' ' ' GLN . 88.3 m -73.01 -34.2 66.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.693 0.282 . . . . 0.0 111.155 -178.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 50.4 m -61.98 -36.15 80.62 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.761 0.315 . . . . 0.0 110.933 177.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 726' ' ' LEU . . . . . 0.554 HD21 HD12 ' A' ' 795' ' ' LEU . 1.1 mt -78.42 -41.36 33.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.271 -178.757 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 727' ' ' GLN . . . . . 0.558 ' CG ' ' HA ' ' A' ' 724' ' ' THR . 1.7 pt20 -74.2 -4.82 38.23 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.973 0.416 . . . . 0.0 111.111 -179.287 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.4 -22.26 65.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.171 175.102 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 729' ' ' SER . . . . . 0.51 ' HB2' ' H ' ' A' ' 730' ' ' GLY . 0.1 OUTLIER -104.38 -107.98 0.28 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.227 177.358 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 730' ' ' GLY . . . . . 0.51 ' H ' ' HB2' ' A' ' 729' ' ' SER . . . -138.93 25.55 2.79 Favored Glycine 0 CA--C 1.51 -0.239 0 N-CA-C 110.922 -0.871 . . . . 0.0 110.922 179.134 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 731' ' ' ILE . . . . . 0.44 ' O ' ' HA ' ' A' ' 727' ' ' GLN . 1.0 OUTLIER -107.47 146.68 13.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 -178.067 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 732' ' ' VAL . . . . . . . . . . . . . 2.1 p -123.36 131.57 72.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.043 0.449 . . . . 0.0 110.981 -176.693 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 733' ' ' VAL . . . . . 0.909 HG21 ' HA ' ' A' ' 723' ' ' GLU . 3.7 t -101.44 147.56 8.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 177.768 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -149.01 141.61 24.41 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.816 0.341 . . . . 0.0 111.057 -173.899 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -59.48 118.21 5.77 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.829 178.325 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 736' ' ' TYR . . . . . 0.823 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 36.5 t80 -85.31 91.01 8.06 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.189 0.519 . . . . 0.0 110.833 -179.494 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 737' ' ' GLU . . . . . 0.491 ' H ' ' HG3' ' A' ' 737' ' ' GLU . 0.0 OUTLIER -93.46 -128.66 0.12 Allowed 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.312 172.061 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 738' ' ' GLY . . . . . 0.482 ' H ' ' HB2' ' A' ' 737' ' ' GLU . . . -80.93 59.33 4.75 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.615 -0.803 . . . . 0.0 112.398 178.155 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 739' ' ' GLN . . . . . 0.495 ' HG2' ' CH2' ' A' ' 710' ' ' TRP . 0.9 OUTLIER -107.37 176.24 5.22 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 -179.049 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 740' ' ' GLU . . . . . 0.441 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 1.1 mt-10 -87.0 141.02 32.91 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.788 -177.918 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 741' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 740' ' ' GLU . 5.4 Cg_endo -87.69 121.39 1.55 Allowed 'Trans proline' 0 N--CA 1.453 -0.888 0 C-N-CA 123.023 2.482 . . . . 0.0 111.585 175.031 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 742' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.16 136.24 20.5 Favored Pre-proline 0 C--N 1.32 -0.708 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.444 -174.754 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 743' ' ' PRO . . . . . 0.752 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 31.8 Cg_endo -65.89 -9.62 23.79 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 123.045 2.497 . . . . 0.0 112.644 177.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -101.84 -1.1 32.97 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.657 175.564 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 37.2 m-20 -110.79 150.85 28.52 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.894 0.378 . . . . 0.0 110.911 -174.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 2.4 p -117.23 136.75 53.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.449 -178.057 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 747' ' ' LEU . . . . . 0.408 HD23 ' O ' ' A' ' 710' ' ' TRP . 0.4 OUTLIER -100.45 136.8 39.76 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.015 -0.538 . . . . 0.0 109.984 177.707 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 748' ' ' ILE . . . . . 0.443 HG21 HD13 ' A' ' 722' ' ' LEU . 18.0 mt -120.12 107.69 21.52 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 171.22 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.05 164.79 11.69 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.813 -0.631 . . . . 0.0 112.159 -170.536 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 750' ' ' ASP . . . . . 0.699 ' HB3' ' HA ' ' A' ' 713' ' ' VAL . 0.0 OUTLIER -129.01 129.34 45.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.936 173.751 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 751' ' ' GLU . . . . . 0.968 ' HG2' ' H ' ' A' ' 752' ' ' VAL . 20.7 tt0 65.3 -178.44 0.18 Allowed 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.682 0.753 . . . . 0.0 111.697 -179.741 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 752' ' ' VAL . . . . . 0.968 ' H ' ' HG2' ' A' ' 751' ' ' GLU . 4.5 p -61.66 132.55 27.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 114.917 -1.038 . . . . 0.0 111.294 178.176 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 8.1 p -129.69 153.77 39.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.168 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -96.54 40.95 1.12 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.758 0.313 . . . . 0.0 111.559 -177.825 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.08 154.29 40.02 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 177.722 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 756' ' ' LYS . . . . . 0.429 ' O ' ' HB3' ' A' ' 757' ' ' TRP . 3.7 tptp -102.24 -37.6 8.03 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 121.316 -0.154 . . . . 0.0 111.271 -177.182 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 757' ' ' TRP . . . . . 0.525 ' CD1' ' HB ' ' A' ' 762' ' ' VAL . 63.5 t-105 72.1 105.34 0.07 Allowed 'General case' 0 N--CA 1.468 0.432 0 O-C-N 123.88 0.737 . . . . 0.0 111.312 179.273 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -100.27 84.4 2.81 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.061 177.177 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 759' ' ' GLY . . . . . 0.752 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -144.71 -149.08 4.97 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.574 -0.822 . . . . 0.0 113.134 -177.534 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.97 -53.74 45.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.238 0.542 . . . . 0.0 109.872 -179.566 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -164.04 156.3 17.1 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.068 178.204 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 762' ' ' VAL . . . . . 0.525 ' HB ' ' CD1' ' A' ' 757' ' ' TRP . 2.4 p -134.39 113.71 17.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 175.841 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -111.67 105.87 19.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.22 -177.65 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 764' ' ' THR . . . . . 0.783 ' HB ' HG12 ' A' ' 782' ' ' VAL . 68.1 m -99.23 120.48 39.61 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.546 -177.218 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 765' ' ' PHE . . . . . 0.527 ' CE1' HG23 ' A' ' 785' ' ' VAL . 8.8 m-85 -76.64 130.34 37.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.138 175.424 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 766' ' ' CYS . . . . . 0.545 ' O ' ' HA ' ' A' ' 784' ' ' SER . 3.2 m -105.25 131.45 52.69 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-O 120.968 0.413 . . . . 0.0 109.964 176.201 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.6 22.54 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 178.687 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 768' ' ' ARG . . . . . 0.436 ' HB3' ' H ' ' A' ' 769' ' ' HIS . 0.0 OUTLIER -157.66 -104.24 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.8 -1.091 . . . . 0.0 108.424 -177.088 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 769' ' ' HIS . . . . . 0.436 ' H ' ' HB3' ' A' ' 768' ' ' ARG . 0.2 OUTLIER -111.13 147.77 34.15 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 109.921 -0.399 . . . . 0.0 109.921 171.409 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 4.6 mt -106.81 154.05 7.86 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.802 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.867 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 771' ' ' GLY . . . . . 0.72 ' HA3' HG23 ' A' ' 752' ' ' VAL . . . -151.09 -39.65 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.871 -0.68 . . . . 0.0 111.765 -179.451 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 772' ' ' ILE . . . . . 0.443 ' HA ' ' HD3' ' A' ' 773' ' ' PRO . 32.9 mm -88.42 131.26 42.76 Favored Pre-proline 0 C--N 1.324 -0.503 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 176.608 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 773' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 772' ' ' ILE . 12.1 Cg_exo -70.64 172.98 12.45 Favored 'Trans proline' 0 N--CA 1.463 -0.316 0 C-N-CA 122.759 2.306 . . . . 0.0 111.936 178.43 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 774' ' ' LEU . . . . . 0.554 ' HB3' HG22 ' A' ' 782' ' ' VAL . 0.7 OUTLIER -90.16 -152.57 0.26 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.734 -179.045 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 775' ' ' GLU . . . . . 0.534 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 1.2 mp0 -62.21 72.42 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.61 -21.47 30.33 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 168.177 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 777' ' ' ALA . . . . . 0.46 ' HB3' ' HG3' ' A' ' 780' ' ' GLU . . . -143.1 155.35 62.02 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 114.321 -1.309 . . . . 0.0 109.102 179.623 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -65.22 78.08 0.23 Allowed 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.891 2.394 . . . . 0.0 111.731 175.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 163.59 -28.31 0.23 Allowed Glycine 0 N--CA 1.447 -0.604 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.54 -178.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 780' ' ' GLU . . . . . 0.534 ' O ' ' HG3' ' A' ' 775' ' ' GLU . 3.5 mt-10 -89.04 121.95 31.89 Favored 'General case' 0 C--O 1.222 -0.39 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 179.385 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 34.4 m95 -139.38 139.0 37.06 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.929 0.395 . . . . 0.0 110.647 -178.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 782' ' ' VAL . . . . . 0.783 HG12 ' HB ' ' A' ' 764' ' ' THR . 28.5 m -138.37 153.52 26.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 169.334 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 783' ' ' HIS . . . . . . . . . . . . . 4.9 t-160 -155.88 120.7 4.71 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.765 0.317 . . . . 0.0 110.454 176.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 784' ' ' SER . . . . . 0.545 ' HA ' ' O ' ' A' ' 766' ' ' CYS . 0.4 OUTLIER -84.73 100.86 11.77 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.059 178.268 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 785' ' ' VAL . . . . . 0.527 HG23 ' CE1' ' A' ' 765' ' ' PHE . 0.0 OUTLIER -162.01 -178.51 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.53 178.548 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -113.8 31.87 6.23 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.79 0.329 . . . . 0.0 110.572 178.065 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 59.46 73.19 0.7 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.009 178.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 788' ' ' PRO . . . . . 0.676 ' HD2' ' OE1' ' A' ' 790' ' ' GLU . 12.0 Cg_exo -71.8 -67.91 0.02 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.711 2.274 . . . . 0.0 110.947 173.825 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 1.4 p-80 176.45 28.48 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 122.784 0.434 . . . . 0.0 110.816 175.246 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 790' ' ' GLU . . . . . 0.676 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -101.25 -43.83 5.85 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.02 0.438 . . . . 0.0 110.265 -177.923 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 791' ' ' LEU . . . . . 0.486 HD22 ' CE2' ' A' ' 765' ' ' PHE . 0.2 OUTLIER -66.66 -47.47 56.21 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 115.822 -0.627 . . . . 0.0 111.788 179.07 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 792' ' ' PRO . . . . . 0.437 ' HG3' HD23 ' A' ' 722' ' ' LEU . 39.8 Cg_exo -57.25 -33.65 96.4 Favored 'Trans proline' 0 C--N 1.359 1.102 0 C-N-CA 121.701 1.6 . . . . 0.0 111.58 175.775 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -68.61 -41.76 79.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.584 177.699 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.57 -28.43 65.96 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.878 178.431 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 795' ' ' LEU . . . . . 0.554 HD12 HD21 ' A' ' 726' ' ' LEU . 0.2 OUTLIER -63.88 -40.5 96.69 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.959 -0.386 . . . . 0.0 109.959 177.521 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 796' ' ' ALA . . . . . 0.451 ' HB1' HD11 ' A' ' 801' ' ' ILE . . . -68.71 -34.61 75.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.025 0.44 . . . . 0.0 110.764 176.707 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.9 -49.05 64.15 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.666 179.681 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -66.09 -31.17 52.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.595 177.856 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -62.16 -34.4 76.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.024 177.789 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 4.6 mt 58.47 74.62 0.43 Allowed 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.409 -178.253 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 801' ' ' ILE . . . . . 0.451 HD11 ' HB1' ' A' ' 796' ' ' ALA . 3.4 mt -62.74 -36.47 75.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.722 -179.3 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 60.83 45.06 10.2 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.745 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 803' ' ' MET . . . . . 0.406 ' SD ' ' HA2' ' A' ' 700' ' ' GLY . 0.4 OUTLIER -140.16 139.18 35.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.061 176.541 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 804' ' ' GLU . . . . . 0.488 ' H ' ' HG3' ' A' ' 804' ' ' GLU . 0.0 OUTLIER -82.05 -100.86 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 121.008 -0.277 . . . . 0.0 111.082 -177.155 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -164.75 172.65 12.74 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.286 0.565 . . . . 0.0 111.911 -176.313 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -130.11 114.62 15.97 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.305 -0.861 . . . . 0.0 108.793 174.502 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -136.93 101.22 9.54 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-O 120.688 0.28 . . . . 0.0 110.997 -174.222 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 808' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -80.47 39.21 0.82 Allowed 'Trans proline' 0 N--CA 1.463 -0.312 0 C-N-CA 123.378 2.718 . . . . 0.0 112.155 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -76.75 92.44 3.57 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.952 0.406 . . . . 0.0 111.091 -178.03 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -161.56 144.72 12.36 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.706 178.5 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -152.17 169.9 21.29 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.83 0.347 . . . . 0.0 111.394 -177.826 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -150.53 131.1 7.08 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.732 177.659 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -80.1 164.18 22.36 Favored 'Trans proline' 0 CA--C 1.53 0.298 0 C-N-CA 122.87 2.38 . . . . 0.0 113.367 -177.216 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -115.36 132.89 56.47 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.898 176.63 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -149.43 129.9 13.9 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.733 -0.212 . . . . 0.0 110.98 -179.026 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -150.01 126.86 11.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.893 0.378 . . . . 0.0 111.211 177.318 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.24 157.04 44.16 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.549 176.912 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -160.57 117.57 2.41 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.983 0.421 . . . . 0.0 111.822 -178.565 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 43.7 t -91.66 119.14 38.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 172.387 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -117.2 103.35 10.11 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.881 0.372 . . . . 0.0 111.351 -175.055 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -151.79 112.8 4.25 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.069 175.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 822' ' ' ASN . . . . . 0.412 ' HB3' ' H ' ' A' ' 823' ' ' ASP . 10.8 t-20 -94.46 -104.87 0.14 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.303 -176.433 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 823' ' ' ASP . . . . . 0.412 ' H ' ' HB3' ' A' ' 822' ' ' ASN . 12.0 t0 -167.35 162.75 14.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.854 0.359 . . . . 0.0 110.311 -177.404 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -138.31 47.27 2.0 Allowed 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 178.368 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 2.6 mtt -76.41 120.45 21.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.237 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 826' ' ' MET . . . . . . . . . . . . . 37.0 ttm -94.02 121.36 35.42 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.288 0.566 . . . . 0.0 111.579 -177.373 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 827' ' ' ILE . . . . . 0.613 HG21 HD11 ' A' ' 936' ' ' LEU . 13.6 mm -112.91 130.74 66.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 114.966 -1.015 . . . . 0.0 109.087 175.292 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 828' ' ' LEU . . . . . 0.637 ' HB3' HG22 ' A' ' 872' ' ' VAL . 34.6 tp -95.21 114.41 26.2 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.196 0.522 . . . . 0.0 110.024 -179.717 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 829' ' ' VAL . . . . . 0.882 ' HB ' ' HD2' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -103.09 107.31 21.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.033 -178.94 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 830' ' ' VAL . . . . . 0.656 HG22 ' HB3' ' A' ' 854' ' ' ALA . 8.9 t -109.2 130.85 61.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.197 179.59 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 831' ' ' ASP . . . . . 0.757 ' HB2' ' NE ' ' A' ' 837' ' ' ARG . 8.6 t0 -135.97 146.01 46.79 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 175.036 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.49 -17.9 62.32 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.234 0.54 . . . . 0.0 109.802 173.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 7.6 m80 -108.25 103.43 50.51 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.393 175.247 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_exo -57.34 -48.85 15.73 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 123.123 2.548 . . . . 0.0 113.984 -173.282 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 835' ' ' ILE . . . . . 0.428 HD13 ' HA ' ' A' ' 835' ' ' ILE . 0.3 OUTLIER -63.94 -35.62 74.0 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-O 120.957 0.408 . . . . 0.0 110.185 -178.164 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 836' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -62.46 -49.02 77.09 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.62 177.474 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 837' ' ' ARG . . . . . 0.882 ' HD2' ' HB ' ' A' ' 829' ' ' VAL . 0.0 OUTLIER -60.27 -47.0 87.87 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.633 -178.915 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 838' ' ' ARG . . . . . 0.41 ' HG2' HD13 ' A' ' 835' ' ' ILE . 0.0 OUTLIER -63.79 -31.11 72.18 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 123.112 0.258 . . . . 0.0 111.144 -176.256 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.82 -47.43 21.48 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.388 -176.19 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 840' ' ' LEU . . . . . . . . . . . . . 2.6 pp -73.36 -26.1 60.87 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.537 178.612 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -67.61 -29.7 69.1 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 173.789 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -64.57 -43.34 94.2 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 174.345 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 843' ' ' GLN . . . . . 0.407 ' HB3' ' CD2' ' A' ' 929' ' ' LEU . 8.1 mm-40 -61.24 -41.23 96.53 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.413 175.315 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 844' ' ' LEU . . . . . 0.501 HD11 HD12 ' A' ' 932' ' ' ILE . 0.1 OUTLIER -58.88 -35.14 72.52 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.373 175.397 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -71.27 -35.22 63.83 Favored Glycine 0 N--CA 1.449 -0.468 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.053 177.072 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.62 -16.73 63.44 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 120.958 0.408 . . . . 0.0 110.431 176.715 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 24.3 mt -80.19 -12.42 59.64 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.588 176.03 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 92.4 19.8 37.28 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 121.018 -0.61 . . . . 0.0 112.784 178.563 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 31.1 m-85 -110.82 163.28 13.95 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.632 0.253 . . . . 0.0 110.611 -179.022 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.81 108.06 20.66 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.255 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -98.77 135.74 39.81 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.669 -178.08 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.71 128.06 55.6 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 173.537 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.66 131.86 40.0 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.291 0.567 . . . . 0.0 112.19 -173.237 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 854' ' ' ALA . . . . . 0.656 ' HB3' HG22 ' A' ' 830' ' ' VAL . . . -140.01 156.95 46.38 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.631 175.379 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 855' ' ' ASN . . . . . 0.579 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 17.0 p-10 -146.04 71.77 1.27 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.229 0.537 . . . . 0.0 111.667 -179.149 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 856' ' ' ASP . . . . . 0.579 ' HB2' ' O ' ' A' ' 855' ' ' ASN . 3.9 t70 162.96 174.52 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.209 1.004 . . . . 0.0 108.769 175.191 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 857' ' ' GLY . . . . . 0.401 ' HA3' ' HB2' ' A' ' 886' ' ' LEU . . . -83.93 -39.19 9.58 Favored Glycine 0 N--CA 1.446 -0.684 0 N-CA-C 110.878 -0.889 . . . . 0.0 110.878 175.787 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 858' ' ' VAL . . . . . 0.433 ' O ' ' HB2' ' A' ' 862' ' ' ASN . 6.7 m -73.41 -31.56 33.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.811 0.338 . . . . 0.0 110.297 177.488 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 859' ' ' ASP . . . . . 0.404 ' H ' ' HB3' ' A' ' 856' ' ' ASP . 25.5 t0 -65.59 -48.72 71.37 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.521 178.358 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -62.66 -42.42 99.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.411 -179.233 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 861' ' ' LEU . . . . . 0.578 HD21 ' HG ' ' A' ' 893' ' ' LEU . 56.3 tp -69.26 -38.19 78.29 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.877 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 862' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' A' ' 858' ' ' VAL . 33.7 t30 -57.83 -54.93 41.35 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.9 -179.29 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 8.1 p -63.09 -31.49 52.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.646 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 864' ' ' LEU . . . . . 0.522 HD11 HD21 ' A' ' 897' ' ' LEU . 0.6 OUTLIER -64.39 -36.69 84.96 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.02 178.673 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -76.3 -24.73 54.38 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.263 0.554 . . . . 0.0 110.255 179.627 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.44 -53.21 8.44 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.015 179.413 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -135.31 144.57 46.81 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.207 -175.786 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 2.0 p80 -70.4 138.24 51.13 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.184 0.516 . . . . 0.0 111.792 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 869' ' ' ILE . . . . . 0.623 HG21 ' HB2' ' A' ' 828' ' ' LEU . 5.6 mt -131.69 139.42 50.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 175.514 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -77.06 -59.39 2.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.863 0.363 . . . . 0.0 111.197 -173.936 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 871' ' ' ILE . . . . . 0.434 HG22 HG23 ' A' ' 827' ' ' ILE . 1.1 mp -117.95 130.46 72.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 CA-C-O 120.908 0.385 . . . . 0.0 110.141 -179.442 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 872' ' ' VAL . . . . . 0.637 HG22 ' HB3' ' A' ' 828' ' ' LEU . 53.8 t -123.42 125.11 71.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.21 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 873' ' ' LEU . . . . . 0.667 HD11 HG12 ' A' ' 829' ' ' VAL . 0.1 OUTLIER -118.74 131.63 56.13 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.9 0.381 . . . . 0.0 110.268 178.391 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -109.8 101.2 10.09 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.699 -178.125 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 875' ' ' ASP . . . . . 0.522 ' HB3' ' HE2' ' A' ' 925' ' ' LYS . 0.3 OUTLIER -90.48 118.15 29.73 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.466 -179.368 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -131.58 117.04 33.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-O 120.883 0.373 . . . . 0.0 111.229 179.13 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -62.61 -61.03 2.71 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 172.902 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.43 123.9 15.68 Favored Pre-proline 0 C--N 1.319 -0.749 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 168.202 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 879' ' ' PRO . . . . . 0.626 ' HB2' ' HA3' ' A' ' 883' ' ' GLY . 57.9 Cg_endo -72.16 49.8 1.41 Allowed 'Trans proline' 0 CA--C 1.532 0.385 0 C-N-CA 122.781 2.321 . . . . 0.0 113.419 -176.3 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 880' ' ' ASN . . . . . 0.41 ' HB3' ' H ' ' A' ' 881' ' ' MET . 60.4 t30 63.14 -84.04 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.309 0.644 . . . . 0.0 111.119 178.374 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 881' ' ' MET . . . . . 0.41 ' H ' ' HB3' ' A' ' 880' ' ' ASN . 0.1 OUTLIER -179.22 -36.59 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 -179.869 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 882' ' ' ASP . . . . . 0.488 ' O ' ' HB3' ' A' ' 885' ' ' ARG . 5.1 p-10 -101.68 28.41 5.63 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.53 -1.214 . . . . 0.0 110.08 176.706 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 883' ' ' GLY . . . . . 0.626 ' HA3' ' HB2' ' A' ' 879' ' ' PRO . . . -59.46 -17.83 41.55 Favored Glycine 0 C--N 1.333 0.367 0 CA-C-N 115.593 -0.73 . . . . 0.0 113.717 -174.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -59.27 -28.89 67.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.5 0.667 . . . . 0.0 109.562 176.68 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 885' ' ' ARG . . . . . 0.488 ' HB3' ' O ' ' A' ' 882' ' ' ASP . 0.0 OUTLIER -61.02 -31.68 71.3 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.144 -0.934 . . . . 0.0 110.728 -179.275 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 886' ' ' LEU . . . . . 0.478 ' N ' ' HD2' ' A' ' 885' ' ' ARG . 0.0 OUTLIER -67.7 -47.63 68.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.748 0.308 . . . . 0.0 110.299 -178.768 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 887' ' ' THR . . . . . 0.427 ' N ' ' HG ' ' A' ' 886' ' ' LEU . 0.0 OUTLIER -69.53 -38.46 77.52 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.311 0.577 . . . . 0.0 110.655 -178.704 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -62.83 -51.29 67.6 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.745 177.749 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 889' ' ' ARG . . . . . 0.465 ' HB2' ' O ' ' A' ' 885' ' ' ARG . 0.0 OUTLIER -62.48 -42.78 99.72 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.988 -174.432 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 890' ' ' ILE . . . . . . . . . . . . . 1.4 tt -67.96 -41.27 84.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 120.857 -0.337 . . . . 0.0 111.411 -176.298 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 891' ' ' ARG . . . . . 0.649 ' HA ' HD23 ' A' ' 895' ' ' LEU . 0.1 OUTLIER -75.31 -27.03 59.14 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.675 0.274 . . . . 0.0 111.26 179.717 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 30.4 tp60 -77.63 -37.16 50.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.046 -179.133 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 893' ' ' LEU . . . . . 0.578 ' HG ' HD21 ' A' ' 861' ' ' LEU . 0.5 OUTLIER -73.97 -32.35 63.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.751 179.764 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 121.91 83.11 0.67 Allowed Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.877 176.133 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 895' ' ' LEU . . . . . 0.649 HD23 ' HA ' ' A' ' 891' ' ' ARG . 0.2 OUTLIER -89.09 135.99 33.26 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 110.236 -0.283 . . . . 0.0 110.236 178.035 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -131.48 26.5 4.76 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.919 0.39 . . . . 0.0 111.532 -177.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 897' ' ' LEU . . . . . 0.522 HD21 HD11 ' A' ' 864' ' ' LEU . 0.0 OUTLIER -145.56 154.65 52.8 Favored Pre-proline 0 C--N 1.323 -0.56 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.311 -175.784 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -63.67 110.6 1.3 Allowed 'Trans proline' 0 C--O 1.236 0.41 0 C-N-CA 122.72 2.28 . . . . 0.0 112.16 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 899' ' ' VAL . . . . . . . . . . . . . 26.7 t -100.95 112.94 35.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.44 0.638 . . . . 0.0 110.643 177.783 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 900' ' ' ILE . . . . . 0.674 HG23 ' HB2' ' A' ' 921' ' ' SER . 2.0 mt -90.45 106.63 17.55 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.812 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.303 179.512 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 901' ' ' GLY . . . . . 0.583 ' O ' ' HA ' ' A' ' 922' ' ' CYS . . . -85.91 119.09 5.01 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 120.755 -0.736 . . . . 0.0 111.511 178.679 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 902' ' ' VAL . . . . . 0.667 ' HB ' HD12 ' A' ' 923' ' ' LEU . 0.1 OUTLIER -124.12 119.5 56.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-O 121.084 0.468 . . . . 0.0 110.251 -178.203 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 903' ' ' THR . . . . . 0.445 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.0 OUTLIER -120.02 160.05 23.56 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.981 -176.193 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 904' ' ' ALA . . . . . 0.601 ' HA ' ' HB2' ' A' ' 925' ' ' LYS . . . -72.48 139.41 47.63 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 173.13 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -64.68 105.36 0.97 Allowed 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.091 0.472 . . . . 0.0 110.451 -177.695 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -117.99 -42.93 2.78 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.509 -0.769 . . . . 0.0 111.195 -174.705 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -158.76 -73.97 0.08 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.363 -176.136 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -161.58 55.22 0.27 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.308 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 909' ' ' GLU . . . . . 0.439 ' HG3' ' H ' ' A' ' 909' ' ' GLU . 0.0 OUTLIER -65.88 -29.84 70.34 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.456 -177.232 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 910' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.67 -37.49 76.13 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.537 174.924 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -67.77 -41.57 83.06 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.303 178.261 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -62.28 -37.14 84.35 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.405 177.414 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 913' ' ' ARG . . . . . 0.406 HH11 ' HD3' ' A' ' 913' ' ' ARG . 0.0 OUTLIER -66.17 -37.37 85.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.508 177.288 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 76.9 m -65.97 -33.54 76.05 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.321 176.804 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.97 -39.69 75.82 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.637 176.451 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -66.22 -52.02 51.93 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.138 -178.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 46.6 48.18 14.34 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -133.0 -33.41 0.37 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.937 176.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 919' ' ' MET . . . . . 0.537 ' O ' ' HB2' ' A' ' 920' ' ' ASP . 12.8 mtt -65.76 -80.96 0.03 OUTLIER 'General case' 0 C--O 1.236 0.394 0 CA-C-O 120.654 0.264 . . . . 0.0 111.386 179.254 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 920' ' ' ASP . . . . . 0.537 ' HB2' ' O ' ' A' ' 919' ' ' MET . 12.4 t70 168.54 -85.53 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.788 177.067 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 921' ' ' SER . . . . . 0.674 ' HB2' HG23 ' A' ' 900' ' ' ILE . 0.0 OUTLIER -109.33 175.79 5.32 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.151 -173.562 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 922' ' ' CYS . . . . . 0.583 ' HA ' ' O ' ' A' ' 901' ' ' GLY . 0.0 OUTLIER -146.43 137.54 24.34 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 120.753 0.311 . . . . 0.0 111.501 -179.925 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 923' ' ' LEU . . . . . 0.667 HD12 ' HB ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -143.0 -175.81 4.66 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.846 175.387 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 924' ' ' SER . . . . . 0.609 ' HB3' ' HD2' ' A' ' 926' ' ' PRO . 0.5 OUTLIER -114.35 150.53 34.43 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.744 0.307 . . . . 0.0 110.776 -179.644 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 925' ' ' LYS . . . . . 0.601 ' HB2' ' HA ' ' A' ' 904' ' ' ALA . 0.0 OUTLIER -50.56 -40.29 59.5 Favored Pre-proline 0 CA--C 1.54 0.579 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 -175.515 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 926' ' ' PRO . . . . . 0.609 ' HD2' ' HB3' ' A' ' 924' ' ' SER . 40.8 Cg_exo -61.08 72.33 0.08 OUTLIER 'Trans proline' 0 C--N 1.361 1.187 0 C-N-CA 121.892 1.728 . . . . 0.0 113.286 174.503 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 927' ' ' VAL . . . . . 0.686 HG13 HG12 ' A' ' 931' ' ' VAL . 3.8 t -107.44 124.75 63.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.92 177.08 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 928' ' ' THR . . . . . 0.546 ' OG1' ' HB ' ' A' ' 931' ' ' VAL . 3.0 p -88.89 171.0 10.23 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.162 -179.345 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 929' ' ' LEU . . . . . 0.48 ' O ' HD22 ' A' ' 929' ' ' LEU . 1.3 tm? -63.47 -46.33 86.68 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.864 0.364 . . . . 0.0 110.087 176.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -63.76 -42.15 97.86 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.832 0.348 . . . . 0.0 110.858 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 931' ' ' VAL . . . . . 0.686 HG12 HG13 ' A' ' 927' ' ' VAL . 0.8 OUTLIER -68.37 -32.41 55.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.656 179.618 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 932' ' ' ILE . . . . . 0.638 ' O ' ' HB2' ' A' ' 936' ' ' LEU . 0.4 OUTLIER -64.68 -40.06 87.77 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.255 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 175.565 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 5.2 ttmt -66.17 -45.95 79.09 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.545 178.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -61.5 -53.81 51.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.24 -179.511 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 3.6 m -65.07 -39.35 93.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.189 -177.549 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 936' ' ' LEU . . . . . 0.638 ' HB2' ' O ' ' A' ' 932' ' ' ILE . 4.9 tp -60.85 -48.15 83.14 Favored 'General case' 0 C--O 1.223 -0.308 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.316 177.368 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 93.2 m -62.93 -41.58 99.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.169 -179.279 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.66 -46.89 87.67 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.105 0.478 . . . . 0.0 111.456 -179.362 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -78.51 -32.84 48.31 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.218 -177.443 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 940' ' ' ALA . . . . . 0.491 ' O ' ' HB2' ' A' ' 944' ' ' ARG . . . -66.94 -41.41 87.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.945 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 941' ' ' GLU . . . . . 0.569 ' HG3' ' N ' ' A' ' 942' ' ' ARG . 0.2 OUTLIER -66.94 -35.78 80.74 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.84 -0.429 . . . . 0.0 109.84 176.795 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 942' ' ' ARG . . . . . 0.569 ' N ' ' HG3' ' A' ' 941' ' ' GLU . 0.0 OUTLIER -60.23 -48.43 81.78 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.855 -179.764 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 13.7 m -76.11 -30.21 20.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.021 -179.213 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 944' ' ' ARG . . . . . 0.491 ' HB2' ' O ' ' A' ' 940' ' ' ALA . 0.0 OUTLIER -65.47 -41.26 93.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.178 179.67 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 945' ' ' LYS . . . . . 0.475 ' HG2' ' O ' ' A' ' 942' ' ' ARG . 4.4 pttt -71.9 -31.31 66.27 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.706 179.615 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 15.0 m -68.96 -35.51 76.84 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 120.879 0.371 . . . . 0.0 110.952 174.688 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 3.1 ttm180 -77.52 -19.89 55.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.531 178.675 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 15.3 t0 63.04 54.34 2.15 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.129 177.847 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.074 -0.965 . . . . 0.0 109.772 178.046 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 1.7 ttm . . . . . 0 N--CA 1.478 0.953 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 126.24 -35.37 2.98 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.15 -179.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . 84.06 -166.91 43.06 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.696 178.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 4.2 m -119.55 152.37 37.1 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.775 0.321 . . . . 0.0 110.288 -178.737 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . -92.82 -145.64 17.23 Favored Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.726 -177.646 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -90.98 165.25 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.137 0.494 . . . . 0.0 111.135 -176.437 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -141.6 -74.47 0.31 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.646 -0.707 . . . . 0.0 109.286 175.847 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . -176.63 157.05 22.13 Favored Glycine 0 N--CA 1.446 -0.689 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 177.716 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -103.71 6.52 36.96 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 121.184 0.516 . . . . 0.0 110.471 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 705' ' ' SER . . . . . 0.411 ' HA ' ' O ' ' A' ' 730' ' ' GLY . 0.0 OUTLIER -74.95 72.4 2.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.854 178.06 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 706' ' ' GLY . . . . . 0.52 ' HA2' ' HD3' ' A' ' 808' ' ' PRO . . . -157.31 -0.66 0.1 OUTLIER Glycine 0 N--CA 1.445 -0.702 0 C-N-CA 120.295 -0.955 . . . . 0.0 113.428 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 707' ' ' LYS . . . . . 0.598 ' HZ2' ' HB3' ' A' ' 707' ' ' LYS . 0.0 OUTLIER -131.88 154.75 48.89 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 117.487 0.644 . . . . 0.0 110.039 179.699 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 708' ' ' ARG . . . . . 0.486 ' N ' ' HG2' ' A' ' 707' ' ' LYS . 0.0 OUTLIER -108.92 154.87 21.54 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.687 -175.18 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 709' ' ' CYS . . . . . 0.434 ' O ' ' HA ' ' A' ' 733' ' ' VAL . 74.6 m -142.73 143.93 32.45 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.773 175.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 710' ' ' TRP . . . . . 0.552 ' CZ3' ' HG3' ' A' ' 739' ' ' GLN . 86.0 m95 -111.36 143.79 41.6 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 120.939 0.4 . . . . 0.0 110.577 -179.868 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 711' ' ' LEU . . . . . 0.441 ' CD1' ' HB2' ' A' ' 719' ' ' CYS . 0.3 OUTLIER -133.51 132.86 41.47 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.46 0.648 . . . . 0.0 110.806 179.178 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -127.24 60.22 1.4 Allowed 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.326 176.394 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 713' ' ' VAL . . . . . 0.747 HG13 ' HB3' ' A' ' 750' ' ' ASP . 28.8 t -108.47 120.8 60.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.745 179.588 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 4.0 mtm180 -79.7 -27.47 40.72 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.06 -177.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -72.43 111.8 7.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.907 175.384 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 716' ' ' ALA . . . . . 0.547 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -66.42 -35.37 80.13 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.55 -174.197 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.78 -45.1 87.74 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.063 0.459 . . . . 0.0 110.631 178.857 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 718' ' ' LEU . . . . . 0.648 HD11 ' HA ' ' A' ' 786' ' ' ALA . 0.3 OUTLIER -71.03 -45.1 64.51 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.868 179.805 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 719' ' ' CYS . . . . . 0.547 ' SG ' ' HA ' ' A' ' 716' ' ' ALA . 2.4 p -65.5 -43.61 89.6 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.821 -177.011 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 720' ' ' GLN . . . . . 0.632 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 19.0 tp60 -63.3 -39.74 95.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.942 -179.589 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -55.91 -54.85 39.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.895 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 6.7 mt -68.17 -48.35 65.53 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.19 -178.28 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 723' ' ' GLU . . . . . 0.638 ' HB2' HG11 ' A' ' 733' ' ' VAL . 0.2 OUTLIER -64.07 -38.13 89.96 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.675 -173.439 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 724' ' ' THR . . . . . 0.566 ' N ' ' HG3' ' A' ' 723' ' ' GLU . 4.1 m -71.77 -40.27 69.38 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 120.601 0.239 . . . . 0.0 110.728 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 20.1 m -62.06 -38.57 89.27 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.465 178.261 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 726' ' ' LEU . . . . . 0.425 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 49.5 mt -67.55 -48.95 65.47 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.454 177.615 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -59.65 -27.28 66.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.233 -179.298 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 728' ' ' ARG . . . . . 0.406 HH11 ' HD3' ' A' ' 728' ' ' ARG . 0.1 OUTLIER -64.42 -24.57 67.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.542 -179.321 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 72.1 m -103.19 7.09 38.63 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.946 0.403 . . . . 0.0 111.23 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 730' ' ' GLY . . . . . 0.411 ' O ' ' HA ' ' A' ' 705' ' ' SER . . . 92.26 1.46 69.37 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.774 177.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 731' ' ' ILE . . . . . 0.425 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 11.9 mm -66.91 127.21 28.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 120.647 0.261 . . . . 0.0 110.33 177.856 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 732' ' ' VAL . . . . . 0.484 ' O ' ' HG2' ' A' ' 708' ' ' ARG . 0.7 OUTLIER -88.73 104.59 14.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.461 0.648 . . . . 0.0 109.856 179.888 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 733' ' ' VAL . . . . . 0.638 HG11 ' HB2' ' A' ' 723' ' ' GLU . 1.6 p -99.53 141.7 16.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.385 -179.714 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 734' ' ' THR . . . . . 0.447 ' HB ' ' CZ3' ' A' ' 710' ' ' TRP . 0.2 OUTLIER -136.93 138.49 40.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.493 178.974 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.6 136.18 52.63 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.418 176.137 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -78.49 79.98 4.9 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.224 -176.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -70.18 -79.36 0.06 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.768 177.263 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -151.77 61.0 0.4 Allowed Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 121.149 -0.548 . . . . 0.0 111.828 179.216 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 739' ' ' GLN . . . . . 0.552 ' HG3' ' CZ3' ' A' ' 710' ' ' TRP . 1.1 mm-40 -114.45 176.24 5.13 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.824 0.345 . . . . 0.0 110.557 -177.413 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 740' ' ' GLU . . . . . 0.449 ' HG3' ' HD2' ' A' ' 741' ' ' PRO . 0.8 OUTLIER -93.42 141.13 23.52 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.866 -179.683 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 741' ' ' PRO . . . . . 0.567 ' HA ' ' CZ3' ' A' ' 757' ' ' TRP . 15.7 Cg_endo -58.45 132.38 48.2 Favored 'Trans proline' 0 C--O 1.234 0.291 0 C-N-CA 123.014 2.476 . . . . 0.0 112.219 176.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 742' ' ' THR . . . . . 0.537 ' HB ' ' HB2' ' A' ' 745' ' ' ASP . 0.2 OUTLIER -105.92 131.8 21.43 Favored Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.611 179.631 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -66.12 -17.99 55.72 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 123.363 2.709 . . . . 0.0 113.391 -175.782 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -105.41 4.15 30.42 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.691 0.281 . . . . 0.0 110.531 178.676 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 745' ' ' ASP . . . . . 0.537 ' HB2' ' HB ' ' A' ' 742' ' ' THR . 14.0 m-20 -115.37 156.86 24.77 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.158 -174.829 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 29.4 m -119.97 148.11 23.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.922 -177.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 747' ' ' LEU . . . . . 0.556 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 0.0 OUTLIER -112.76 118.48 35.09 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.627 -0.261 . . . . 0.0 110.367 178.062 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 4.3 mt -104.47 107.24 21.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 173.468 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 1.5 t -117.42 163.8 15.83 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.59 0.233 . . . . 0.0 110.851 -175.858 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 750' ' ' ASP . . . . . 0.747 ' HB3' HG13 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -121.02 130.21 53.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.172 0.51 . . . . 0.0 110.902 -179.797 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 67.06 177.93 0.23 Allowed 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 114.656 -1.156 . . . . 0.0 111.297 -175.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 752' ' ' VAL . . . . . 0.607 HG22 HG12 ' A' ' 772' ' ' ILE . 69.9 t -80.68 91.82 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.411 0.624 . . . . 0.0 110.939 -176.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 2.0 t -86.9 -6.62 10.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.421 176.081 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 3.6 m 59.26 39.81 22.15 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.635 179.172 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.83 133.91 44.6 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.257 -0.428 . . . . 0.0 109.988 176.782 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 756' ' ' LYS . . . . . 0.498 ' HA ' ' HD2' ' A' ' 756' ' ' LYS . 4.9 mmmt -100.8 81.4 2.28 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.138 0.494 . . . . 0.0 110.326 -179.682 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 757' ' ' TRP . . . . . 0.567 ' CZ3' ' HA ' ' A' ' 741' ' ' PRO . 65.7 t-105 -75.96 95.5 3.58 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.378 178.628 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -94.6 59.83 2.51 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.336 0.588 . . . . 0.0 110.025 175.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 759' ' ' GLY . . . . . . . . . . . . . . . -108.07 -127.01 5.55 Favored Glycine 0 N--CA 1.446 -0.647 0 N-CA-C 111.187 -0.765 . . . . 0.0 111.187 176.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 32.0 ttt85 -77.47 -58.83 3.06 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.15 0.5 . . . . 0.0 109.83 175.654 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -156.64 152.95 27.78 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.525 -0.762 . . . . 0.0 109.749 179.141 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 762' ' ' VAL . . . . . 0.466 ' HB ' ' HB3' ' A' ' 757' ' ' TRP . 2.1 p -131.82 123.41 51.6 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-O 121.171 0.51 . . . . 0.0 110.421 178.359 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 763' ' ' VAL . . . . . 0.571 HG11 HD11 ' A' ' 791' ' ' LEU . 84.3 t -105.92 115.15 47.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.091 178.709 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 764' ' ' THR . . . . . 0.455 ' O ' ' HA ' ' A' ' 782' ' ' VAL . 9.2 m -106.99 110.87 23.12 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.175 -178.755 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 765' ' ' PHE . . . . . 0.499 ' HE1' HG23 ' A' ' 785' ' ' VAL . 40.5 m-85 -70.73 152.72 43.51 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 171.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 766' ' ' CYS . . . . . 0.469 ' SG ' ' HB ' ' A' ' 782' ' ' VAL . 0.0 OUTLIER -157.5 133.56 9.49 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 178.32 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 767' ' ' ARG . . . . . 0.417 ' HB2' ' HE ' ' A' ' 767' ' ' ARG . 0.0 OUTLIER -126.1 -8.97 6.51 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.775 177.105 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 768' ' ' ARG . . . . . 0.525 ' HA ' ' HD2' ' A' ' 768' ' ' ARG . 2.3 mmm-85 -122.45 -72.89 0.66 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.013 0.435 . . . . 0.0 110.983 179.441 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -103.29 129.94 50.42 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.222 -0.658 . . . . 0.0 109.222 -178.398 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 770' ' ' ILE . . . . . 0.469 HG23 ' O ' ' A' ' 770' ' ' ILE . 0.2 OUTLIER -114.65 12.51 8.02 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 CA-C-O 121.645 0.736 . . . . 0.0 111.328 -173.241 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -76.15 41.83 1.58 Allowed Glycine 0 CA--C 1.521 0.411 0 CA-C-N 115.542 -0.753 . . . . 0.0 113.291 -177.35 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 772' ' ' ILE . . . . . 0.607 HG12 HG22 ' A' ' 752' ' ' VAL . 1.1 mm -105.84 145.01 30.04 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 174.514 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 773' ' ' PRO . . . . . 0.498 ' HB2' ' HG2' ' A' ' 780' ' ' GLU . 54.3 Cg_exo -51.11 107.77 0.19 Allowed 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.165 1.91 . . . . 0.0 111.817 173.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 774' ' ' LEU . . . . . 0.61 ' HG ' ' HG2' ' A' ' 776' ' ' LYS . 0.5 OUTLIER -101.99 -155.37 0.52 Allowed 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.255 179.618 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 775' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 1.8 mp0 -66.35 10.0 0.14 Allowed 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -179.085 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 776' ' ' LYS . . . . . 0.61 ' HG2' ' HG ' ' A' ' 774' ' ' LEU . 8.9 ptpt -71.03 -18.32 62.58 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 166.272 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -121.06 136.23 25.49 Favored Pre-proline 0 N--CA 1.451 -0.421 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.325 174.627 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -65.28 111.82 1.91 Allowed 'Trans proline' 0 CA--C 1.529 0.24 0 C-N-CA 122.587 2.191 . . . . 0.0 112.59 -177.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 110.14 -8.66 31.21 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.907 -0.663 . . . . 0.0 112.024 179.434 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 780' ' ' GLU . . . . . 0.498 ' HG2' ' HB2' ' A' ' 773' ' ' PRO . 0.1 OUTLIER -107.59 134.76 50.12 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 179.954 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 30.4 m95 -135.79 148.73 48.87 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.245 -0.28 . . . . 0.0 110.245 -178.086 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 782' ' ' VAL . . . . . 0.469 ' HB ' ' SG ' ' A' ' 766' ' ' CYS . 19.3 m -132.1 165.23 32.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 168.215 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 783' ' ' HIS . . . . . 0.416 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.2 OUTLIER -171.29 134.16 0.88 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.973 0.416 . . . . 0.0 111.502 177.038 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 784' ' ' SER . . . . . 0.487 ' O ' HG13 ' A' ' 785' ' ' VAL . 0.0 OUTLIER -98.81 99.25 10.31 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.515 178.208 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 785' ' ' VAL . . . . . 0.499 HG23 ' HE1' ' A' ' 765' ' ' PHE . 0.0 OUTLIER -171.39 -179.3 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 C-N-CA 122.796 0.438 . . . . 0.0 110.17 178.816 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 786' ' ' ALA . . . . . 0.648 ' HA ' HD11 ' A' ' 718' ' ' LEU . . . -107.95 22.24 16.23 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.696 -0.683 . . . . 0.0 109.92 171.817 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 787' ' ' ALA . . . . . 0.407 ' HB2' ' CZ ' ' A' ' 765' ' ' PHE . . . 58.98 63.11 3.9 Favored Pre-proline 0 N--CA 1.468 0.43 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.973 -178.857 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 788' ' ' PRO . . . . . 0.459 ' HD3' ' HB ' ' A' ' 785' ' ' VAL . 24.3 Cg_exo -63.71 -53.46 1.32 Allowed 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.569 2.179 . . . . 0.0 112.844 -178.151 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 8.2 p-80 -172.13 25.71 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 790' ' ' GLU . . . . . 0.451 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -121.9 -46.81 2.2 Favored 'General case' 0 C--N 1.323 -0.578 0 O-C-N 122.034 -0.416 . . . . 0.0 111.091 -179.963 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 791' ' ' LEU . . . . . 0.571 HD11 HG11 ' A' ' 763' ' ' VAL . 0.5 OUTLIER -57.85 -54.61 53.59 Favored Pre-proline 0 CA--C 1.537 0.48 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -178.826 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 792' ' ' PRO . . . . . 0.406 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 12.7 Cg_endo -60.59 -26.74 83.51 Favored 'Trans proline' 0 C--N 1.355 0.915 0 C-N-CA 121.432 1.421 . . . . 0.0 112.019 178.959 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -70.43 -43.54 69.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.955 0.407 . . . . 0.0 110.264 177.041 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 794' ' ' LEU . . . . . 0.528 ' O ' ' HB ' ' A' ' 798' ' ' ILE . 0.1 OUTLIER -61.91 -37.82 86.08 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.332 177.537 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 795' ' ' LEU . . . . . 0.422 HD21 HG21 ' A' ' 763' ' ' VAL . 1.3 mm? -63.04 -49.9 72.78 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.156 0.503 . . . . 0.0 110.816 179.477 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -59.99 -48.33 82.16 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.185 -179.227 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 797' ' ' ARG . . . . . 0.446 ' HG2' ' HA ' ' A' ' 794' ' ' LEU . 0.3 OUTLIER -71.99 -20.83 61.66 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.667 -178.288 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 798' ' ' ILE . . . . . 0.528 ' HB ' ' O ' ' A' ' 794' ' ' LEU . 0.1 OUTLIER -72.01 -31.19 39.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.959 0.409 . . . . 0.0 110.247 178.442 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -85.37 -56.22 3.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.216 175.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 800' ' ' LEU . . . . . 0.432 ' HG ' ' HA ' ' A' ' 797' ' ' ARG . 4.8 mt 47.26 60.53 3.39 Favored 'General case' 0 N--CA 1.467 0.391 0 O-C-N 123.934 0.771 . . . . 0.0 112.562 178.078 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 801' ' ' ILE . . . . . . . . . . . . . 17.7 mt -105.15 -53.42 6.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 176.494 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 64.96 -2.3 0.73 Allowed 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 114.979 -1.009 . . . . 0.0 113.088 171.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 803' ' ' MET . . . . . . . . . . . . . 12.2 ptm -160.4 99.66 1.31 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.398 0.618 . . . . 0.0 110.457 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 804' ' ' GLU . . . . . 0.419 ' HB2' ' HA3' ' A' ' 706' ' ' GLY . 0.2 OUTLIER -132.33 -72.4 0.53 Allowed 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.573 179.157 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 7.8 m 56.77 46.18 20.42 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 112.902 0.704 . . . . 0.0 112.902 172.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -87.36 -28.93 21.9 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 171.543 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 807' ' ' ASP . . . . . 0.459 ' N ' ' HD3' ' A' ' 808' ' ' PRO . 27.8 t70 64.47 66.14 1.01 Allowed Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 114.602 -1.181 . . . . 0.0 111.621 -176.167 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 808' ' ' PRO . . . . . 0.52 ' HD3' ' HA2' ' A' ' 706' ' ' GLY . 35.9 Cg_endo -95.26 51.25 0.2 Allowed 'Trans proline' 0 N--CA 1.449 -1.127 0 C-N-CA 123.495 2.796 . . . . 0.0 110.547 172.892 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -90.87 31.14 1.1 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.29 -174.145 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -98.32 127.23 44.16 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 174.405 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -166.9 98.04 0.54 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.172 -178.442 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 812' ' ' LEU . . . . . 0.408 ' HA ' ' HD3' ' A' ' 813' ' ' PRO . 1.4 pp -73.23 134.0 80.65 Favored Pre-proline 0 C--N 1.325 -0.459 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.558 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 813' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 812' ' ' LEU . 8.2 Cg_exo -71.86 88.31 0.8 Allowed 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.91 2.407 . . . . 0.0 111.915 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.56 96.35 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.259 175.387 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.8 102.84 15.44 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.547 -173.866 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -81.64 168.3 18.29 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.673 175.007 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.12 136.17 33.02 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 179.2 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -54.24 -49.14 70.17 Favored 'General case' 0 C--O 1.232 0.18 0 O-C-N 123.59 0.556 . . . . 0.0 110.384 179.156 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 72.1 t -90.5 136.5 23.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 173.249 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 4.5 m -67.25 84.15 0.14 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.298 0.57 . . . . 0.0 110.788 179.372 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -139.35 144.46 38.24 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.67 -178.729 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -147.41 12.81 1.06 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.931 0.396 . . . . 0.0 110.746 -178.818 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -132.11 134.39 45.41 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.653 0.739 . . . . 0.0 111.784 -174.583 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 824' ' ' ASP . . . . . 0.41 ' HB3' ' HE1' ' A' ' 849' ' ' TYR . 25.1 t70 -153.91 -69.87 0.14 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.925 -1.034 . . . . 0.0 108.667 175.636 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -106.78 124.57 49.8 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.457 173.092 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 826' ' ' MET . . . . . . . . . . . . . 2.9 ttt -96.64 113.26 24.81 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.456 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 827' ' ' ILE . . . . . 0.661 HD12 ' HB ' ' A' ' 871' ' ' ILE . 9.4 mm -113.13 134.46 55.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.281 -179.548 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 828' ' ' LEU . . . . . 0.908 HD23 HG12 ' A' ' 869' ' ' ILE . 0.3 OUTLIER -101.06 120.42 40.18 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.897 178.215 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -102.85 95.78 4.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.209 0.528 . . . . 0.0 110.088 178.828 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 830' ' ' VAL . . . . . 0.476 HG22 HD12 ' A' ' 828' ' ' LEU . 1.7 t -113.16 109.13 27.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.346 -177.807 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 831' ' ' ASP . . . . . 0.728 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 18.8 t70 -124.88 159.46 31.07 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 110.22 -0.289 . . . . 0.0 110.22 179.073 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 832' ' ' ASP . . . . . 0.697 ' HB3' ' HB3' ' A' ' 877' ' ' ASN . 35.0 t70 -75.0 -27.55 60.19 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.954 -176.819 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 6.6 m170 -120.47 111.32 34.96 Favored Pre-proline 0 C--N 1.326 -0.421 0 O-C-N 122.322 -0.236 . . . . 0.0 111.053 -174.035 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 834' ' ' PRO . . . . . 0.467 ' HA ' ' HD2' ' A' ' 837' ' ' ARG . 87.6 Cg_exo -43.59 -36.89 7.59 Favored 'Trans proline' 0 CA--C 1.532 0.407 0 C-N-CA 123.643 2.895 . . . . 0.0 114.369 -176.052 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 835' ' ' ILE . . . . . 0.512 ' O ' ' HG3' ' A' ' 838' ' ' ARG . 1.1 pp -66.13 -44.46 91.72 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 CA-C-O 120.888 0.375 . . . . 0.0 111.214 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 836' ' ' ASN . . . . . 0.445 ' HB3' ' OD2' ' A' ' 831' ' ' ASP . 18.3 t-20 -72.14 -41.87 66.65 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 177.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 837' ' ' ARG . . . . . 0.728 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 0.1 OUTLIER -53.8 -46.07 70.97 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.733 -1.121 . . . . 0.0 111.437 179.044 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 838' ' ' ARG . . . . . 0.512 ' HG3' ' O ' ' A' ' 835' ' ' ILE . 0.0 OUTLIER -72.76 -29.05 63.0 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 121.0 -0.28 . . . . 0.0 110.88 179.265 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.34 -47.11 83.53 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.645 -0.252 . . . . 0.0 111.371 -178.977 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 840' ' ' LEU . . . . . 0.473 ' H ' ' HG ' ' A' ' 840' ' ' LEU . 0.0 OUTLIER -71.35 -32.72 68.86 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.952 0.406 . . . . 0.0 110.254 178.188 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -63.64 -33.98 76.83 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.327 0.584 . . . . 0.0 110.39 177.047 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -65.53 -44.63 86.33 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.396 177.612 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 843' ' ' GLN . . . . . 0.752 ' HG3' HD23 ' A' ' 929' ' ' LEU . 1.2 mp0 -64.75 -41.69 95.73 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.542 179.012 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 844' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.66 -31.82 72.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.419 175.587 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -61.8 -43.12 99.65 Favored Glycine 0 N--CA 1.451 -0.329 0 CA-C-N 115.771 -0.649 . . . . 0.0 112.301 176.91 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -31.48 72.7 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.849 0.356 . . . . 0.0 110.626 176.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 847' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 847' ' ' LEU . 14.8 mt -66.77 -32.65 74.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.63 177.584 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 87.65 27.55 26.67 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.639 177.418 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 849' ' ' TYR . . . . . 0.467 ' HD1' ' HA ' ' A' ' 849' ' ' TYR . 0.1 OUTLIER -114.45 167.11 11.0 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 122.804 -0.233 . . . . 0.0 110.674 -179.261 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -71.01 118.64 14.05 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.481 -175.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -123.54 107.82 11.96 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.456 179.287 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.58 119.4 35.0 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 177.048 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.13 110.19 21.22 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.074 0.464 . . . . 0.0 111.709 -171.201 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 854' ' ' ALA . . . . . 0.446 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -121.78 155.93 34.26 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.897 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -137.23 79.07 1.73 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.341 -177.77 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 856' ' ' ASP . . . . . 0.434 ' CG ' ' H ' ' A' ' 857' ' ' GLY . 7.5 t70 -175.61 -166.92 0.22 Allowed 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.1 177.074 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 857' ' ' GLY . . . . . 0.434 ' H ' ' CG ' ' A' ' 856' ' ' ASP . . . -124.14 -53.61 0.19 Allowed Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 121.226 -0.511 . . . . 0.0 111.907 178.796 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -71.7 -31.02 40.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.899 0.381 . . . . 0.0 110.757 -177.346 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.76 -19.91 65.16 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.973 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 860' ' ' ALA . . . . . 0.473 ' O ' ' HG ' ' A' ' 864' ' ' LEU . . . -64.73 -51.06 64.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.753 0.311 . . . . 0.0 110.203 176.077 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 861' ' ' LEU . . . . . 0.859 HD23 HG13 ' A' ' 890' ' ' ILE . 1.4 tm? -58.87 -39.78 82.4 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.375 0.607 . . . . 0.0 109.636 175.275 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 28.7 t30 -55.02 -42.31 72.45 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.027 177.556 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 863' ' ' VAL . . . . . 0.591 HG13 HD13 ' A' ' 869' ' ' ILE . 0.4 OUTLIER -71.16 -32.34 47.36 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.71 -177.497 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 864' ' ' LEU . . . . . 0.724 HD13 HD21 ' A' ' 897' ' ' LEU . 4.4 mt -68.02 -37.59 81.57 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.409 0.623 . . . . 0.0 110.5 178.912 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 1.4 m -78.92 -16.14 57.39 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.317 179.254 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 1.4 mtmm -81.53 -57.49 3.44 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.514 177.169 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -139.53 151.32 46.03 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.448 -178.339 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 80.3 t60 -78.24 105.52 9.53 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.286 0.565 . . . . 0.0 111.156 -177.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 869' ' ' ILE . . . . . 0.908 HG12 HD23 ' A' ' 828' ' ' LEU . 1.5 mp -93.86 146.24 6.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 171.846 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -84.06 -52.34 6.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.817 0.341 . . . . 0.0 110.884 -175.141 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 871' ' ' ILE . . . . . 0.661 ' HB ' HD12 ' A' ' 827' ' ' ILE . 12.9 mm -124.59 122.46 63.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.14 -179.237 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 872' ' ' VAL . . . . . 0.634 ' HB ' HG13 ' A' ' 899' ' ' VAL . 2.5 t -103.54 124.94 58.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.863 178.147 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 873' ' ' LEU . . . . . . . . . . . . . 67.7 mt -107.25 110.29 22.29 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 176.186 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -113.62 99.7 7.93 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.679 -179.513 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 875' ' ' ASP . . . . . 0.516 ' HA ' HG13 ' A' ' 902' ' ' VAL . 47.2 t0 -97.48 113.26 24.91 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.219 -178.736 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -103.86 103.53 15.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.868 -178.004 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 877' ' ' ASN . . . . . 0.697 ' HB3' ' HB3' ' A' ' 832' ' ' ASP . 0.4 OUTLIER -65.45 -42.6 92.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.623 178.129 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 878' ' ' MET . . . . . 0.516 ' HG2' ' HB2' ' A' ' 880' ' ' ASN . 10.1 ttp -140.28 102.61 6.71 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.942 -177.561 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 879' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_exo -74.27 -60.74 0.04 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 122.557 2.171 . . . . 0.0 110.379 170.398 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 880' ' ' ASN . . . . . 0.516 ' HB2' ' HG2' ' A' ' 878' ' ' MET . 0.8 OUTLIER 46.03 64.31 1.52 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.464 -0.789 . . . . 0.0 112.31 175.438 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 5.1 tpt 78.42 -20.6 0.38 Allowed 'General case' 0 N--CA 1.471 0.605 0 O-C-N 123.923 0.764 . . . . 0.0 112.038 175.29 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 29.4 t0 -95.58 171.47 8.66 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 177.399 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . 103.43 -17.92 49.52 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.916 -0.659 . . . . 0.0 111.504 -176.783 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.63 -33.21 75.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.208 0.527 . . . . 0.0 109.754 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 885' ' ' ARG . . . . . 0.408 ' O ' ' HB2' ' A' ' 889' ' ' ARG . 0.6 OUTLIER -72.56 -31.33 65.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.528 176.919 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.59 -51.05 62.67 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.808 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 887' ' ' THR . . . . . 0.651 HG21 ' HB2' ' A' ' 916' ' ' GLU . 44.4 m -63.52 -41.48 98.48 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.037 0.446 . . . . 0.0 111.007 178.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 888' ' ' GLN . . . . . 0.478 ' O ' ' HB2' ' A' ' 892' ' ' GLN . 1.5 tp60 -63.2 -41.7 99.2 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.765 178.757 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 889' ' ' ARG . . . . . 0.408 ' HB2' ' O ' ' A' ' 885' ' ' ARG . 0.0 OUTLIER -66.09 -43.39 87.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.264 -178.227 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 890' ' ' ILE . . . . . 0.859 HG13 HD23 ' A' ' 861' ' ' LEU . 13.0 tt -66.37 -41.1 88.28 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.502 -176.753 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 891' ' ' ARG . . . . . 0.433 ' HG3' ' N ' ' A' ' 892' ' ' GLN . 0.2 OUTLIER -75.4 -29.09 59.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.541 0.21 . . . . 0.0 111.153 179.413 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 892' ' ' GLN . . . . . 0.478 ' HB2' ' O ' ' A' ' 888' ' ' GLN . 1.2 tp60 -73.31 -50.36 22.53 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 120.83 0.348 . . . . 0.0 111.389 -177.545 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.12 -38.16 78.73 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.725 -177.77 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 121.95 82.39 0.64 Allowed Glycine 0 N--CA 1.445 -0.752 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.656 177.771 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 895' ' ' LEU . . . . . 0.571 ' O ' ' HG ' ' A' ' 895' ' ' LEU . 0.1 OUTLIER -59.73 130.85 48.84 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 175.793 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -117.96 13.27 13.94 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.57 0.582 . . . . 0.0 112.57 -171.547 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 897' ' ' LEU . . . . . 0.724 HD21 HD13 ' A' ' 864' ' ' LEU . 0.0 OUTLIER -157.31 166.52 16.44 Favored Pre-proline 0 C--N 1.321 -0.645 0 CA-C-N 116.616 -0.266 . . . . 0.0 111.331 -174.38 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_exo -71.06 108.55 2.35 Favored 'Trans proline' 0 C--O 1.239 0.545 0 C-N-CA 122.492 2.128 . . . . 0.0 111.622 173.412 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 899' ' ' VAL . . . . . 0.634 HG13 ' HB ' ' A' ' 872' ' ' VAL . 2.4 t -97.54 121.32 47.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.868 176.539 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 900' ' ' ILE . . . . . . . . . . . . . 2.7 mp -103.48 106.27 19.87 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-O 121.242 0.544 . . . . 0.0 109.987 178.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -94.61 97.73 2.2 Favored Glycine 0 N--CA 1.443 -0.897 0 CA-C-N 115.458 -0.792 . . . . 0.0 112.203 -178.395 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 902' ' ' VAL . . . . . 0.516 HG13 ' HA ' ' A' ' 875' ' ' ASP . 0.2 OUTLIER -79.86 123.77 37.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 175.098 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -118.68 143.73 46.66 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.015 0.436 . . . . 0.0 111.094 -174.111 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 904' ' ' ALA . . . . . 0.548 ' HA ' ' HB2' ' A' ' 925' ' ' LYS . . . -82.22 119.23 23.82 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.198 178.7 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 62.8 56.68 1.87 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.985 174.412 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 906' ' ' ALA . . . . . 0.541 ' HB3' ' HG3' ' A' ' 909' ' ' GLU . . . -107.46 -39.08 5.75 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.232 174.794 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 72.48 -65.68 0.34 Allowed 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.797 177.673 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -82.86 53.93 2.56 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.077 0.465 . . . . 0.0 109.791 176.328 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 909' ' ' GLU . . . . . 0.541 ' HG3' ' HB3' ' A' ' 906' ' ' ALA . 3.4 mp0 -62.63 -35.24 78.95 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.928 -177.667 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 910' ' ' GLU . . . . . 0.476 ' H ' ' HG3' ' A' ' 910' ' ' GLU . 0.0 OUTLIER -62.62 -45.29 93.53 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.421 0.629 . . . . 0.0 110.194 176.289 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 1.1 tttt -63.69 -37.21 86.49 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.489 177.326 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 18.6 tt0 -60.57 -42.58 96.95 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.471 177.13 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.88 -40.34 76.03 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.563 178.542 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 3.9 m -75.58 -31.16 59.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.037 179.38 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.73 -52.73 18.98 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.664 -175.767 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 916' ' ' GLU . . . . . 0.651 ' HB2' HG21 ' A' ' 887' ' ' THR . 0.2 OUTLIER -79.23 -44.68 21.33 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.457 -177.341 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 67.4 m 50.72 45.4 27.12 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 123.257 0.348 . . . . 0.0 111.852 -176.802 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 918' ' ' GLY . . . . . 0.407 ' H ' ' CD ' ' A' ' 916' ' ' GLU . . . -122.23 -33.56 0.89 Allowed Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.561 -0.828 . . . . 0.0 112.133 -179.706 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 919' ' ' MET . . . . . 0.61 ' HB3' ' HB ' ' A' ' 899' ' ' VAL . 5.4 mmt -90.9 -71.82 0.61 Allowed 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 176.977 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 920' ' ' ASP . . . . . 0.449 ' HB2' ' O ' ' A' ' 919' ' ' MET . 13.6 t70 158.59 -67.34 0.0 OUTLIER 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 114.399 -1.273 . . . . 0.0 108.959 175.135 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -118.9 167.71 11.46 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.26 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 922' ' ' CYS . . . . . 0.535 ' HB2' ' O ' ' A' ' 909' ' ' GLU . 85.0 m -143.47 133.71 24.51 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.225 -0.443 . . . . 0.0 109.985 177.221 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 923' ' ' LEU . . . . . . . . . . . . . 56.0 mt -120.93 169.4 10.5 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.9 -178.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 924' ' ' SER . . . . . 0.435 ' O ' HG23 ' A' ' 927' ' ' VAL . 0.7 OUTLIER -84.66 150.4 25.17 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.4 177.066 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 925' ' ' LYS . . . . . 0.548 ' HB2' ' HA ' ' A' ' 904' ' ' ALA . 0.0 OUTLIER -58.38 -40.82 85.69 Favored Pre-proline 0 CA--C 1.541 0.621 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -179.432 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -64.8 73.83 0.22 Allowed 'Trans proline' 0 C--N 1.357 0.999 0 C-N-CA 122.102 1.868 . . . . 0.0 112.757 173.433 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 927' ' ' VAL . . . . . 0.435 HG23 ' O ' ' A' ' 924' ' ' SER . 8.9 t -100.94 114.54 40.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 121.12 0.486 . . . . 0.0 109.828 174.791 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.53 177.46 7.74 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.251 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 929' ' ' LEU . . . . . 0.752 HD23 ' HG3' ' A' ' 843' ' ' GLN . 1.6 tm? -57.82 -45.45 86.15 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.804 0.335 . . . . 0.0 110.401 177.723 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 930' ' ' ASP . . . . . 0.443 ' O ' ' HG2' ' A' ' 934' ' ' GLN . 3.4 t0 -66.5 -40.65 89.37 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.665 -178.452 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 50.8 t -64.7 -47.9 86.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.868 -179.1 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 932' ' ' ILE . . . . . 0.407 HG22 ' O ' ' A' ' 929' ' ' LEU . 0.0 OUTLIER -64.95 -31.97 56.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.936 0.398 . . . . 0.0 110.09 178.673 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 4.8 ttmt -65.74 -48.31 72.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.242 177.36 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 934' ' ' GLN . . . . . 0.459 ' O ' ' HB3' ' A' ' 938' ' ' LEU . 56.5 mm-40 -60.54 -48.77 80.29 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.447 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 13.4 m -59.62 -51.85 68.06 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.371 -178.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 936' ' ' LEU . . . . . 0.466 HD11 HG13 ' A' ' 827' ' ' ILE . 0.3 OUTLIER -63.65 -47.19 82.28 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.208 -177.76 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 32.3 m -63.53 -50.29 70.15 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -178.014 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 938' ' ' LEU . . . . . 0.459 ' HB3' ' O ' ' A' ' 934' ' ' GLN . 0.0 OUTLIER -66.32 -36.33 82.66 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.466 -0.333 . . . . 0.0 111.232 -175.832 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -76.03 -37.66 58.11 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.843 -0.343 . . . . 0.0 111.03 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -65.07 -37.77 88.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.947 0.403 . . . . 0.0 110.713 178.498 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 941' ' ' GLU . . . . . 0.649 ' O ' ' HG2' ' A' ' 945' ' ' LYS . 2.2 pt-20 -75.76 -29.01 58.69 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.678 -0.409 . . . . 0.0 110.52 177.385 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 942' ' ' ARG . . . . . . . . . . . . . 1.4 tpt85 -66.59 -47.49 72.56 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.567 179.09 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 27.9 m -67.24 -29.16 44.96 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 121.283 0.563 . . . . 0.0 109.861 176.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.91 -24.93 66.15 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.804 175.861 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 945' ' ' LYS . . . . . 0.649 ' HG2' ' O ' ' A' ' 941' ' ' GLU . 9.6 mmtt -73.87 -43.63 58.0 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 120.855 0.36 . . . . 0.0 110.183 176.821 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.32 -30.89 71.92 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.743 177.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.39 -19.31 46.6 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.248 174.862 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 29.6 t70 73.18 -95.24 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.957 -1.02 . . . . 0.0 111.538 177.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.252 1.225 0 CA-C-O 117.935 -1.031 . . . . 0.0 109.817 -178.631 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 2.7 ptt? . . . . . 0 N--CA 1.477 0.891 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 73.49 61.94 3.22 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.876 -0.678 . . . . 0.0 111.814 -176.124 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . -109.56 120.6 5.81 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 120.862 -0.685 . . . . 0.0 111.809 -179.382 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.08 -57.6 10.97 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.694 0.283 . . . . 0.0 111.029 -179.51 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . 72.59 -143.26 33.66 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.685 -0.769 . . . . 0.0 111.915 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 9.9 m -94.99 141.21 15.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.011 0.434 . . . . 0.0 111.072 -179.27 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -128.6 -132.27 0.22 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.118 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . 91.29 -65.62 2.49 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 121.013 -0.613 . . . . 0.0 113.343 175.267 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.441 HD21 HG12 ' A' ' 801' ' ' ILE . 8.8 mt -80.55 -56.78 3.93 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.925 0.393 . . . . 0.0 111.416 -175.808 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 3.3 m -66.1 131.21 45.66 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.368 -176.459 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 106.75 -12.71 42.18 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.76 175.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -75.48 132.0 40.49 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 174.618 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 708' ' ' ARG . . . . . 0.726 ' HG3' ' HB ' ' A' ' 732' ' ' VAL . 2.8 ttt180 -97.3 152.78 18.55 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.19 0.519 . . . . 0.0 111.445 -171.586 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -130.18 117.84 20.51 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.947 176.502 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 710' ' ' TRP . . . . . 0.469 ' O ' HD23 ' A' ' 747' ' ' LEU . 47.2 m95 -94.82 120.19 34.65 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.56 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 711' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -122.36 132.38 54.35 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.393 0.616 . . . . 0.0 111.199 -177.686 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -125.76 70.4 1.2 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.422 176.093 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 713' ' ' VAL . . . . . 0.643 HG13 ' HB3' ' A' ' 750' ' ' ASP . 60.8 t -128.15 120.58 53.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.114 -0.948 . . . . 0.0 109.952 -176.727 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 714' ' ' ARG . . . . . 0.572 ' HD2' ' OD2' ' A' ' 750' ' ' ASP . 0.3 OUTLIER -91.94 -8.99 44.71 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.385 -175.734 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -83.23 113.65 20.82 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 176.2 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 716' ' ' ALA . . . . . 0.402 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -58.0 -43.95 86.93 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.49 -173.793 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.34 -45.66 86.89 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.009 0.433 . . . . 0.0 110.331 -179.171 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.15 -50.55 60.8 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.235 -179.396 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 719' ' ' CYS . . . . . 0.402 ' SG ' ' HA ' ' A' ' 716' ' ' ALA . 13.9 p -67.13 -44.9 78.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.221 -174.446 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 720' ' ' GLN . . . . . 0.631 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 0.3 OUTLIER -65.51 -37.87 88.04 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 121.002 -0.279 . . . . 0.0 111.173 -177.016 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 39.2 t80 -60.59 -48.16 83.02 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 121.013 -0.275 . . . . 0.0 110.692 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 722' ' ' LEU . . . . . 0.418 HD13 HG21 ' A' ' 748' ' ' ILE . 15.9 mt -66.16 -48.78 69.62 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.628 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 723' ' ' GLU . . . . . 0.887 ' HB2' HG11 ' A' ' 733' ' ' VAL . 8.7 pt-20 -61.88 -37.49 84.75 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.721 -175.181 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 724' ' ' THR . . . . . 0.541 ' HA ' ' HG2' ' A' ' 727' ' ' GLN . 26.2 m -68.96 -38.23 79.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.92 0.391 . . . . 0.0 110.797 179.226 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 24.3 m -70.71 -28.41 64.71 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.11 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 726' ' ' LEU . . . . . . . . . . . . . 18.3 mt -80.14 -44.21 20.3 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.98 0.419 . . . . 0.0 110.747 179.142 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 727' ' ' GLN . . . . . 0.541 ' HG2' ' HA ' ' A' ' 724' ' ' THR . 12.2 pt20 -72.03 -7.89 51.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.957 0.408 . . . . 0.0 110.705 178.183 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.74 -29.06 70.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.922 178.104 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 2.1 p -104.66 -88.55 0.43 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.065 0.459 . . . . 0.0 110.553 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 730' ' ' GLY . . . . . . . . . . . . . . . -158.05 19.68 0.35 Allowed Glycine 0 N--CA 1.445 -0.751 0 N-CA-C 111.343 -0.703 . . . . 0.0 111.343 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 731' ' ' ILE . . . . . . . . . . . . . 35.0 mm -79.35 128.09 38.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 120.886 0.374 . . . . 0.0 110.601 -179.338 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 732' ' ' VAL . . . . . 0.726 ' HB ' ' HG3' ' A' ' 708' ' ' ARG . 0.1 OUTLIER -79.15 89.26 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.554 -179.525 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 733' ' ' VAL . . . . . 0.887 HG11 ' HB2' ' A' ' 723' ' ' GLU . 94.7 t -66.09 114.43 3.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.015 176.416 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -130.13 133.41 46.62 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.15 0.5 . . . . 0.0 110.862 -178.703 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.8 124.15 20.74 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.926 178.532 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -85.09 96.29 9.39 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.296 0.57 . . . . 0.0 110.556 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -107.95 -10.81 15.45 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.299 178.835 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 148.27 57.1 0.01 OUTLIER Glycine 0 CA--C 1.51 -0.25 0 N-CA-C 111.199 -0.76 . . . . 0.0 111.199 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 17.2 mp0 -106.81 173.99 6.08 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.953 0.406 . . . . 0.0 111.59 -173.069 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 740' ' ' GLU . . . . . 0.434 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 6.2 mm-40 -75.38 141.52 73.6 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.557 -177.725 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 741' ' ' PRO . . . . . 0.589 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 1.9 Cg_endo -84.72 123.52 2.88 Favored 'Trans proline' 0 N--CA 1.455 -0.744 0 C-N-CA 123.108 2.539 . . . . 0.0 112.415 176.388 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 742' ' ' THR . . . . . 0.497 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.0 OUTLIER -111.95 138.26 21.62 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.468 177.564 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 743' ' ' PRO . . . . . 0.497 ' HD2' HG22 ' A' ' 742' ' ' THR . 40.5 Cg_endo -67.12 -6.65 16.63 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 123.166 2.578 . . . . 0.0 113.916 -175.236 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -109.13 1.12 20.16 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.8 0.333 . . . . 0.0 110.895 178.044 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 82.7 m-20 -117.01 157.51 25.69 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-N 116.279 -0.419 . . . . 0.0 109.979 -175.277 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 746' ' ' VAL . . . . . 0.423 HG21 HD11 ' A' ' 795' ' ' LEU . 0.8 OUTLIER -123.6 149.08 27.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 120.915 0.388 . . . . 0.0 111.156 -177.809 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 747' ' ' LEU . . . . . 0.469 HD23 ' O ' ' A' ' 710' ' ' TRP . 0.0 OUTLIER -105.82 112.56 25.68 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.877 176.191 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 748' ' ' ILE . . . . . 0.418 HG21 HD13 ' A' ' 722' ' ' LEU . 17.9 mt -98.88 114.19 35.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 176.76 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 34.8 p -115.01 148.99 38.14 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.685 0.279 . . . . 0.0 111.253 -174.799 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 750' ' ' ASP . . . . . 0.643 ' HB3' HG13 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -98.82 123.28 42.97 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 171.303 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 751' ' ' GLU . . . . . 0.478 ' HB3' ' H ' ' A' ' 752' ' ' VAL . 10.2 mm-40 57.89 -156.48 0.32 Allowed 'General case' 0 C--O 1.236 0.361 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.356 -175.419 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 752' ' ' VAL . . . . . 0.67 HG22 ' H ' ' A' ' 771' ' ' GLY . 4.9 t -87.55 141.06 14.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 121.103 0.478 . . . . 0.0 111.422 -174.251 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 15.6 m -125.29 160.54 30.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.908 177.553 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -84.66 56.56 3.92 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.948 0.404 . . . . 0.0 110.9 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.72 176.3 12.14 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.415 179.304 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.53 -39.24 2.03 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.411 -179.902 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 757' ' ' TRP . . . . . 0.589 ' CH2' ' HA ' ' A' ' 741' ' ' PRO . 76.0 t-105 70.46 158.88 0.19 Allowed 'General case' 0 CA--C 1.537 0.462 0 O-C-N 123.702 0.626 . . . . 0.0 111.576 177.701 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -134.15 -85.45 0.42 Allowed 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 172.175 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 759' ' ' GLY . . . . . . . . . . . . . . . 50.25 -136.44 26.03 Favored Glycine 0 C--N 1.334 0.452 0 CA-C-N 116.394 -0.366 . . . . 0.0 112.946 176.289 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 30.7 ttm-85 -85.29 -50.58 7.23 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.241 0.543 . . . . 0.0 109.587 172.717 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -166.54 158.85 13.8 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.028 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 762' ' ' VAL . . . . . 0.494 ' HB ' ' CD1' ' A' ' 757' ' ' TRP . 2.4 p -120.41 128.09 75.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 174.334 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 763' ' ' VAL . . . . . 0.732 HG11 HD21 ' A' ' 791' ' ' LEU . 11.9 t -112.06 104.71 17.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 121.085 0.469 . . . . 0.0 110.273 -178.919 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 764' ' ' THR . . . . . . . . . . . . . 36.7 m -98.38 125.25 43.45 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.043 -179.088 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 765' ' ' PHE . . . . . 0.441 ' CE2' HG23 ' A' ' 785' ' ' VAL . 14.8 m-85 -83.12 112.99 20.32 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.661 175.275 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -95.1 133.03 39.36 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.161 -178.172 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 767' ' ' ARG . . . . . 0.513 ' HD2' ' HA ' ' A' ' 767' ' ' ARG . 13.6 mmm-85 -118.55 -48.37 2.5 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.731 0.301 . . . . 0.0 110.233 178.153 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.41 -19.13 1.25 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.941 -178.04 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -138.09 144.3 40.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.921 0.391 . . . . 0.0 111.013 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 16.2 mt -124.25 87.59 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.573 -178.419 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 771' ' ' GLY . . . . . 0.67 ' H ' HG22 ' A' ' 752' ' ' VAL . . . -85.7 -33.88 14.93 Favored Glycine 0 N--CA 1.45 -0.378 0 N-CA-C 111.207 -0.757 . . . . 0.0 111.207 175.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 772' ' ' ILE . . . . . 0.439 ' HA ' ' HD3' ' A' ' 773' ' ' PRO . 0.9 OUTLIER -98.5 116.17 65.54 Favored Pre-proline 0 C--N 1.322 -0.596 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 173.118 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 773' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 772' ' ' ILE . 6.0 Cg_exo -77.51 -177.98 4.25 Favored 'Trans proline' 0 N--CA 1.461 -0.439 0 C-N-CA 123.101 2.534 . . . . 0.0 113.41 -174.432 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 774' ' ' LEU . . . . . 0.524 HD23 ' H ' ' A' ' 774' ' ' LEU . 1.7 pt? -88.06 -161.2 0.7 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.464 179.374 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 775' ' ' GLU . . . . . 0.502 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 9.8 mp0 -65.37 62.95 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 113.632 0.975 . . . . 0.0 113.632 -176.897 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 776' ' ' LYS . . . . . 0.427 ' HD3' ' CB ' ' A' ' 773' ' ' PRO . 0.1 OUTLIER -108.42 0.85 21.3 Favored 'General case' 0 C--N 1.309 -1.171 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 168.963 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 777' ' ' ALA . . . . . 0.685 ' HB1' ' HD2' ' A' ' 778' ' ' PRO . . . -132.17 164.55 42.41 Favored Pre-proline 0 N--CA 1.447 -0.601 0 CA-C-N 113.833 -1.53 . . . . 0.0 108.435 177.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 778' ' ' PRO . . . . . 0.685 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 14.0 Cg_endo -55.91 -17.96 20.59 Favored 'Trans proline' 0 CA--C 1.534 0.476 0 C-N-CA 123.087 2.525 . . . . 0.0 114.577 -173.58 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . -158.54 34.57 0.5 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 119.71 -1.234 . . . . 0.0 113.397 -177.034 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 780' ' ' GLU . . . . . 0.54 ' HB2' ' HB3' ' A' ' 777' ' ' ALA . 0.1 OUTLIER -97.99 122.66 41.38 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.95 0.375 . . . . 0.0 110.043 178.622 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 16.4 m95 -131.46 146.71 52.37 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.521 -178.655 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 4.8 m -139.18 153.89 24.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.553 176.683 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 783' ' ' HIS . . . . . 0.41 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.9 OUTLIER -155.66 127.5 7.46 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.979 0.419 . . . . 0.0 110.688 173.056 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -95.0 99.93 11.86 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.633 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 785' ' ' VAL . . . . . 0.45 ' HB ' ' HD3' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -166.96 -173.57 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.931 179.629 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -124.39 48.19 1.98 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.904 0.383 . . . . 0.0 110.658 175.281 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 787' ' ' ALA . . . . . 0.406 ' N ' ' HD3' ' A' ' 788' ' ' PRO . . . 54.05 66.17 4.63 Favored Pre-proline 0 N--CA 1.467 0.386 0 CA-C-N 115.248 -0.887 . . . . 0.0 112.547 178.547 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 788' ' ' PRO . . . . . 0.775 ' HD2' ' OE1' ' A' ' 790' ' ' GLU . 17.0 Cg_exo -68.75 -61.75 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.655 2.236 . . . . 0.0 111.673 175.653 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 789' ' ' HIS . . . . . 0.501 ' HB3' ' O ' ' A' ' 788' ' ' PRO . 0.1 OUTLIER 175.79 10.47 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 O-C-N 123.32 0.388 . . . . 0.0 111.881 178.235 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 790' ' ' GLU . . . . . 0.775 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -93.77 -41.95 9.4 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.812 0.339 . . . . 0.0 110.6 -175.724 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 791' ' ' LEU . . . . . 0.732 HD21 HG11 ' A' ' 763' ' ' VAL . 0.2 OUTLIER -62.86 -49.17 83.29 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.667 -179.976 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 792' ' ' PRO . . . . . 0.524 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 10.7 Cg_endo -56.12 -30.94 81.35 Favored 'Trans proline' 0 C--N 1.354 0.864 0 C-N-CA 121.8 1.667 . . . . 0.0 112.042 175.402 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -72.91 -44.72 60.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.772 178.097 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -61.68 -38.18 86.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.181 177.05 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 795' ' ' LEU . . . . . 0.423 HD11 HG21 ' A' ' 746' ' ' VAL . 0.4 OUTLIER -66.68 -42.65 86.19 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.886 -179.774 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 796' ' ' ALA . . . . . 0.477 ' HB1' HD12 ' A' ' 801' ' ' ILE . . . -63.85 -38.34 90.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.117 0.484 . . . . 0.0 110.481 176.734 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.17 -44.6 87.98 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.74 178.239 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -69.05 -22.15 25.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.525 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.741 -176.789 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -85.3 0.35 52.29 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.03 0.443 . . . . 0.0 110.126 176.33 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 6.6 mt 68.1 71.8 0.31 Allowed 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 114.847 -1.069 . . . . 0.0 112.521 171.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 801' ' ' ILE . . . . . 0.477 HD12 ' HB1' ' A' ' 796' ' ' ALA . 59.2 mt -97.52 -66.37 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 171.318 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 51.19 51.73 16.35 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.274 -0.875 . . . . 0.0 113.084 170.23 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 803' ' ' MET . . . . . . . . . . . . . 7.2 ptp -149.88 124.67 9.84 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.422 175.519 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 804' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -153.91 148.79 26.61 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.462 179.066 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.73 76.33 9.59 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.192 0.52 . . . . 0.0 110.557 177.635 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -114.18 108.33 16.81 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.672 -178.203 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 28.3 t0 -142.87 85.16 10.15 Favored Pre-proline 0 C--N 1.326 -0.427 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.619 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 808' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_exo -71.57 137.53 30.54 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 123.201 2.6 . . . . 0.0 112.321 -179.233 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -95.88 144.43 26.22 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.7 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -147.56 143.29 27.67 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.095 -179.408 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -132.32 102.25 5.68 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.721 0.296 . . . . 0.0 111.105 -179.41 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -128.63 86.07 58.62 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-O 120.894 0.378 . . . . 0.0 110.238 176.828 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -85.8 162.82 10.56 Favored 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 123.043 2.495 . . . . 0.0 113.283 -176.588 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -132.13 137.67 47.77 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.3 176.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.97 116.52 10.19 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.026 0.441 . . . . 0.0 111.825 -177.726 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -132.3 118.45 19.47 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.714 178.524 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 2.5 ttpm? -129.76 95.34 3.95 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.36 -178.081 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -125.19 103.92 8.23 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.058 179.452 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -138.76 141.9 35.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.111 178.635 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -138.88 116.83 11.62 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.927 0.394 . . . . 0.0 111.245 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -78.84 144.54 34.92 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 173.226 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -143.1 -64.89 0.39 Allowed 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 113.426 0.898 . . . . 0.0 113.426 -168.128 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -67.25 125.72 26.98 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -168.29 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -163.3 90.81 0.67 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.866 -1.061 . . . . 0.0 109.74 174.306 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -116.68 120.36 38.37 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.834 178.27 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 826' ' ' MET . . . . . 0.482 ' O ' HG22 ' A' ' 869' ' ' ILE . 18.9 ttm -95.13 118.58 32.17 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.349 0.595 . . . . 0.0 112.193 -172.163 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 827' ' ' ILE . . . . . 0.98 ' HB ' HD21 ' A' ' 844' ' ' LEU . 2.5 mm -115.9 135.82 54.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.779 177.404 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 828' ' ' LEU . . . . . 0.467 HD23 HG13 ' A' ' 872' ' ' VAL . 2.7 tp -117.28 128.99 55.61 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.111 0.481 . . . . 0.0 111.094 -177.698 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 829' ' ' VAL . . . . . 0.675 HG12 HD11 ' A' ' 873' ' ' LEU . 0.0 OUTLIER -110.1 110.38 31.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.269 179.511 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 830' ' ' VAL . . . . . 0.709 HG13 ' HB3' ' A' ' 854' ' ' ALA . 0.0 OUTLIER -113.07 101.63 12.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.594 -179.261 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 831' ' ' ASP . . . . . 0.711 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 5.7 t70 -104.76 157.18 17.38 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 110.089 -0.337 . . . . 0.0 110.089 178.774 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -90.06 -21.42 22.33 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.053 177.886 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 833' ' ' HIS . . . . . 0.404 ' HA ' ' HD3' ' A' ' 834' ' ' PRO . 25.7 m170 -111.79 123.04 35.57 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.592 -178.42 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 834' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 833' ' ' HIS . 66.3 Cg_exo -52.25 -44.72 44.3 Favored 'Trans proline' 0 C--O 1.237 0.446 0 C-N-CA 123.666 2.911 . . . . 0.0 114.191 -173.499 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -71.87 -40.14 68.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.637 0.256 . . . . 0.0 111.082 -176.119 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 836' ' ' ASN . . . . . 0.423 ' CG ' ' HE3' ' A' ' 925' ' ' LYS . 5.1 t30 -68.31 -37.04 80.21 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 178.134 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 837' ' ' ARG . . . . . 0.711 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 4.3 ttp85 -54.12 -44.09 71.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.736 176.2 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 838' ' ' ARG . . . . . 0.454 ' HD2' ' O ' ' A' ' 838' ' ' ARG . 0.0 OUTLIER -65.26 -37.66 87.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.217 178.676 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 839' ' ' LEU . . . . . 0.441 ' HG ' ' NE2' ' A' ' 843' ' ' GLN . 9.2 tp -61.1 -49.8 75.84 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.645 -176.588 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 840' ' ' LEU . . . . . 0.524 HD11 ' HB2' ' A' ' 831' ' ' ASP . 0.0 OUTLIER -70.32 -35.57 73.73 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.778 179.564 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -62.79 -39.51 94.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.109 0.48 . . . . 0.0 110.772 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -70.23 -42.62 72.0 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.562 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 843' ' ' GLN . . . . . 0.94 ' HG2' HD12 ' A' ' 929' ' ' LEU . 20.8 mt-30 -55.98 -49.51 73.4 Favored 'General case' 0 C--O 1.23 0.078 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.363 176.321 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 844' ' ' LEU . . . . . 0.98 HD21 ' HB ' ' A' ' 827' ' ' ILE . 0.2 OUTLIER -59.65 -40.38 87.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.018 178.329 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -68.07 -24.05 74.56 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 121.069 -0.586 . . . . 0.0 112.502 179.024 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 5.4 m -86.31 -25.94 25.18 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.911 0.386 . . . . 0.0 110.591 178.767 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 847' ' ' LEU . . . . . 0.577 HD21 ' HA ' ' A' ' 933' ' ' LYS . 0.2 OUTLIER -67.54 -31.76 72.07 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.87 179.209 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 96.76 52.04 1.58 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.473 178.444 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 54.0 m-85 -133.65 174.56 10.31 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 178.362 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.4 107.89 13.57 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 175.477 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -97.57 129.85 44.67 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.618 -174.268 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 852' ' ' LYS . . . . . 0.468 ' HE2' ' SD ' ' A' ' 826' ' ' MET . 1.5 mptt -125.11 122.7 37.9 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 171.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 853' ' ' THR . . . . . 0.533 HG23 HG23 ' A' ' 829' ' ' VAL . 0.2 OUTLIER -110.6 144.28 39.72 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.911 0.386 . . . . 0.0 111.905 -175.083 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 854' ' ' ALA . . . . . 0.709 ' HB3' HG13 ' A' ' 830' ' ' VAL . . . -148.51 151.25 34.81 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.705 174.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 855' ' ' ASN . . . . . 0.474 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 1.1 t30 -130.69 74.56 1.6 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.318 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 856' ' ' ASP . . . . . 0.624 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 24.2 t0 171.26 146.65 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.34 0 O-C-N 123.595 0.559 . . . . 0.0 110.467 -178.554 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -75.3 -35.16 49.14 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.622 -0.799 . . . . 0.0 111.278 175.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 858' ' ' VAL . . . . . 0.407 ' H ' HG23 ' A' ' 858' ' ' VAL . 0.6 OUTLIER -68.65 -34.58 65.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 120.95 0.405 . . . . 0.0 110.415 178.077 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 859' ' ' ASP . . . . . 0.624 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 1.2 t70 -71.1 -30.11 66.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.455 179.36 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 860' ' ' ALA . . . . . 0.641 ' HB2' HG11 ' A' ' 830' ' ' VAL . . . -64.5 -39.15 93.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.337 176.169 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 861' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.79 -40.23 83.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.181 175.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -59.53 -52.95 63.38 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.952 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 7.6 p -65.06 -31.36 53.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.04 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 864' ' ' LEU . . . . . 0.732 HD21 HD11 ' A' ' 897' ' ' LEU . 0.2 OUTLIER -65.48 -32.9 74.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.905 0.383 . . . . 0.0 111.319 179.167 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 865' ' ' SER . . . . . 0.427 ' HB3' HD11 ' A' ' 893' ' ' LEU . 0.1 OUTLIER -88.59 -16.83 31.49 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.924 0.392 . . . . 0.0 111.04 -178.198 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.03 -27.81 15.43 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.794 -177.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -146.02 158.2 43.87 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.691 0.281 . . . . 0.0 110.811 -175.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -90.31 -28.27 18.87 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 176.894 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 869' ' ' ILE . . . . . 0.482 HG22 ' O ' ' A' ' 826' ' ' MET . 2.3 mt 56.93 -136.52 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.528 0.135 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 -177.537 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 870' ' ' ASP . . . . . 0.429 ' H ' HG22 ' A' ' 869' ' ' ILE . 0.3 OUTLIER -157.95 -52.42 0.07 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.11 0.481 . . . . 0.0 109.824 169.309 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 871' ' ' ILE . . . . . . . . . . . . . 7.4 mm -122.4 124.0 69.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.726 179.418 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 872' ' ' VAL . . . . . 0.491 ' O ' ' HA ' ' A' ' 899' ' ' VAL . 38.4 t -118.27 129.28 74.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.316 178.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 873' ' ' LEU . . . . . 0.675 HD11 HG12 ' A' ' 829' ' ' VAL . 0.7 OUTLIER -131.76 135.23 46.64 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 177.152 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 874' ' ' SER . . . . . 0.505 ' HA ' ' O ' ' A' ' 830' ' ' VAL . 0.9 OUTLIER -123.69 126.63 46.89 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.686 -177.459 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 875' ' ' ASP . . . . . 0.481 ' HA ' ' O ' ' A' ' 902' ' ' VAL . 40.5 t0 -111.21 120.14 41.28 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.41 -178.291 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 4.1 t -121.39 131.93 71.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.031 -176.573 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 877' ' ' ASN . . . . . 0.43 ' HB2' ' HE2' ' A' ' 925' ' ' LYS . 57.7 t30 -121.96 53.02 1.23 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.073 0.464 . . . . 0.0 110.863 179.049 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 878' ' ' MET . . . . . 0.555 ' HG2' ' HB3' ' A' ' 881' ' ' MET . 0.3 OUTLIER -139.15 110.72 7.77 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.13 179.232 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 879' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -65.03 -49.16 2.97 Favored 'Trans proline' 0 CA--C 1.529 0.261 0 C-N-CA 122.606 2.204 . . . . 0.0 112.005 179.365 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -108.26 109.21 20.51 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.525 177.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 881' ' ' MET . . . . . 0.555 ' HB3' ' HG2' ' A' ' 878' ' ' MET . 0.3 OUTLIER -157.55 -174.92 5.1 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.111 0.482 . . . . 0.0 110.978 -175.943 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -122.21 -159.74 0.84 Allowed 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 171.445 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . 109.54 9.01 25.92 Favored Glycine 0 N--CA 1.445 -0.723 0 N-CA-C 110.397 -1.081 . . . . 0.0 110.397 -172.056 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.2 -28.28 68.64 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 176.626 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 885' ' ' ARG . . . . . 0.474 ' O ' ' HB2' ' A' ' 889' ' ' ARG . 0.0 OUTLIER -63.82 -31.11 72.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.285 173.939 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 886' ' ' LEU . . . . . 0.453 ' O ' ' HB ' ' A' ' 890' ' ' ILE . 0.0 OUTLIER -68.32 -45.58 72.58 Favored 'General case' 0 C--O 1.226 -0.172 0 CA-C-N 116.662 -0.244 . . . . 0.0 110.523 -177.532 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.59 -43.82 92.61 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.114 0.483 . . . . 0.0 110.814 179.544 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 2.9 tm0? -63.96 -51.46 64.25 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.89 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 889' ' ' ARG . . . . . 0.474 ' HB2' ' O ' ' A' ' 885' ' ' ARG . 0.2 OUTLIER -72.51 -28.17 62.71 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.776 -0.647 . . . . 0.0 112.124 -174.611 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 890' ' ' ILE . . . . . 0.453 ' HB ' ' O ' ' A' ' 886' ' ' LEU . 0.8 OUTLIER -71.65 -38.59 67.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.707 179.273 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 891' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.18 -24.88 54.76 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.121 0.486 . . . . 0.0 109.749 176.559 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -77.3 -31.89 55.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.459 179.3 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 893' ' ' LEU . . . . . 0.427 HD11 ' HB3' ' A' ' 865' ' ' SER . 1.6 tp -73.57 -49.36 26.73 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.345 -179.728 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 133.93 63.61 0.07 OUTLIER Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.297 -0.954 . . . . 0.0 112.161 -179.343 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 895' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.38 110.22 17.33 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.94 -0.392 . . . . 0.0 109.94 175.822 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -115.92 34.04 5.18 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.292 0.568 . . . . 0.0 110.996 -178.852 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 897' ' ' LEU . . . . . 0.732 HD11 HD21 ' A' ' 864' ' ' LEU . 0.2 OUTLIER -141.52 148.93 52.36 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.925 -178.283 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -69.66 130.12 18.9 Favored 'Trans proline' 0 C--O 1.24 0.599 0 C-N-CA 122.647 2.232 . . . . 0.0 113.03 -177.398 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 899' ' ' VAL . . . . . 0.7 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 8.0 t -112.05 129.45 67.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.586 176.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 900' ' ' ILE . . . . . 0.428 ' CG2' ' HG ' ' A' ' 923' ' ' LEU . 3.0 mp -99.2 111.93 30.07 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 175.805 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 901' ' ' GLY . . . . . 0.43 ' HA3' ' SD ' ' A' ' 919' ' ' MET . . . -95.07 101.13 2.67 Favored Glycine 0 N--CA 1.442 -0.938 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.035 -177.433 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 902' ' ' VAL . . . . . 1.017 ' HB ' ' HB2' ' A' ' 923' ' ' LEU . 0.1 OUTLIER -96.21 128.17 47.65 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 178.898 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 903' ' ' THR . . . . . 0.478 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.2 OUTLIER -135.51 169.12 18.0 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.321 -176.492 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 904' ' ' ALA . . . . . 0.576 ' HB2' ' HB2' ' A' ' 925' ' ' LYS . . . -142.81 104.73 4.38 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.678 0.275 . . . . 0.0 111.307 177.354 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 63.4 t30 58.3 74.01 0.45 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.175 -0.921 . . . . 0.0 113.217 172.641 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 906' ' ' ALA . . . . . 0.618 ' HB3' ' HG3' ' A' ' 909' ' ' GLU . . . -117.76 -2.06 11.45 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 169.704 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 2.3 tp 71.76 -56.1 0.65 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 114.87 -1.059 . . . . 0.0 112.746 175.579 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 908' ' ' ALA . . . . . 0.588 ' O ' ' HB2' ' A' ' 912' ' ' GLN . . . -92.14 12.58 21.69 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -172.889 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 909' ' ' GLU . . . . . 0.618 ' HG3' ' HB3' ' A' ' 906' ' ' ALA . 0.5 OUTLIER -63.36 -36.19 82.89 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.583 0.23 . . . . 0.0 111.338 -175.192 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 910' ' ' GLU . . . . . 0.404 ' H ' ' HG3' ' A' ' 910' ' ' GLU . 0.0 OUTLIER -59.73 -61.89 2.28 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.209 -177.341 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.64 -29.31 66.75 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.088 -178.051 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 912' ' ' GLN . . . . . 0.588 ' HB2' ' O ' ' A' ' 908' ' ' ALA . 1.1 mt-30 -62.94 -45.04 94.33 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 177.55 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.61 -38.6 81.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.597 179.52 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 90.7 m -62.84 -35.25 79.31 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.956 176.002 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.47 -51.86 21.48 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.652 -179.051 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 916' ' ' GLU . . . . . 0.508 ' H ' ' HG3' ' A' ' 916' ' ' GLU . 0.0 OUTLIER -72.91 -50.31 24.45 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.672 -0.24 . . . . 0.0 111.292 -175.899 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 49.96 39.21 18.18 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.87 -174.512 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -99.11 -31.45 6.22 Favored Glycine 0 N--CA 1.445 -0.701 0 C-N-CA 120.845 -0.693 . . . . 0.0 111.975 -177.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 919' ' ' MET . . . . . 0.7 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 2.6 mtm -78.58 -94.0 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 110.533 -0.173 . . . . 0.0 110.533 179.325 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 920' ' ' ASP . . . . . 0.572 ' HB2' ' O ' ' A' ' 919' ' ' MET . 11.5 t70 157.47 -81.88 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.39 1.076 . . . . 0.0 108.871 179.479 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -97.48 173.04 7.37 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.752 -178.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 922' ' ' CYS . . . . . 0.424 ' O ' HD23 ' A' ' 923' ' ' LEU . 0.0 OUTLIER -144.18 136.76 26.86 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.943 0.401 . . . . 0.0 111.208 -178.248 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 923' ' ' LEU . . . . . 1.017 ' HB2' ' HB ' ' A' ' 902' ' ' VAL . 60.6 mt -127.25 -175.72 3.52 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.612 178.413 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 924' ' ' SER . . . . . 0.478 ' HA ' ' O ' ' A' ' 903' ' ' THR . 0.2 OUTLIER -126.31 144.17 50.9 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.362 178.3 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 925' ' ' LYS . . . . . 0.576 ' HB2' ' HB2' ' A' ' 904' ' ' ALA . 2.3 tttp -53.82 -42.96 95.44 Favored Pre-proline 0 CA--C 1.54 0.564 0 O-C-N 123.538 0.524 . . . . 0.0 112.305 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -66.91 69.99 0.52 Allowed 'Trans proline' 0 C--N 1.36 1.168 0 C-N-CA 122.067 1.845 . . . . 0.0 111.807 171.236 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 3.0 p -115.48 158.1 15.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.72 -177.323 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -109.03 161.97 14.67 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.255 177.473 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 929' ' ' LEU . . . . . 0.94 HD12 ' HG2' ' A' ' 843' ' ' GLN . 1.2 tt -61.77 -29.52 70.19 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.925 0.393 . . . . 0.0 110.295 176.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 930' ' ' ASP . . . . . 0.561 ' O ' ' HG2' ' A' ' 934' ' ' GLN . 17.1 t0 -62.59 -46.24 89.22 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.246 179.375 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 55.2 t -71.73 -42.23 70.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.784 -176.285 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 932' ' ' ILE . . . . . 0.512 HG22 ' HA ' ' A' ' 929' ' ' LEU . 0.0 OUTLIER -64.95 -38.74 83.55 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.038 177.956 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 933' ' ' LYS . . . . . 0.577 ' HA ' HD21 ' A' ' 847' ' ' LEU . 2.0 tmmt? -62.7 -46.13 89.58 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.328 176.634 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 934' ' ' GLN . . . . . 0.561 ' HG2' ' O ' ' A' ' 930' ' ' ASP . 14.1 mm100 -57.05 -51.13 70.51 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.906 179.145 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 5.1 m -63.13 -42.45 99.5 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.464 -178.673 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 936' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.02 -35.85 82.07 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.712 178.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 90.2 m -68.32 -45.28 73.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.098 178.738 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 9.4 tp -61.83 -42.87 99.57 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.166 0.508 . . . . 0.0 110.506 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -72.67 -31.85 65.39 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.935 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -62.12 -41.15 97.95 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.807 178.037 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 941' ' ' GLU . . . . . 0.552 ' HG3' ' N ' ' A' ' 942' ' ' ARG . 0.0 OUTLIER -66.51 -35.43 80.23 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.342 178.139 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 942' ' ' ARG . . . . . 0.552 ' N ' ' HG3' ' A' ' 941' ' ' GLU . 5.0 mmt85 -66.1 -48.65 70.24 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.024 0.44 . . . . 0.0 110.89 178.37 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 25.4 m -74.17 -33.23 34.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.531 -174.263 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 944' ' ' ARG . . . . . 0.507 ' HG3' ' N ' ' A' ' 945' ' ' LYS . 0.0 OUTLIER -69.92 -34.59 73.69 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 121.187 -0.205 . . . . 0.0 110.696 -179.819 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 945' ' ' LYS . . . . . 0.507 ' N ' ' HG3' ' A' ' 944' ' ' ARG . 12.8 ptpt -79.16 -31.74 44.08 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 121.158 -0.217 . . . . 0.0 111.347 -178.332 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 946' ' ' SER . . . . . 0.401 ' N ' ' HG3' ' A' ' 945' ' ' LYS . 7.7 m -74.42 -36.82 63.45 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.98 0.419 . . . . 0.0 110.508 179.489 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 947' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 947' ' ' ARG . 1.7 ttm105 -78.51 -19.51 52.82 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.722 175.871 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 27.1 t70 67.84 79.44 0.22 Allowed 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.036 -0.984 . . . . 0.0 111.118 177.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 14.9 m . . . . . 0 C--N 1.32 -0.7 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.651 176.983 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.479 1.025 0 CA-C-O 120.777 0.322 . . . . 0.0 110.596 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . -91.02 -128.71 4.11 Favored Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.922 -0.656 . . . . 0.0 112.065 179.584 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . 60.02 -167.63 9.05 Favored Glycine 0 CA--C 1.52 0.362 0 C-N-CA 121.235 -0.507 . . . . 0.0 112.701 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.3 -40.47 16.53 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.743 0.306 . . . . 0.0 110.877 177.539 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . 88.38 122.25 1.87 Allowed Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.752 -0.737 . . . . 0.0 111.729 -176.431 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -120.19 67.35 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 120.921 0.391 . . . . 0.0 110.697 -178.03 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.93 129.97 35.09 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.863 176.924 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . -101.18 -154.3 26.52 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.839 -0.696 . . . . 0.0 113.006 -176.148 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -86.75 46.87 1.41 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.762 0.315 . . . . 0.0 111.303 -175.344 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 705' ' ' SER . . . . . 0.628 ' HA ' ' O ' ' A' ' 730' ' ' GLY . 0.9 OUTLIER -70.54 62.56 0.25 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.439 177.394 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . -171.83 -28.45 0.02 OUTLIER Glycine 0 N--CA 1.446 -0.681 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.614 -178.072 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 707' ' ' LYS . . . . . 0.501 ' HE2' ' CE2' ' A' ' 799' ' ' TYR . 0.0 OUTLIER -63.41 148.99 46.99 Favored 'General case' 0 C--N 1.334 -0.095 0 N-CA-C 109.862 -0.421 . . . . 0.0 109.862 176.595 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 708' ' ' ARG . . . . . 0.463 ' H ' ' HE3' ' A' ' 707' ' ' LYS . 4.7 mtt180 -116.53 146.86 42.32 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.125 0.488 . . . . 0.0 111.322 -177.85 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 709' ' ' CYS . . . . . 0.506 ' HB2' HD22 ' A' ' 726' ' ' LEU . 42.9 t -126.89 138.0 53.24 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.138 174.163 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 710' ' ' TRP . . . . . 0.63 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 38.9 m95 -105.49 130.83 53.48 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 120.783 0.325 . . . . 0.0 110.336 -177.335 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 711' ' ' LEU . . . . . 0.545 HD22 HG22 ' A' ' 733' ' ' VAL . 0.6 OUTLIER -136.37 137.73 40.85 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.217 0.532 . . . . 0.0 111.429 -178.412 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -126.91 53.45 1.7 Allowed 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.322 176.18 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 713' ' ' VAL . . . . . 0.987 ' HA ' ' HB2' ' A' ' 750' ' ' ASP . 15.8 t -109.13 132.76 56.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.807 -175.837 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.57 -11.81 16.21 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.583 -177.466 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -74.22 112.9 10.83 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 170.357 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 716' ' ' ALA . . . . . 0.609 ' O ' ' HB2' ' A' ' 720' ' ' GLN . . . -63.05 -44.75 94.96 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 122.73 0.412 . . . . 0.0 111.542 -172.834 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.3 -39.04 89.08 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.002 0.43 . . . . 0.0 110.709 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 718' ' ' LEU . . . . . 0.518 ' O ' ' HG ' ' A' ' 722' ' ' LEU . 2.3 tt -69.0 -51.17 42.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.596 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 719' ' ' CYS . . . . . 0.434 ' HB3' ' HB ' ' A' ' 713' ' ' VAL . 15.0 p -65.12 -42.03 94.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.548 -176.624 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 720' ' ' GLN . . . . . 0.726 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -60.95 -39.38 89.3 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.288 179.483 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.12 -53.7 55.3 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.96 0.409 . . . . 0.0 110.836 -179.623 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 722' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 718' ' ' LEU . 0.0 OUTLIER -67.4 -48.25 67.9 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.304 -178.314 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 723' ' ' GLU . . . . . 0.726 ' HG2' ' HA ' ' A' ' 720' ' ' GLN . 3.1 pt-20 -59.51 -41.13 89.2 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.669 -174.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 724' ' ' THR . . . . . 0.671 ' HA ' ' HG2' ' A' ' 727' ' ' GLN . 10.0 m -70.35 -36.6 74.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.688 0.28 . . . . 0.0 111.277 -179.1 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 25.1 m -66.92 -34.08 76.98 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.478 0.18 . . . . 0.0 111.336 -179.116 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 726' ' ' LEU . . . . . 0.671 HD11 HD12 ' A' ' 795' ' ' LEU . 1.1 mp -81.48 -41.67 21.4 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 121.17 -0.212 . . . . 0.0 111.301 178.161 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 727' ' ' GLN . . . . . 0.671 ' HG2' ' HA ' ' A' ' 724' ' ' THR . 0.0 OUTLIER -65.07 -21.76 66.86 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.219 0.533 . . . . 0.0 109.906 177.19 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 728' ' ' ARG . . . . . 0.468 ' HB2' ' O ' ' A' ' 724' ' ' THR . 20.2 ttp85 -60.48 -26.69 66.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.841 175.056 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -107.21 4.32 26.55 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.144 -179.588 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 730' ' ' GLY . . . . . 0.628 ' O ' ' HA ' ' A' ' 705' ' ' SER . . . 99.44 -5.82 58.97 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 121.122 -0.561 . . . . 0.0 112.436 177.902 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 731' ' ' ILE . . . . . 0.589 HG21 HD23 ' A' ' 726' ' ' LEU . 17.1 mt -75.6 113.75 14.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.116 0.484 . . . . 0.0 110.487 -177.053 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 732' ' ' VAL . . . . . . . . . . . . . 10.5 m -76.33 133.69 30.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.83 -177.395 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 733' ' ' VAL . . . . . 0.545 HG22 HD22 ' A' ' 711' ' ' LEU . 0.3 OUTLIER -97.6 138.86 21.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.351 179.42 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 4.7 m -133.98 135.31 43.38 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.254 179.082 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.33 118.82 9.22 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.425 177.016 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 736' ' ' TYR . . . . . 0.63 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 50.8 t80 -82.48 95.01 7.57 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.255 0.55 . . . . 0.0 110.556 -179.294 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.24 -70.82 0.78 Allowed 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.404 175.803 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -130.22 91.29 0.3 Allowed Glycine 0 N--CA 1.445 -0.75 0 N-CA-C 110.788 -0.925 . . . . 0.0 110.788 175.286 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.13 164.25 34.46 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.78 0.324 . . . . 0.0 111.002 -176.37 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 740' ' ' GLU . . . . . 0.523 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 1.9 mt-10 -79.28 138.49 55.92 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.771 -179.066 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 741' ' ' PRO . . . . . 0.523 ' HD3' ' HA ' ' A' ' 740' ' ' GLU . 5.0 Cg_endo -87.46 126.63 2.28 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 123.282 2.655 . . . . 0.0 112.246 177.013 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 742' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -104.65 134.62 19.57 Favored Pre-proline 0 C--N 1.323 -0.571 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.009 177.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 743' ' ' PRO . . . . . 1.044 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 18.7 Cg_endo -61.91 -16.88 52.4 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 123.084 2.523 . . . . 0.0 112.98 -179.564 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 56.8 mp0 -105.33 11.79 32.41 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.844 0.354 . . . . 0.0 110.839 178.044 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -111.53 159.86 17.72 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.465 -177.062 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 3.6 p -124.08 141.44 44.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.236 -174.666 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 747' ' ' LEU . . . . . 0.671 ' HB3' HG23 ' A' ' 762' ' ' VAL . 0.5 OUTLIER -117.56 141.43 48.38 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.944 179.33 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -121.75 120.92 63.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 N-CA-C 108.631 -0.878 . . . . 0.0 108.631 169.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 749' ' ' THR . . . . . 0.427 HG23 HD22 ' A' ' 747' ' ' LEU . 0.0 OUTLIER -119.27 150.42 40.13 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -169.575 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 750' ' ' ASP . . . . . 0.987 ' HB2' ' HA ' ' A' ' 713' ' ' VAL . 10.1 t0 -108.84 111.55 23.33 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.479 179.472 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 751' ' ' GLU . . . . . 0.972 ' HG2' HH21 ' A' ' 767' ' ' ARG . 17.1 mm-40 58.75 -151.9 0.41 Allowed 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 123.517 0.727 . . . . 0.0 111.248 -177.69 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 752' ' ' VAL . . . . . 0.552 HG22 ' H ' ' A' ' 771' ' ' GLY . 2.6 t -85.74 129.73 37.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 121.061 0.458 . . . . 0.0 111.741 -174.81 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 753' ' ' VAL . . . . . 0.403 HG21 HG22 ' A' ' 749' ' ' THR . 3.4 t -120.7 159.59 22.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.19 -0.671 . . . . 0.0 109.19 177.597 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 1.4 m -79.78 37.93 0.37 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.974 0.416 . . . . 0.0 110.934 178.103 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 3.8 mttt -159.31 -174.65 4.8 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 178.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 756' ' ' LYS . . . . . 0.627 ' O ' ' HB2' ' A' ' 757' ' ' TRP . 0.0 OUTLIER -140.03 -67.6 0.43 Allowed 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 172.627 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 757' ' ' TRP . . . . . 0.627 ' HB2' ' O ' ' A' ' 756' ' ' LYS . 0.7 OUTLIER 157.68 164.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 114.303 -1.317 . . . . 0.0 109.519 -175.265 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.69 49.97 1.14 Allowed 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 173.362 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 759' ' ' GLY . . . . . 1.044 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -150.14 -144.6 3.96 Favored Glycine 0 N--CA 1.442 -0.954 0 C-N-CA 120.403 -0.904 . . . . 0.0 113.654 -173.827 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 760' ' ' ARG . . . . . 0.726 HH21 ' HB3' ' A' ' 821' ' ' ASP . 4.9 ttt85 -63.42 -61.51 2.29 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.22 -0.49 . . . . 0.0 111.652 -173.483 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -162.4 146.35 11.86 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.859 0.362 . . . . 0.0 111.068 -178.559 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 762' ' ' VAL . . . . . 0.671 HG23 ' HB3' ' A' ' 747' ' ' LEU . 4.0 p -126.57 122.96 62.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.738 174.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 763' ' ' VAL . . . . . 0.574 HG11 HD21 ' A' ' 791' ' ' LEU . 16.6 t -102.08 95.56 4.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.824 179.668 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 764' ' ' THR . . . . . 0.822 HG21 HG13 ' A' ' 772' ' ' ILE . 91.5 m -92.14 122.53 34.72 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.618 -179.38 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 765' ' ' PHE . . . . . 0.875 ' HZ ' ' HG ' ' A' ' 791' ' ' LEU . 3.9 m-30 -99.39 101.65 12.98 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.098 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -123.5 133.53 54.0 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.21 -177.646 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 767' ' ' ARG . . . . . 0.972 HH21 ' HG2' ' A' ' 751' ' ' GLU . 0.0 OUTLIER -140.19 -35.08 0.52 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.944 -179.048 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -84.98 -52.53 5.92 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 178.195 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -125.15 124.91 42.81 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.57 172.643 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 2.1 mt -115.39 85.34 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.161 0.505 . . . . 0.0 110.538 -177.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 771' ' ' GLY . . . . . 0.552 ' H ' HG22 ' A' ' 752' ' ' VAL . . . -92.35 -6.54 64.42 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.858 -0.686 . . . . 0.0 111.815 178.894 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 772' ' ' ILE . . . . . 0.822 HG13 HG21 ' A' ' 764' ' ' THR . 3.0 mm -103.52 131.3 22.19 Favored Pre-proline 0 C--N 1.323 -0.583 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.431 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 773' ' ' PRO . . . . . 0.562 ' O ' ' HB3' ' A' ' 774' ' ' LEU . 31.6 Cg_exo -60.57 -94.04 0.0 OUTLIER 'Trans proline' 0 CA--C 1.532 0.391 0 C-N-CA 123.188 2.592 . . . . 0.0 113.075 -176.725 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 774' ' ' LEU . . . . . 0.678 ' HA ' ' HB ' ' A' ' 782' ' ' VAL . 0.4 OUTLIER 167.4 -163.68 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.19 0.596 . . . . 0.0 109.913 -178.98 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 775' ' ' GLU . . . . . 0.605 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 1.4 mp0 -62.94 69.47 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.743 0.782 . . . . 0.0 112.423 175.084 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 776' ' ' LYS . . . . . 0.404 ' HE3' ' CD2' ' A' ' 774' ' ' LEU . 18.3 ptpt -132.61 -1.03 3.49 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 114.796 -1.093 . . . . 0.0 108.872 171.208 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 777' ' ' ALA . . . . . 0.457 ' HB1' ' HD2' ' A' ' 778' ' ' PRO . . . -131.62 158.36 75.58 Favored Pre-proline 0 N--CA 1.449 -0.494 0 CA-C-N 114.94 -1.027 . . . . 0.0 109.25 179.557 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 778' ' ' PRO . . . . . 0.457 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 23.0 Cg_endo -61.64 99.93 0.18 Allowed 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.58 2.187 . . . . 0.0 112.714 -178.529 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 94.23 15.62 47.09 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.883 -0.675 . . . . 0.0 113.408 175.51 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 780' ' ' GLU . . . . . 0.605 ' O ' ' HG3' ' A' ' 775' ' ' GLU . 2.7 tt0 -100.07 121.78 41.92 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 117.541 0.67 . . . . 0.0 110.322 179.251 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 781' ' ' TRP . . . . . 0.545 ' CZ3' HD11 ' A' ' 794' ' ' LEU . 12.0 m95 -129.33 124.23 33.77 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 176.853 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 782' ' ' VAL . . . . . 0.678 ' HB ' ' HA ' ' A' ' 774' ' ' LEU . 1.8 t -141.13 136.34 33.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 C-N-CA 120.696 -0.402 . . . . 0.0 111.711 -176.131 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 783' ' ' HIS . . . . . 0.444 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 1.0 OUTLIER -176.17 174.81 1.98 Allowed 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.913 168.432 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 784' ' ' SER . . . . . 0.726 ' HB3' ' HB3' ' A' ' 767' ' ' ARG . 0.7 OUTLIER -98.42 100.47 11.74 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.968 177.1 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 785' ' ' VAL . . . . . 0.755 HG12 ' H ' ' A' ' 787' ' ' ALA . 39.8 t -138.47 140.38 39.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -178.703 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -90.23 12.57 17.66 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.76 0.314 . . . . 0.0 111.138 -179.016 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 787' ' ' ALA . . . . . 0.755 ' H ' HG12 ' A' ' 785' ' ' VAL . . . 53.82 57.64 13.18 Favored Pre-proline 0 N--CA 1.467 0.381 0 CA-C-N 115.481 -0.781 . . . . 0.0 112.279 -178.782 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 788' ' ' PRO . . . . . 0.525 ' HD3' ' N ' ' A' ' 787' ' ' ALA . 24.2 Cg_exo -65.23 -57.83 0.24 Allowed 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 122.509 2.139 . . . . 0.0 112.375 178.22 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -160.73 -22.49 0.06 Allowed 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 179.041 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 790' ' ' GLU . . . . . 0.417 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 2.7 pm0 -73.09 -33.53 65.66 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 111.684 0.253 . . . . 0.0 111.684 -175.152 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 791' ' ' LEU . . . . . 0.875 ' HG ' ' HZ ' ' A' ' 765' ' ' PHE . 0.4 OUTLIER -71.07 -52.53 9.32 Favored Pre-proline 0 C--N 1.327 -0.382 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.761 -178.673 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 792' ' ' PRO . . . . . 0.443 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 9.5 Cg_endo -56.68 -30.77 85.17 Favored 'Trans proline' 0 C--N 1.356 0.949 0 C-N-CA 121.521 1.481 . . . . 0.0 111.831 175.228 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -69.7 -42.24 74.32 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.657 175.588 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 794' ' ' LEU . . . . . 0.545 HD11 ' CZ3' ' A' ' 781' ' ' TRP . 0.7 OUTLIER -60.44 -42.57 96.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.66 177.997 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 795' ' ' LEU . . . . . 0.671 HD12 HD11 ' A' ' 726' ' ' LEU . 0.3 OUTLIER -64.68 -35.36 80.77 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.988 0.423 . . . . 0.0 110.693 -179.338 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -63.67 -38.43 91.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.626 177.116 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 797' ' ' ARG . . . . . 0.509 ' HG3' ' N ' ' A' ' 798' ' ' ILE . 0.0 OUTLIER -71.55 -33.06 68.8 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.106 176.593 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 798' ' ' ILE . . . . . 0.509 ' N ' ' HG3' ' A' ' 797' ' ' ARG . 0.9 OUTLIER -61.45 -35.53 67.24 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.445 -175.739 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 799' ' ' TYR . . . . . 0.501 ' CE2' ' HE2' ' A' ' 707' ' ' LYS . 0.2 OUTLIER -104.62 28.04 7.39 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 119.829 -0.749 . . . . 0.0 112.076 176.114 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 800' ' ' LEU . . . . . 0.533 HD21 ' HB2' ' A' ' 821' ' ' ASP . 0.7 OUTLIER 46.09 50.74 11.52 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.291 -0.868 . . . . 0.0 112.993 170.419 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 801' ' ' ILE . . . . . . . . . . . . . 31.5 mt -77.21 79.72 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 121.817 0.817 . . . . 0.0 109.183 174.019 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -84.6 51.54 2.15 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.887 -1.051 . . . . 0.0 111.482 -173.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 803' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.35 -63.2 1.24 Allowed 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 107.937 -1.135 . . . . 0.0 107.937 170.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 804' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 56.02 61.02 2.93 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 114.809 -1.087 . . . . 0.0 112.619 167.319 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -83.42 37.65 0.58 Allowed 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.14 174.456 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 22.8 t70 53.43 58.03 5.6 Favored 'General case' 0 C--O 1.232 0.139 0 N-CA-C 107.953 -1.128 . . . . 0.0 107.953 -167.766 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 807' ' ' ASP . . . . . 0.447 ' HA ' ' HD3' ' A' ' 808' ' ' PRO . 1.7 t0 -66.64 118.61 56.02 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-N 114.304 -1.316 . . . . 0.0 111.101 -173.646 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 808' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 807' ' ' ASP . 13.5 Cg_exo -69.51 -166.57 0.18 Allowed 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 123.196 2.597 . . . . 0.0 112.062 179.126 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . 73.02 -41.06 0.49 Allowed 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.25 0.62 . . . . 0.0 111.427 -179.528 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -79.44 81.77 5.66 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.239 0.542 . . . . 0.0 110.09 175.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -101.33 28.71 5.23 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.161 177.713 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -130.47 75.49 78.96 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.982 177.466 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -74.21 14.5 0.72 Allowed 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.859 2.373 . . . . 0.0 112.641 -177.695 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.65 5.19 19.01 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.778 179.139 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.73 53.8 1.99 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.755 178.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -84.73 129.65 34.8 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.65 -176.825 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.03 162.13 41.15 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.106 -179.387 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -82.58 117.45 22.57 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.88 0.371 . . . . 0.0 110.509 179.128 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 45.1 t -83.76 84.12 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 121.302 0.572 . . . . 0.0 110.973 -178.296 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -104.22 19.35 20.33 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.814 174.881 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 821' ' ' ASP . . . . . 0.726 ' HB3' HH21 ' A' ' 760' ' ' ARG . 18.8 m-20 -76.73 94.18 3.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.386 -179.693 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -89.91 73.96 7.39 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.58 -176.595 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -106.41 54.86 0.68 Allowed 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 173.6 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -94.82 59.44 2.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.99 -1.004 . . . . 0.0 111.249 -172.327 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 3.0 tpt -112.99 92.7 4.1 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.142 0.496 . . . . 0.0 110.252 176.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 826' ' ' MET . . . . . . . . . . . . . 8.7 ptp -114.27 129.89 56.64 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.938 -179.066 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 827' ' ' ILE . . . . . 0.503 ' O ' ' HA ' ' A' ' 851' ' ' CYS . 1.0 OUTLIER -126.39 137.76 56.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.998 -178.584 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 828' ' ' LEU . . . . . 0.698 HD22 HD13 ' A' ' 869' ' ' ILE . 0.2 OUTLIER -107.68 143.61 35.93 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.782 0.325 . . . . 0.0 110.632 -178.504 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 829' ' ' VAL . . . . . 0.562 ' HA ' ' HB2' ' A' ' 873' ' ' LEU . 0.1 OUTLIER -128.04 119.67 51.72 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 121.315 0.579 . . . . 0.0 110.231 -179.345 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 830' ' ' VAL . . . . . 0.774 HG22 ' HB3' ' A' ' 854' ' ' ALA . 69.0 t -122.6 107.89 20.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 115.285 -0.871 . . . . 0.0 109.333 176.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 831' ' ' ASP . . . . . 0.545 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -118.22 153.26 34.19 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.155 0.502 . . . . 0.0 111.177 -177.611 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 832' ' ' ASP . . . . . 0.44 ' HB2' ' HA ' ' A' ' 876' ' ' VAL . 6.8 t70 -68.94 -42.4 76.78 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.778 -1.101 . . . . 0.0 112.293 -177.289 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 833' ' ' HIS . . . . . 0.489 ' HA ' ' HD2' ' A' ' 834' ' ' PRO . 0.5 OUTLIER -126.41 105.06 24.52 Favored Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 110.299 -0.259 . . . . 0.0 110.299 -173.776 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 834' ' ' PRO . . . . . 0.489 ' HD2' ' HA ' ' A' ' 833' ' ' HIS . 1.4 Cg_endo -40.75 -25.12 0.18 Allowed 'Trans proline' 0 C--N 1.353 0.803 1 C-N-CA 125.892 4.395 . . . . 0.0 116.553 -164.38 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 835' ' ' ILE . . . . . 0.443 ' O ' ' HG3' ' A' ' 838' ' ' ARG . 0.0 OUTLIER -61.01 -39.95 83.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 117.985 0.357 . . . . 0.0 111.173 -179.206 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 836' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -74.5 -41.6 60.41 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 837' ' ' ARG . . . . . 0.545 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 12.9 ttp180 -52.83 -49.93 64.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.25 177.682 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 838' ' ' ARG . . . . . 0.443 ' HG3' ' O ' ' A' ' 835' ' ' ILE . 0.0 OUTLIER -68.56 -34.61 76.13 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.94 -178.139 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 839' ' ' LEU . . . . . 0.435 HD22 ' HA ' ' A' ' 839' ' ' LEU . 0.6 OUTLIER -69.91 -49.15 54.88 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.077 -176.104 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 840' ' ' LEU . . . . . 0.479 HD11 ' CG2' ' A' ' 829' ' ' VAL . 2.6 pp -74.26 -31.44 62.55 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.405 -178.199 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -68.93 -35.21 76.53 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.941 0.401 . . . . 0.0 110.398 177.11 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 842' ' ' ASP . . . . . 0.404 ' HB2' ' O ' ' A' ' 838' ' ' ARG . 0.3 OUTLIER -63.5 -36.66 84.49 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.885 176.064 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 843' ' ' GLN . . . . . 0.734 ' HG3' HD23 ' A' ' 929' ' ' LEU . 2.5 mm-40 -68.44 -39.79 81.36 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.494 -0.775 . . . . 0.0 109.991 176.903 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 844' ' ' LEU . . . . . 0.585 ' HA ' HD12 ' A' ' 847' ' ' LEU . 0.3 OUTLIER -59.15 -43.46 92.06 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.273 176.579 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -61.92 -35.13 90.92 Favored Glycine 0 N--CA 1.451 -0.316 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.003 176.594 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 846' ' ' SER . . . . . 0.626 ' HA ' ' O ' ' A' ' 705' ' ' SER . 29.3 m -71.47 -17.26 62.37 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.792 0.33 . . . . 0.0 111.167 178.401 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 847' ' ' LEU . . . . . 0.585 HD12 ' HA ' ' A' ' 844' ' ' LEU . 44.3 mt -83.22 -18.39 39.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.374 175.312 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 88.97 30.02 15.99 Favored Glycine 0 C--N 1.33 0.213 0 C-N-CA 121.042 -0.599 . . . . 0.0 112.924 177.375 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 849' ' ' TYR . . . . . 0.424 ' HB2' HD23 ' A' ' 844' ' ' LEU . 27.1 m-85 -119.31 160.19 22.71 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 179.149 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.82 109.51 19.33 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.196 0.522 . . . . 0.0 111.085 -177.614 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 851' ' ' CYS . . . . . 0.503 ' HA ' ' O ' ' A' ' 827' ' ' ILE . 0.0 OUTLIER -93.39 151.79 19.53 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.996 179.97 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.92 109.94 13.63 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.517 173.646 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 853' ' ' THR . . . . . 0.428 HG22 ' CG ' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -94.43 124.07 38.23 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -171.189 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 854' ' ' ALA . . . . . 0.774 ' HB3' HG22 ' A' ' 830' ' ' VAL . . . -137.65 155.58 48.99 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.479 175.881 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -134.39 75.35 1.58 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 856' ' ' ASP . . . . . 0.62 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 26.8 t70 170.6 143.84 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.681 179.627 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -70.63 -37.42 67.82 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 121.038 -0.601 . . . . 0.0 113.148 -177.114 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -73.71 -31.54 32.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.846 0.355 . . . . 0.0 110.217 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 859' ' ' ASP . . . . . 0.62 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 1.0 OUTLIER -58.99 -29.21 67.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.764 177.275 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 860' ' ' ALA . . . . . 0.4 ' O ' ' HB2' ' A' ' 864' ' ' LEU . . . -63.76 -42.47 97.82 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.961 0.41 . . . . 0.0 110.495 177.018 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 861' ' ' LEU . . . . . 0.533 HD22 ' HA ' ' A' ' 861' ' ' LEU . 0.2 OUTLIER -71.14 -33.52 70.16 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.999 178.17 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -63.98 -52.23 60.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.602 179.072 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 9.4 p -69.14 -32.69 55.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.023 -177.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 864' ' ' LEU . . . . . 0.783 HD21 HD11 ' A' ' 897' ' ' LEU . 0.2 OUTLIER -61.3 -39.02 88.92 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.051 0.453 . . . . 0.0 110.571 177.984 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 11.0 m -82.14 -20.89 37.04 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.986 -178.49 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.8 -46.34 17.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.451 -179.607 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -150.5 138.92 20.46 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 177.729 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 18.3 m80 -86.7 88.66 7.72 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.301 0.572 . . . . 0.0 111.773 -172.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 869' ' ' ILE . . . . . 0.698 HD13 HD22 ' A' ' 828' ' ' LEU . 0.8 OUTLIER -69.48 154.74 8.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.301 173.22 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.03 -34.37 15.15 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -169.692 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 871' ' ' ILE . . . . . . . . . . . . . 2.2 mt -130.37 136.01 59.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 O-C-N 122.208 -0.308 . . . . 0.0 110.721 -179.165 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 872' ' ' VAL . . . . . 0.852 ' HB ' ' HB ' ' A' ' 899' ' ' VAL . 2.2 t -103.38 126.2 57.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.425 -178.092 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 873' ' ' LEU . . . . . 0.562 ' HB2' ' HA ' ' A' ' 829' ' ' VAL . 13.0 mt -104.03 99.82 9.57 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 170.904 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -106.05 96.95 6.84 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.581 0.229 . . . . 0.0 110.645 -178.723 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 875' ' ' ASP . . . . . 0.527 ' HA ' ' HB ' ' A' ' 902' ' ' VAL . 10.2 t0 -109.26 110.69 21.94 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.395 -177.245 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 876' ' ' VAL . . . . . 0.44 ' HA ' ' HB2' ' A' ' 832' ' ' ASP . 0.2 OUTLIER -108.01 155.19 8.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.22 0.533 . . . . 0.0 111.538 -175.884 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -115.63 -65.75 1.16 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.476 176.031 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 878' ' ' MET . . . . . 0.438 ' CB ' ' HD3' ' A' ' 879' ' ' PRO . 2.5 ttm -178.0 -70.32 0.0 OUTLIER Pre-proline 0 CA--C 1.538 0.491 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 177.062 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 879' ' ' PRO . . . . . 0.438 ' HD3' ' CB ' ' A' ' 878' ' ' MET . 79.5 Cg_endo -88.5 51.52 1.77 Allowed 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 122.302 2.001 . . . . 0.0 114.235 -164.138 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -125.63 -23.64 4.01 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.813 175.876 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 4.1 ptt? -173.78 179.58 1.98 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.426 -177.651 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -74.8 131.77 41.05 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 171.692 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -75.28 41.54 1.35 Allowed Glycine 0 CA--C 1.519 0.332 0 C-N-CA 121.49 -0.386 . . . . 0.0 114.005 -172.134 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 884' ' ' TYR . . . . . 0.448 ' H ' ' H ' ' A' ' 885' ' ' ARG . 0.6 OUTLIER -168.06 -8.58 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.842 0.353 . . . . 0.0 110.6 178.512 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 885' ' ' ARG . . . . . 0.448 ' H ' ' H ' ' A' ' 884' ' ' TYR . 5.8 tmm_? -63.51 -44.15 95.13 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.311 -176.141 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 886' ' ' LEU . . . . . 0.636 HD13 ' H ' ' A' ' 887' ' ' THR . 0.0 OUTLIER -68.72 -29.25 67.64 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.149 -177.796 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 887' ' ' THR . . . . . 0.636 ' H ' HD13 ' A' ' 886' ' ' LEU . 0.2 OUTLIER -72.33 -43.58 63.91 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 120.942 0.401 . . . . 0.0 110.409 176.863 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -59.53 -40.78 88.27 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.343 177.388 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.68 -34.78 62.74 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.355 -178.648 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 890' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -73.32 -36.72 49.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 120.9 -0.32 . . . . 0.0 110.904 -179.712 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 891' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -75.57 -25.26 56.91 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.969 0.414 . . . . 0.0 110.097 176.799 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -71.01 -45.41 63.99 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.209 175.514 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 4.4 tp -68.08 -45.81 72.77 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.571 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 125.49 66.41 0.18 Allowed Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.155 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 895' ' ' LEU . . . . . 0.528 ' O ' ' HG ' ' A' ' 895' ' ' LEU . 0.0 OUTLIER -55.52 121.6 9.41 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.18 0.514 . . . . 0.0 110.204 176.599 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -123.12 17.8 9.97 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.323 0.582 . . . . 0.0 111.021 -176.889 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 897' ' ' LEU . . . . . 0.783 HD11 HD21 ' A' ' 864' ' ' LEU . 0.0 OUTLIER -144.03 138.54 15.09 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.203 -177.003 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 898' ' ' PRO . . . . . 0.472 ' HD3' ' HA ' ' A' ' 897' ' ' LEU . 33.1 Cg_exo -61.43 140.78 89.59 Favored 'Trans proline' 0 C--O 1.237 0.427 0 C-N-CA 122.709 2.273 . . . . 0.0 112.191 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 899' ' ' VAL . . . . . 0.877 HG13 ' HA ' ' A' ' 919' ' ' MET . 0.2 OUTLIER -128.88 138.42 54.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.655 0.74 . . . . 0.0 110.94 -178.425 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 900' ' ' ILE . . . . . 0.608 HG23 ' HB2' ' A' ' 921' ' ' SER . 4.1 mt -91.15 114.29 28.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 115.33 -0.85 . . . . 0.0 109.905 177.675 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 901' ' ' GLY . . . . . 0.518 ' O ' ' HA ' ' A' ' 922' ' ' CYS . . . -84.52 106.66 2.94 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.266 -179.201 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 902' ' ' VAL . . . . . 0.527 ' HB ' ' HA ' ' A' ' 875' ' ' ASP . 1.1 t -110.07 140.04 30.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 903' ' ' THR . . . . . 0.417 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.0 OUTLIER -150.82 150.03 30.44 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 110.267 -0.271 . . . . 0.0 110.267 176.542 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 904' ' ' ALA . . . . . 0.527 ' HB2' ' HD2' ' A' ' 925' ' ' LYS . . . -69.79 114.54 8.08 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 169.818 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -54.7 106.45 0.21 Allowed 'General case' 0 CA--C 1.513 -0.453 0 CA-C-O 121.539 0.685 . . . . 0.0 110.64 -174.427 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 906' ' ' ALA . . . . . 0.573 ' O ' ' HB2' ' A' ' 907' ' ' LEU . . . -120.8 -81.64 0.64 Allowed 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 114.851 -1.068 . . . . 0.0 110.109 -175.464 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 907' ' ' LEU . . . . . 0.573 ' HB2' ' O ' ' A' ' 906' ' ' ALA . 0.4 OUTLIER 160.24 137.87 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.475 -1.239 . . . . 0.0 108.496 -176.692 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . 74.69 -50.72 0.67 Allowed 'General case' 0 N--CA 1.467 0.391 0 O-C-N 123.788 0.68 . . . . 0.0 111.977 175.483 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.98 -38.8 92.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.119 0.485 . . . . 0.0 111.027 179.7 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 910' ' ' GLU . . . . . 0.458 ' H ' ' HG3' ' A' ' 910' ' ' GLU . 0.5 OUTLIER -67.15 -29.12 68.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.449 0.642 . . . . 0.0 109.496 175.581 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 1.4 ttpm? -77.69 -15.94 58.83 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.315 178.393 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -75.59 -37.53 59.8 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 173.266 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.49 -40.46 87.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.672 172.582 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 70.8 m -71.54 -26.5 62.67 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.156 176.664 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.6 -44.6 70.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.643 -179.809 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -77.85 -48.11 17.25 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.059 178.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.8 25.92 3.23 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.066 0.546 . . . . 0.0 111.776 -175.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -98.62 24.02 33.82 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.156 -178.017 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 919' ' ' MET . . . . . 0.877 ' HA ' HG13 ' A' ' 899' ' ' VAL . 1.5 mpt? -112.44 -86.19 0.56 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 110.162 -0.31 . . . . 0.0 110.162 -179.396 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 920' ' ' ASP . . . . . 0.595 ' HB2' ' O ' ' A' ' 919' ' ' MET . 8.4 t70 160.38 -73.17 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.449 0 O-C-N 124.614 1.196 . . . . 0.0 109.357 175.549 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 921' ' ' SER . . . . . 0.608 ' HB2' HG23 ' A' ' 900' ' ' ILE . 0.1 OUTLIER -90.77 172.97 8.27 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.077 -173.993 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 922' ' ' CYS . . . . . 0.518 ' HA ' ' O ' ' A' ' 901' ' ' GLY . 0.1 OUTLIER -149.73 121.33 8.01 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.485 177.794 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 923' ' ' LEU . . . . . 0.402 HD12 HG13 ' A' ' 902' ' ' VAL . 0.0 OUTLIER -143.7 173.04 12.02 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.894 0.378 . . . . 0.0 110.31 175.138 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 924' ' ' SER . . . . . 0.417 ' HA ' ' O ' ' A' ' 903' ' ' THR . 1.8 m -94.52 153.29 17.97 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.436 179.255 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 925' ' ' LYS . . . . . 0.527 ' HD2' ' HB2' ' A' ' 904' ' ' ALA . 25.8 tttp -46.93 -48.99 51.42 Favored Pre-proline 0 CA--C 1.538 0.519 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -178.753 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 926' ' ' PRO . . . . . 0.421 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 50.2 Cg_endo -69.67 72.52 1.39 Allowed 'Trans proline' 0 C--N 1.355 0.901 0 C-N-CA 121.634 1.556 . . . . 0.0 112.815 177.257 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 34.2 t -79.62 119.19 28.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.428 177.684 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 928' ' ' THR . . . . . 0.466 ' O ' HG22 ' A' ' 932' ' ' ILE . 0.0 OUTLIER -72.42 156.55 38.94 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.228 179.655 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 929' ' ' LEU . . . . . 0.734 HD23 ' HG3' ' A' ' 843' ' ' GLN . 1.4 tm? -56.57 -46.05 80.97 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.631 -176.874 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -67.43 -33.09 74.44 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.372 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 54.0 t -70.08 -49.23 57.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.876 -177.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 932' ' ' ILE . . . . . 0.466 HG22 ' O ' ' A' ' 928' ' ' THR . 0.8 OUTLIER -61.1 -39.59 82.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 178.861 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 2.4 tmmt? -61.93 -48.79 78.85 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.894 178.43 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 -66.16 -48.22 71.48 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.487 -177.081 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 4.3 m -61.85 -44.16 97.38 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.165 -178.684 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 936' ' ' LEU . . . . . 0.462 ' HB2' ' O ' ' A' ' 932' ' ' ILE . 0.7 OUTLIER -64.59 -41.73 96.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.513 179.527 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 86.4 m -62.36 -44.43 96.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.977 0.418 . . . . 0.0 110.819 178.432 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -64.98 -44.32 89.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.406 -177.776 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 939' ' ' TYR . . . . . 0.418 ' HA ' ' HB3' ' A' ' 942' ' ' ARG . 19.5 m-85 -76.64 -28.57 56.09 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.414 -177.458 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -66.71 -41.51 87.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.899 0.381 . . . . 0.0 110.179 175.248 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 941' ' ' GLU . . . . . 0.523 ' HA ' ' HB2' ' A' ' 944' ' ' ARG . 7.4 pt-20 -75.55 -22.1 57.34 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.347 177.949 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 942' ' ' ARG . . . . . 0.418 ' HB3' ' HA ' ' A' ' 939' ' ' TYR . 0.0 OUTLIER -66.28 -48.01 71.78 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.259 175.604 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 12.7 m -74.41 -30.93 26.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.892 0.377 . . . . 0.0 110.342 178.05 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 944' ' ' ARG . . . . . 0.523 ' HB2' ' HA ' ' A' ' 941' ' ' GLU . 0.8 OUTLIER -65.83 -31.94 73.19 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.002 177.928 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -87.73 -15.35 37.31 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.692 0.282 . . . . 0.0 110.623 177.11 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 53.2 m -72.52 -45.27 60.11 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.904 0.383 . . . . 0.0 110.053 174.594 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 2.9 ttp85 -78.07 -31.68 50.37 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 174.236 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 36.5 t70 70.41 101.43 0.06 Allowed 'General case' 0 C--O 1.233 0.235 0 CA-C-N 114.751 -1.113 . . . . 0.0 111.272 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 C--O 1.25 1.103 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.145 -177.859 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 2.9 tpt . . . . . 0 N--CA 1.481 1.103 0 N-CA-C 110.191 -0.3 . . . . 0.0 110.191 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 106.17 -76.8 0.24 Allowed Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.786 -0.721 . . . . 0.0 111.523 -179.3 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . -163.45 -131.95 1.28 Allowed Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 121.044 -0.598 . . . . 0.0 111.937 177.111 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 5.7 m -92.82 148.48 22.0 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 120.951 0.405 . . . . 0.0 110.649 -179.671 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . -103.67 38.55 3.19 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.992 -0.623 . . . . 0.0 112.134 -177.181 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 11.5 p -152.78 152.29 10.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 N-CA-C 110.24 -0.281 . . . . 0.0 110.24 -178.493 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 702' ' ' GLU . . . . . 0.42 ' HB3' ' H ' ' A' ' 703' ' ' GLY . 1.0 OUTLIER -96.9 -143.28 0.29 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 175.255 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 703' ' ' GLY . . . . . 0.42 ' H ' ' HB3' ' A' ' 702' ' ' GLU . . . 72.87 68.35 1.61 Allowed Glycine 0 C--N 1.33 0.213 0 C-N-CA 120.516 -0.85 . . . . 0.0 111.174 -176.325 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.582 ' H ' HD13 ' A' ' 704' ' ' LEU . 0.0 OUTLIER -74.55 121.77 22.06 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.724 0.773 . . . . 0.0 112.499 -171.678 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 705' ' ' SER . . . . . 0.584 ' HA ' ' HA3' ' A' ' 730' ' ' GLY . 4.6 m -94.19 47.72 1.21 Allowed 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.153 -0.931 . . . . 0.0 109.444 172.161 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . -145.42 43.94 0.9 Allowed Glycine 0 N--CA 1.447 -0.596 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.617 -176.562 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 707' ' ' LYS . . . . . 0.559 ' HE3' ' HD1' ' A' ' 799' ' ' TYR . 1.2 mmtt -133.99 143.92 48.43 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 178.201 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 708' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.06 152.82 20.53 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.246 0.546 . . . . 0.0 110.993 -177.566 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 709' ' ' CYS . . . . . 0.501 ' SG ' HD13 ' A' ' 726' ' ' LEU . 0.1 OUTLIER -131.59 112.36 12.54 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.766 175.482 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 710' ' ' TRP . . . . . 0.64 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 84.5 m95 -92.51 121.12 33.66 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.431 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 711' ' ' LEU . . . . . 0.518 HD12 ' SG ' ' A' ' 719' ' ' CYS . 2.4 pt? -128.77 131.15 47.81 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.528 0.68 . . . . 0.0 111.297 -177.02 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -127.43 66.34 1.31 Allowed 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.876 177.083 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 713' ' ' VAL . . . . . 0.815 HG13 ' HB3' ' A' ' 750' ' ' ASP . 45.9 t -113.85 130.09 68.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.109 -179.015 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 714' ' ' ARG . . . . . 0.485 ' HD2' ' OD2' ' A' ' 750' ' ' ASP . 20.6 mtt180 -81.37 -13.42 58.35 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.209 -177.536 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 715' ' ' ASN . . . . . 0.643 ' H ' HG12 ' A' ' 713' ' ' VAL . 0.6 OUTLIER -87.4 122.2 30.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.411 178.098 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -70.59 -35.65 73.14 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.74 -176.199 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.18 -54.41 47.23 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.115 0.483 . . . . 0.0 110.244 177.502 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 718' ' ' LEU . . . . . 0.494 HD21 ' CE1' ' A' ' 765' ' ' PHE . 0.8 OUTLIER -61.99 -49.38 76.29 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.763 -179.499 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 719' ' ' CYS . . . . . 0.759 ' SG ' ' HB ' ' A' ' 713' ' ' VAL . 0.7 OUTLIER -59.31 -53.08 62.3 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.205 -177.287 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 720' ' ' GLN . . . . . 0.478 ' O ' ' HG3' ' A' ' 723' ' ' GLU . 48.0 tt0 -65.28 -44.34 88.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.798 -174.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -56.52 -48.81 76.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.822 0.344 . . . . 0.0 110.954 -176.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 76.3 mt -68.35 -48.12 65.65 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.09 -178.731 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 723' ' ' GLU . . . . . 0.724 ' HB2' HG21 ' A' ' 733' ' ' VAL . 0.0 OUTLIER -62.15 -42.73 99.53 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 111.705 0.261 . . . . 0.0 111.705 -174.092 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 724' ' ' THR . . . . . . . . . . . . . 27.8 m -69.08 -37.52 78.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.837 0.351 . . . . 0.0 111.022 -179.133 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 23.8 m -67.76 -37.88 82.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.804 0.335 . . . . 0.0 111.151 178.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 726' ' ' LEU . . . . . 0.785 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 18.4 mt -75.15 -38.57 60.9 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.998 0.428 . . . . 0.0 111.101 -178.874 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -74.47 -4.3 35.91 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.148 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.78 -44.11 94.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.277 -0.42 . . . . 0.0 109.95 174.988 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -80.67 -68.76 0.65 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.068 175.604 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 730' ' ' GLY . . . . . 0.584 ' HA3' ' HA ' ' A' ' 705' ' ' SER . . . 172.28 26.07 0.02 OUTLIER Glycine 0 N--CA 1.442 -0.919 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.942 176.051 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 731' ' ' ILE . . . . . 0.785 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 13.5 mm -84.09 91.49 2.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 177.763 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 732' ' ' VAL . . . . . . . . . . . . . 1.8 p -67.46 120.71 15.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.601 0.715 . . . . 0.0 111.173 -176.789 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 733' ' ' VAL . . . . . 0.724 HG21 ' HB2' ' A' ' 723' ' ' GLU . 4.3 m -91.32 147.63 5.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.087 -178.028 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 734' ' ' THR . . . . . 0.445 ' HB ' ' CZ3' ' A' ' 710' ' ' TRP . 0.1 OUTLIER -143.61 138.44 29.02 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.767 178.309 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.25 110.91 1.17 Allowed 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.788 176.46 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 736' ' ' TYR . . . . . 0.64 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 46.2 t80 -80.52 93.17 6.0 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.371 0.605 . . . . 0.0 110.175 178.158 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -97.21 -30.85 12.75 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.763 177.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 162.64 56.78 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 111.019 -0.832 . . . . 0.0 111.019 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 739' ' ' GLN . . . . . 0.492 ' HB3' ' H ' ' A' ' 740' ' ' GLU . 15.2 mp0 -101.99 -144.95 0.35 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.91 0.386 . . . . 0.0 111.728 -172.425 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 740' ' ' GLU . . . . . 0.492 ' H ' ' HB3' ' A' ' 739' ' ' GLN . 2.3 pt-20 -106.02 125.11 33.92 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.117 -173.609 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 741' ' ' PRO . . . . . 0.556 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 73.4 Cg_endo -78.5 123.34 5.92 Favored 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 122.471 2.114 . . . . 0.0 112.267 175.487 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 742' ' ' THR . . . . . 0.605 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.2 OUTLIER -118.84 141.8 30.72 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.589 178.506 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 743' ' ' PRO . . . . . 0.605 ' HD2' HG22 ' A' ' 742' ' ' THR . 34.7 Cg_endo -65.55 -1.38 4.72 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 123.314 2.676 . . . . 0.0 113.032 179.036 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -103.34 -8.48 20.24 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.245 0.545 . . . . 0.0 110.4 177.796 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -112.75 153.1 28.3 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.744 -171.006 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 746' ' ' VAL . . . . . 0.48 ' HA ' ' O ' ' A' ' 761' ' ' ALA . 8.3 m -116.94 147.92 20.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.817 178.353 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 747' ' ' LEU . . . . . 0.434 HD23 ' HA ' ' A' ' 747' ' ' LEU . 0.0 OUTLIER -107.86 104.61 14.12 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.372 179.933 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -99.49 111.89 30.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 177.875 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 14.0 p -124.09 156.22 36.98 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.896 0.379 . . . . 0.0 111.418 -175.326 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 750' ' ' ASP . . . . . 0.815 ' HB3' HG13 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -109.16 130.77 55.48 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 168.464 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 751' ' ' GLU . . . . . 0.43 ' HG3' ' N ' ' A' ' 752' ' ' VAL . 4.4 tp10 72.86 153.25 0.13 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.188 -167.76 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 752' ' ' VAL . . . . . 0.847 HG22 ' HB ' ' A' ' 772' ' ' ILE . 1.4 t -70.82 123.5 25.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.63 -178.401 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 11.1 m -101.32 155.09 4.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.563 -179.372 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -83.24 75.15 9.97 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.061 178.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -154.24 127.3 8.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.066 0.46 . . . . 0.0 111.568 -175.91 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.96 81.2 4.59 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 169.915 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 757' ' ' TRP . . . . . 0.556 ' CH2' ' HA ' ' A' ' 741' ' ' PRO . 70.7 t-105 -68.24 100.64 1.06 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.759 -177.649 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.39 49.15 0.99 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.38 0.61 . . . . 0.0 109.805 178.659 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 759' ' ' GLY . . . . . 0.45 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -104.13 -131.34 7.15 Favored Glycine 0 N--CA 1.444 -0.768 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.396 178.827 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 2.9 ttm-85 -79.83 -50.41 10.56 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.102 177.128 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 761' ' ' ALA . . . . . 0.48 ' O ' ' HA ' ' A' ' 746' ' ' VAL . . . -166.93 157.87 12.07 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.256 179.065 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 762' ' ' VAL . . . . . 0.544 HG13 ' HA ' ' A' ' 780' ' ' GLU . 1.4 p -133.91 122.8 43.16 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 176.604 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 763' ' ' VAL . . . . . 0.489 HG11 HD21 ' A' ' 791' ' ' LEU . 41.8 t -114.71 115.11 48.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.291 -0.413 . . . . 0.0 109.904 -178.284 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 764' ' ' THR . . . . . 0.586 HG22 ' HB2' ' A' ' 766' ' ' CYS . 34.2 m -112.2 119.09 37.17 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.246 0.546 . . . . 0.0 111.321 -178.321 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 765' ' ' PHE . . . . . 0.612 ' HA ' ' O ' ' A' ' 783' ' ' HIS . 91.3 m-85 -84.06 98.0 9.62 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.372 175.163 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 766' ' ' CYS . . . . . 0.586 ' HB2' HG22 ' A' ' 764' ' ' THR . 1.7 t -140.04 141.35 36.27 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -172.807 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 767' ' ' ARG . . . . . 0.505 ' HE ' ' HB3' ' A' ' 767' ' ' ARG . 0.0 OUTLIER -104.29 -31.03 9.76 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.026 174.654 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 768' ' ' ARG . . . . . 0.407 HH11 ' HD2' ' A' ' 768' ' ' ARG . 0.0 OUTLIER -83.92 -50.86 7.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.194 177.401 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 769' ' ' HIS . . . . . 0.572 ' HA ' ' CG2' ' A' ' 752' ' ' VAL . 12.3 p-80 46.93 88.22 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.331 1.052 . . . . 0.0 113.037 177.484 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 6.1 mt -78.05 -74.21 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.919 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 771' ' ' GLY . . . . . 0.679 ' H ' HG11 ' A' ' 752' ' ' VAL . . . -111.85 7.91 27.62 Favored Glycine 0 C--N 1.332 0.317 0 C-N-CA 120.485 -0.864 . . . . 0.0 114.375 -170.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 772' ' ' ILE . . . . . 0.847 ' HB ' HG22 ' A' ' 752' ' ' VAL . 43.2 mm -105.0 115.58 62.16 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 117.647 0.724 . . . . 0.0 110.397 176.307 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 773' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -90.63 -170.41 0.38 Allowed 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 123.769 2.98 . . . . 0.0 112.465 176.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 774' ' ' LEU . . . . . 0.459 ' HA ' HG22 ' A' ' 782' ' ' VAL . 1.0 OUTLIER -95.32 -158.22 0.63 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.509 178.041 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 775' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 0.3 OUTLIER -66.49 61.92 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -179.085 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -121.56 22.15 10.71 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 167.859 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 777' ' ' ALA . . . . . 0.851 ' HB1' ' HD2' ' A' ' 778' ' ' PRO . . . -148.47 176.31 2.3 Favored Pre-proline 0 N--CA 1.451 -0.399 0 CA-C-N 113.611 -1.632 . . . . 0.0 108.794 -175.39 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 778' ' ' PRO . . . . . 0.851 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 51.8 Cg_endo -68.65 61.96 1.2 Allowed 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 122.702 2.268 . . . . 0.0 114.176 -178.807 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 102.02 22.26 10.2 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.611 -0.804 . . . . 0.0 113.764 173.208 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 780' ' ' GLU . . . . . 0.584 ' HB2' ' HB3' ' A' ' 777' ' ' ALA . 0.3 OUTLIER -79.57 125.28 29.39 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 117.111 0.456 . . . . 0.0 110.564 178.213 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 20.3 m95 -130.12 115.62 17.32 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.65 0.262 . . . . 0.0 110.429 179.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 782' ' ' VAL . . . . . 0.459 HG22 ' HA ' ' A' ' 774' ' ' LEU . 0.1 OUTLIER -103.04 136.02 37.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 110.176 -0.305 . . . . 0.0 110.176 175.263 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 783' ' ' HIS . . . . . 0.612 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.2 OUTLIER -152.1 132.93 14.11 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.725 0.298 . . . . 0.0 110.827 179.202 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -99.44 100.24 11.26 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.982 0.42 . . . . 0.0 110.176 174.121 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -164.56 178.92 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.764 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -111.51 28.95 8.27 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.94 0.4 . . . . 0.0 110.187 175.106 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 57.82 70.54 1.26 Allowed Pre-proline 0 N--CA 1.465 0.285 0 CA-C-N 115.32 -0.855 . . . . 0.0 111.278 -178.532 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 788' ' ' PRO . . . . . 0.458 ' HB2' ' H ' ' A' ' 789' ' ' HIS . 5.3 Cg_exo -77.09 -96.34 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.724 2.283 . . . . 0.0 112.438 -178.34 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 789' ' ' HIS . . . . . 0.458 ' H ' ' HB2' ' A' ' 788' ' ' PRO . 0.1 OUTLIER -124.11 2.94 8.62 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.964 0.411 . . . . 0.0 111.717 -178.319 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 790' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -104.38 -46.66 4.33 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.669 -175.073 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 791' ' ' LEU . . . . . 0.588 ' HG ' ' CZ ' ' A' ' 765' ' ' PHE . 0.4 OUTLIER -62.91 -51.23 72.73 Favored Pre-proline 0 C--N 1.327 -0.382 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -178.803 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 792' ' ' PRO . . . . . 0.427 ' HD3' ' HB3' ' A' ' 791' ' ' LEU . 24.5 Cg_exo -60.95 -30.59 90.22 Favored 'Trans proline' 0 C--N 1.354 0.836 0 C-N-CA 121.445 1.43 . . . . 0.0 111.626 179.747 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -68.98 -45.49 70.5 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.413 176.716 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 794' ' ' LEU . . . . . 0.444 HD22 ' HA ' ' A' ' 794' ' ' LEU . 0.2 OUTLIER -63.78 -36.58 84.36 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.687 179.437 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 795' ' ' LEU . . . . . 0.443 HD22 ' HA ' ' A' ' 795' ' ' LEU . 0.4 OUTLIER -63.56 -47.61 80.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.771 179.622 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -66.14 -33.6 76.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.105 179.196 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 1.5 ttt-85 -71.05 -37.12 72.53 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.889 179.611 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -69.53 -31.45 49.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.827 -178.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 799' ' ' TYR . . . . . 0.559 ' HD1' ' HE3' ' A' ' 707' ' ' LYS . 17.3 m-85 -85.39 -0.43 54.82 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.578 178.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 47.7 mt 58.4 44.7 17.85 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.337 178.438 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 801' ' ' ILE . . . . . 0.411 ' C ' ' H ' ' A' ' 803' ' ' MET . 48.0 mm -72.01 -40.57 67.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.14 177.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 802' ' ' GLU . . . . . 0.492 ' HA ' ' OG ' ' A' ' 805' ' ' SER . 8.0 mm-40 72.13 -21.68 0.22 Allowed 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.619 0.768 . . . . 0.0 112.873 173.92 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 803' ' ' MET . . . . . 0.411 ' H ' ' C ' ' A' ' 801' ' ' ILE . 6.1 tpt -71.36 -32.15 68.17 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.285 0.564 . . . . 0.0 109.881 175.602 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 804' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -112.29 12.17 20.23 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.995 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 805' ' ' SER . . . . . 0.492 ' OG ' ' HA ' ' A' ' 802' ' ' GLU . 13.8 m -82.98 81.97 8.43 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 174.089 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -80.65 52.54 1.7 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.669 -172.566 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -130.84 90.72 39.07 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.084 177.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 808' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -81.63 54.72 5.23 Favored 'Trans proline' 0 N--CA 1.462 -0.381 0 C-N-CA 122.647 2.232 . . . . 0.0 111.645 178.109 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . 60.14 67.42 0.86 Allowed 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.751 -0.658 . . . . 0.0 109.381 -173.854 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -45.93 -62.52 1.28 Allowed 'General case' 0 C--O 1.232 0.181 0 CA-C-N 114.843 -1.071 . . . . 0.0 112.752 -174.473 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -142.32 -53.26 0.41 Allowed 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -176.539 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -113.45 122.66 34.84 Favored Pre-proline 0 C--N 1.322 -0.587 0 CA-C-O 120.561 0.22 . . . . 0.0 111.546 -173.869 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_exo -58.0 -47.24 21.28 Favored 'Trans proline' 0 C--O 1.232 0.209 0 C-N-CA 122.638 2.225 . . . . 0.0 110.996 172.529 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 1.4 m 69.88 -58.54 0.53 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.884 0.874 . . . . 0.0 113.1 173.374 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -82.15 88.6 6.46 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.244 0.545 . . . . 0.0 112.296 -174.009 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 47.0 t0 -91.75 163.68 13.99 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.689 174.185 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.75 -62.22 1.75 Allowed 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 -179.539 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . 60.56 89.83 0.07 Allowed 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.817 176.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -101.28 135.82 35.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.664 179.519 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 1.7 m -130.61 93.79 3.51 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.104 0.478 . . . . 0.0 111.025 -177.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -83.0 74.55 9.95 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.055 0.455 . . . . 0.0 110.742 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -111.15 5.38 20.01 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.411 179.506 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -101.93 107.44 18.59 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.662 -178.326 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -129.26 -35.82 1.76 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -173.847 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 825' ' ' MET . . . . . 0.543 ' O ' ' HB2' ' A' ' 850' ' ' GLN . 0.1 OUTLIER -127.83 106.66 9.27 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.979 -176.767 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 826' ' ' MET . . . . . 0.489 ' HG2' ' H ' ' A' ' 826' ' ' MET . 0.0 OUTLIER -97.84 108.86 21.66 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.301 0.572 . . . . 0.0 111.3 -177.042 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 827' ' ' ILE . . . . . 0.49 HG23 ' HB ' ' A' ' 871' ' ' ILE . 9.6 mm -107.52 136.13 43.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.312 175.755 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 828' ' ' LEU . . . . . 0.607 HD23 HG13 ' A' ' 872' ' ' VAL . 46.2 tp -106.17 122.61 46.56 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.994 0.425 . . . . 0.0 110.541 -176.599 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 829' ' ' VAL . . . . . 0.632 ' HB ' ' HD2' ' A' ' 837' ' ' ARG . 0.8 OUTLIER -113.38 111.55 36.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.19 -179.361 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 830' ' ' VAL . . . . . 0.621 HG22 ' HB3' ' A' ' 854' ' ' ALA . 12.7 t -117.37 129.27 74.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.335 -179.435 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 831' ' ' ASP . . . . . 0.752 ' HB2' ' NE ' ' A' ' 837' ' ' ARG . 9.1 t0 -134.61 142.54 46.94 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 173.028 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 832' ' ' ASP . . . . . 0.425 ' HB2' ' HB2' ' A' ' 878' ' ' MET . 4.8 p-10 -65.98 -15.1 62.71 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.132 0.492 . . . . 0.0 110.432 174.108 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 833' ' ' HIS . . . . . 0.408 ' HA ' ' HD2' ' A' ' 834' ' ' PRO . 22.1 m170 -117.41 104.99 49.21 Favored Pre-proline 0 C--O 1.234 0.268 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.486 171.246 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 834' ' ' PRO . . . . . 0.408 ' HD2' ' HA ' ' A' ' 833' ' ' HIS . 19.7 Cg_endo -57.67 -35.77 98.7 Favored 'Trans proline' 0 CA--C 1.532 0.392 0 C-N-CA 123.184 2.589 . . . . 0.0 113.799 -173.388 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 835' ' ' ILE . . . . . 0.519 ' O ' ' HG3' ' A' ' 838' ' ' ARG . 0.0 OUTLIER -59.55 -44.38 93.0 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-O 121.006 0.432 . . . . 0.0 111.199 -177.737 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 836' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -65.41 -40.09 92.95 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.248 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 837' ' ' ARG . . . . . 0.752 ' NE ' ' HB2' ' A' ' 831' ' ' ASP . 0.0 OUTLIER -64.97 -46.99 79.21 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.675 -177.028 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 838' ' ' ARG . . . . . 0.519 ' HG3' ' O ' ' A' ' 835' ' ' ILE . 0.3 OUTLIER -65.87 -29.13 69.53 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.839 0.352 . . . . 0.0 110.962 -179.28 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 8.5 mt -66.41 -52.56 45.31 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.944 -179.39 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 840' ' ' LEU . . . . . 0.462 HD11 ' HD3' ' A' ' 837' ' ' ARG . 1.2 pp -72.68 -26.66 61.7 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.588 179.247 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -65.58 -33.28 75.55 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.008 0.433 . . . . 0.0 110.202 174.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -63.14 -43.5 98.2 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.045 175.53 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 843' ' ' GLN . . . . . . . . . . . . . 45.2 mm-40 -64.29 -39.73 94.52 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.387 176.565 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 844' ' ' LEU . . . . . 0.598 HD13 ' HB2' ' A' ' 849' ' ' TYR . 0.0 OUTLIER -61.15 -34.96 75.86 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.578 176.575 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -62.41 -39.0 97.22 Favored Glycine 0 N--CA 1.445 -0.72 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.003 176.465 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -70.32 -23.25 62.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.92 0.391 . . . . 0.0 110.985 176.514 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 847' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' A' ' 847' ' ' LEU . 5.4 mt -78.81 -21.47 47.69 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.885 0.374 . . . . 0.0 111.127 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 102.21 12.15 34.55 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.662 -0.78 . . . . 0.0 113.545 174.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 849' ' ' TYR . . . . . 0.598 ' HB2' HD13 ' A' ' 844' ' ' LEU . 66.6 m-85 -104.68 138.4 41.04 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.958 0.379 . . . . 0.0 109.986 178.658 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 850' ' ' GLN . . . . . 0.543 ' HB2' ' O ' ' A' ' 825' ' ' MET . 4.7 mp0 -73.03 121.08 19.57 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 179.275 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 851' ' ' CYS . . . . . 0.471 ' SG ' ' HB3' ' A' ' 844' ' ' LEU . 0.0 OUTLIER -108.13 126.83 53.23 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 120.988 0.423 . . . . 0.0 111.607 -173.884 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 852' ' ' LYS . . . . . 0.422 ' O ' HD12 ' A' ' 828' ' ' LEU . 0.0 OUTLIER -106.36 111.76 24.48 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 174.797 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 853' ' ' THR . . . . . 0.468 ' HA ' HG23 ' A' ' 829' ' ' VAL . 0.9 OUTLIER -91.18 124.58 35.5 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 120.93 0.395 . . . . 0.0 111.451 -174.632 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 854' ' ' ALA . . . . . 0.621 ' HB3' HG22 ' A' ' 830' ' ' VAL . . . -130.11 142.28 50.61 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.961 -179.681 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 855' ' ' ASN . . . . . 0.56 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 20.2 t30 -124.22 74.99 1.34 Allowed 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 177.026 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 856' ' ' ASP . . . . . 0.743 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 12.0 t70 166.14 147.37 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.036 177.043 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -71.9 -41.91 54.13 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.566 178.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 2.0 t -73.7 -34.7 41.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.077 0.465 . . . . 0.0 110.598 -178.363 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 859' ' ' ASP . . . . . 0.743 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 1.1 t0 -64.27 -27.74 69.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.939 -178.867 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -62.14 -38.39 88.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.139 0.495 . . . . 0.0 110.352 176.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 861' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.14 -33.01 63.39 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.93 176.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -60.56 -53.76 53.64 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.858 178.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 10.7 p -66.01 -32.21 57.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.769 0.318 . . . . 0.0 110.945 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 864' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.99 -40.46 97.82 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.565 176.578 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 7.4 m -74.31 -27.28 60.64 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.862 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 866' ' ' LYS . . . . . 0.536 ' HA ' ' HD2' ' A' ' 866' ' ' LYS . 1.3 tptm -69.79 -55.85 8.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.716 179.532 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 867' ' ' ASN . . . . . 0.482 ' HB3' ' H ' ' A' ' 868' ' ' HIS . 6.0 t30 -119.15 -105.5 0.39 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.905 178.904 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 868' ' ' HIS . . . . . 0.482 ' H ' ' HB3' ' A' ' 867' ' ' ASN . 0.1 OUTLIER 178.93 155.54 0.45 Allowed 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 178.571 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 869' ' ' ILE . . . . . 0.452 HG12 ' HB2' ' A' ' 828' ' ' LEU . 0.7 OUTLIER -143.25 147.98 19.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 -179.794 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.69 -49.98 5.13 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.694 0.283 . . . . 0.0 111.356 -178.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 871' ' ' ILE . . . . . 0.49 ' HB ' HG23 ' A' ' 827' ' ' ILE . 18.7 mm -111.54 123.98 67.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.272 -178.373 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 872' ' ' VAL . . . . . 0.607 HG13 HD23 ' A' ' 828' ' ' LEU . 1.8 t -109.52 125.92 66.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.217 -179.086 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 873' ' ' LEU . . . . . 0.698 HD11 HD12 ' A' ' 936' ' ' LEU . 47.3 mt -111.49 100.83 9.32 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 173.456 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 5.7 m -105.77 101.49 11.0 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.939 0.4 . . . . 0.0 111.22 -176.206 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 875' ' ' ASP . . . . . 0.673 ' OD1' ' HG2' ' A' ' 925' ' ' LYS . 0.6 OUTLIER -92.62 106.6 18.55 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.383 -179.517 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 876' ' ' VAL . . . . . 0.683 HG12 ' HG2' ' A' ' 879' ' ' PRO . 0.1 OUTLIER -115.45 111.99 37.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.314 0.578 . . . . 0.0 112.134 -172.25 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -119.65 -44.59 2.54 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.664 172.044 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 878' ' ' MET . . . . . 0.425 ' HB2' ' HB2' ' A' ' 832' ' ' ASP . 4.4 tpp -69.61 -50.15 19.47 Favored Pre-proline 0 CA--C 1.537 0.443 0 CA-C-N 115.559 -0.746 . . . . 0.0 112.699 -178.844 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 879' ' ' PRO . . . . . 0.683 ' HG2' HG12 ' A' ' 876' ' ' VAL . 34.7 Cg_exo -59.3 103.94 0.19 Allowed 'Trans proline' 0 C--N 1.357 1.011 0 C-N-CA 121.961 1.774 . . . . 0.0 112.579 179.197 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -113.54 -53.9 2.65 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.715 179.243 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -94.51 -22.86 17.97 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.105 179.471 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -87.97 2.96 50.43 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.836 -179.38 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -76.9 38.33 1.52 Allowed Glycine 0 C--N 1.331 0.301 0 CA-C-N 115.793 -0.64 . . . . 0.0 112.047 178.725 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -137.22 -40.91 0.58 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -68.47 -47.33 67.39 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.677 -179.017 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 886' ' ' LEU . . . . . 0.647 ' HG ' ' N ' ' A' ' 887' ' ' THR . 0.0 OUTLIER -65.55 -43.55 89.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.646 -0.252 . . . . 0.0 110.384 -179.495 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 887' ' ' THR . . . . . 0.647 ' N ' ' HG ' ' A' ' 886' ' ' LEU . 0.0 OUTLIER -62.52 -44.89 95.25 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.218 0.532 . . . . 0.0 110.662 -179.483 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 888' ' ' GLN . . . . . 0.79 ' HA ' ' HD3' ' A' ' 891' ' ' ARG . 15.9 tt0 -63.47 -41.31 98.61 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.624 177.842 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -67.27 -41.66 85.13 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.192 0.441 . . . . 0.0 112.192 -175.185 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 890' ' ' ILE . . . . . 0.614 HG13 ' O ' ' A' ' 886' ' ' LEU . 22.2 mt -68.54 -42.63 83.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.881 -179.478 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 891' ' ' ARG . . . . . 0.79 ' HD3' ' HA ' ' A' ' 888' ' ' GLN . 0.7 OUTLIER -68.92 -23.93 64.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.032 0.444 . . . . 0.0 110.216 177.262 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 -71.18 -42.14 69.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.367 176.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 893' ' ' LEU . . . . . 0.493 HD22 ' HA ' ' A' ' 893' ' ' LEU . 0.2 OUTLIER -71.26 -32.8 69.14 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.183 179.071 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 115.66 87.5 1.41 Allowed Glycine 0 N--CA 1.441 -1.017 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.747 178.554 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 895' ' ' LEU . . . . . 0.524 HD12 HG22 ' A' ' 890' ' ' ILE . 0.3 OUTLIER -63.74 109.27 1.66 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.125 0.488 . . . . 0.0 110.602 177.781 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -120.77 16.95 11.9 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.805 0.812 . . . . 0.0 109.469 176.284 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 897' ' ' LEU . . . . . 0.463 HD12 HG21 ' A' ' 872' ' ' VAL . 0.0 OUTLIER -139.06 123.88 11.63 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 114.801 -1.09 . . . . 0.0 109.283 -176.665 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 898' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 897' ' ' LEU . 35.5 Cg_exo -59.28 121.41 9.86 Favored 'Trans proline' 0 C--O 1.238 0.494 0 C-N-CA 122.888 2.392 . . . . 0.0 112.305 -177.69 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 899' ' ' VAL . . . . . 0.558 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 26.5 t -98.36 108.68 22.45 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 CA-C-O 121.257 0.551 . . . . 0.0 110.639 -179.603 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 900' ' ' ILE . . . . . 0.421 HG23 ' HB2' ' A' ' 921' ' ' SER . 2.5 mt -84.41 92.42 3.11 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 175.445 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 901' ' ' GLY . . . . . 0.711 ' HA3' ' SD ' ' A' ' 919' ' ' MET . . . -83.4 122.41 5.77 Favored Glycine 0 N--CA 1.441 -1.026 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.075 -176.093 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 902' ' ' VAL . . . . . 0.682 ' HB ' ' HB2' ' A' ' 923' ' ' LEU . 0.2 OUTLIER -111.57 117.09 54.28 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 178.459 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 903' ' ' THR . . . . . 0.651 ' HB ' ' HB2' ' A' ' 906' ' ' ALA . 0.0 OUTLIER -107.64 148.88 28.77 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.917 -172.271 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 904' ' ' ALA . . . . . 0.66 ' HB2' ' HG3' ' A' ' 925' ' ' LYS . . . -90.51 134.51 34.31 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.494 175.538 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 53.69 43.26 31.34 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.298 179.627 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 906' ' ' ALA . . . . . 0.651 ' HB2' ' HB ' ' A' ' 903' ' ' THR . . . -92.25 93.76 8.82 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.059 177.245 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -52.33 -49.11 64.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.254 -178.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -127.06 88.56 2.83 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.103 176.564 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 909' ' ' GLU . . . . . 0.7 ' HB3' ' HB2' ' A' ' 922' ' ' CYS . 10.7 mt-10 -57.85 -34.97 70.28 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.179 -176.865 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 910' ' ' GLU . . . . . 0.529 ' H ' ' HG3' ' A' ' 910' ' ' GLU . 0.0 OUTLIER -58.78 -57.03 14.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.998 178.638 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 8.0 tttt -65.52 -27.93 68.82 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.197 179.334 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -62.91 -44.96 94.67 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 176.022 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 913' ' ' ARG . . . . . 0.508 ' HD2' ' O ' ' A' ' 913' ' ' ARG . 0.0 OUTLIER -65.63 -37.9 87.86 Favored 'General case' 0 C--O 1.225 -0.201 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.053 175.999 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 19.0 m -58.66 -37.16 75.39 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.871 0.367 . . . . 0.0 110.937 177.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.84 -51.23 42.69 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.755 -178.206 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 916' ' ' GLU . . . . . 0.446 ' OE2' ' HD3' ' A' ' 913' ' ' ARG . 0.0 OUTLIER -77.11 -42.64 37.18 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 111.627 0.232 . . . . 0.0 111.627 -175.219 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 1.4 m 53.06 52.15 14.35 Favored 'General case' 0 C--O 1.235 0.32 0 O-C-N 123.464 0.478 . . . . 0.0 112.149 -178.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -139.66 -32.8 0.17 Allowed Glycine 0 CA--C 1.523 0.578 0 C-N-CA 120.51 -0.853 . . . . 0.0 113.745 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 919' ' ' MET . . . . . 0.711 ' SD ' ' HA3' ' A' ' 901' ' ' GLY . 20.2 mtt -76.58 -93.54 0.03 OUTLIER 'General case' 0 C--O 1.238 0.488 0 CA-C-N 117.311 0.556 . . . . 0.0 112.171 -174.311 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 920' ' ' ASP . . . . . 0.52 ' HB2' ' O ' ' A' ' 919' ' ' MET . 45.0 t0 162.29 -73.16 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.191 0.996 . . . . 0.0 109.643 176.705 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 921' ' ' SER . . . . . 0.421 ' HB2' HG23 ' A' ' 900' ' ' ILE . 0.0 OUTLIER -105.91 172.02 7.03 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.054 -179.765 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 922' ' ' CYS . . . . . 0.7 ' HB2' ' HB3' ' A' ' 909' ' ' GLU . 0.8 OUTLIER -140.42 136.78 33.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.292 0.568 . . . . 0.0 111.881 -178.278 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 923' ' ' LEU . . . . . 0.682 ' HB2' ' HB ' ' A' ' 902' ' ' VAL . 0.3 OUTLIER -133.73 178.21 7.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.192 177.158 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -104.18 143.1 33.39 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.268 178.594 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 925' ' ' LYS . . . . . 0.673 ' HG2' ' OD1' ' A' ' 875' ' ' ASP . 0.0 OUTLIER -48.63 -43.5 63.11 Favored Pre-proline 0 N--CA 1.475 0.823 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -176.034 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 926' ' ' PRO . . . . . 0.514 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 37.7 Cg_endo -66.71 68.44 0.51 Allowed 'Trans proline' 0 C--N 1.356 0.929 0 C-N-CA 121.885 1.723 . . . . 0.0 112.998 175.441 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 927' ' ' VAL . . . . . 0.704 HG13 ' HB ' ' A' ' 931' ' ' VAL . 42.3 t -87.8 110.67 21.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.038 0.447 . . . . 0.0 110.425 177.225 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.36 167.49 20.16 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.29 176.074 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 929' ' ' LEU . . . . . 0.438 ' HA ' HG23 ' A' ' 932' ' ' ILE . 0.7 OUTLIER -54.62 -38.66 67.09 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.69 0.281 . . . . 0.0 111.604 -177.975 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -68.72 -23.35 64.34 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.854 0.359 . . . . 0.0 110.747 -177.651 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 931' ' ' VAL . . . . . 0.704 ' HB ' HG13 ' A' ' 927' ' ' VAL . 18.4 t -78.13 -41.57 26.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.418 179.062 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 932' ' ' ILE . . . . . 0.438 HG23 ' HA ' ' A' ' 929' ' ' LEU . 0.0 OUTLIER -66.64 -37.16 78.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 177.277 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -60.7 -49.05 79.08 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.439 -179.503 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 934' ' ' GLN . . . . . 0.453 ' HG3' ' H ' ' A' ' 935' ' ' THR . 0.3 OUTLIER -71.74 -48.96 43.45 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -175.941 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 935' ' ' THR . . . . . 0.453 ' H ' ' HG3' ' A' ' 934' ' ' GLN . 1.6 m -66.73 -43.4 84.32 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 111.828 0.307 . . . . 0.0 111.828 -174.363 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 936' ' ' LEU . . . . . 0.698 HD12 HD11 ' A' ' 873' ' ' LEU . 0.3 OUTLIER -66.23 -49.92 65.6 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.636 0.255 . . . . 0.0 110.812 -179.577 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 95.0 m -62.2 -46.06 90.61 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.25 -178.676 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 938' ' ' LEU . . . . . 0.466 ' O ' ' HB3' ' A' ' 942' ' ' ARG . 29.3 tp -62.82 -47.77 81.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.182 -178.46 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -69.26 -40.73 77.67 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.613 -0.267 . . . . 0.0 111.171 -177.097 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -66.36 -40.98 90.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.737 0.303 . . . . 0.0 111.006 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 941' ' ' GLU . . . . . 0.584 ' O ' ' HG3' ' A' ' 944' ' ' ARG . 0.0 OUTLIER -69.99 -33.8 72.51 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.87 0.366 . . . . 0.0 110.216 178.473 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 942' ' ' ARG . . . . . 0.466 ' HB3' ' O ' ' A' ' 938' ' ' LEU . 0.0 OUTLIER -66.84 -37.7 84.98 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.446 -178.511 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 943' ' ' VAL . . . . . 0.461 ' N ' ' HG3' ' A' ' 942' ' ' ARG . 17.1 m -78.08 -33.8 18.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.646 -0.422 . . . . 0.0 110.954 -177.496 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 944' ' ' ARG . . . . . 0.584 ' HG3' ' O ' ' A' ' 941' ' ' GLU . 0.2 OUTLIER -73.56 -21.63 60.3 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.32 177.42 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 16.0 mmtp -67.32 -52.4 40.79 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-O 121.33 0.586 . . . . 0.0 109.885 171.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 50.3 m -63.5 -44.32 94.67 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.123 -0.944 . . . . 0.0 111.428 -177.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -68.38 -60.94 2.07 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.77 -0.196 . . . . 0.0 110.51 178.297 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 6.7 t70 72.55 -34.13 0.29 Allowed 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.724 0.81 . . . . 0.0 112.79 175.624 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 14.6 m . . . . . 0 C--O 1.246 0.915 0 CA-C-O 118.869 -0.586 . . . . 0.0 109.892 -179.601 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 2.9 tpt . . . . . 0 N--CA 1.478 0.926 0 CA-C-O 120.9 0.381 . . . . 0.0 110.501 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 146.47 169.06 13.98 Favored Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.938 -0.648 . . . . 0.0 111.87 -179.76 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . -81.11 62.3 4.47 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.517 -178.391 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -94.32 141.8 28.15 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.255 -0.276 . . . . 0.0 110.255 179.594 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . -159.07 -77.05 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.943 -179.435 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 701' ' ' VAL . . . . . 0.605 ' HB ' ' HB3' ' A' ' 802' ' ' GLU . 6.7 t 58.41 72.35 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 CA-C-O 121.517 0.675 . . . . 0.0 110.341 -178.768 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -75.35 70.87 2.29 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.557 -0.747 . . . . 0.0 112.43 -174.462 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 703' ' ' GLY . . . . . 0.425 ' HA3' ' HG2' ' A' ' 804' ' ' GLU . . . -85.06 -52.41 3.45 Favored Glycine 0 N--CA 1.449 -0.438 0 N-CA-C 110.527 -1.029 . . . . 0.0 110.527 171.24 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.909 ' HA ' ' HB ' ' A' ' 801' ' ' ILE . 1.8 mt 63.41 62.13 0.99 Allowed 'General case' 0 C--N 1.332 -0.172 0 C-N-CA 123.21 0.604 . . . . 0.0 112.456 173.391 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 705' ' ' SER . . . . . 0.474 ' HA ' ' C ' ' A' ' 730' ' ' GLY . 0.8 OUTLIER -127.47 145.89 50.68 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.012 175.397 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 108.51 -36.13 4.54 Favored Glycine 0 CA--C 1.52 0.355 0 C-N-CA 120.384 -0.912 . . . . 0.0 114.037 171.343 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 707' ' ' LYS . . . . . 0.403 ' NZ ' ' HB3' ' A' ' 744' ' ' GLU . 7.2 mmmt -75.4 155.61 36.23 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 117.011 0.406 . . . . 0.0 111.624 -174.832 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 708' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -97.63 149.32 22.38 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.875 178.585 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -134.88 131.7 37.65 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 177.454 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 710' ' ' TRP . . . . . 0.471 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 70.4 m95 -105.06 124.72 50.01 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.901 0.382 . . . . 0.0 110.679 -177.715 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 711' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -120.51 138.97 53.55 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.198 0.523 . . . . 0.0 111.046 -179.257 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -124.6 67.39 1.09 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.125 176.002 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 713' ' ' VAL . . . . . 0.754 HG13 ' HB3' ' A' ' 750' ' ' ASP . 41.4 t -122.39 122.44 66.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.277 -177.617 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 714' ' ' ARG . . . . . 0.48 HH11 ' HB2' ' A' ' 714' ' ' ARG . 0.1 OUTLIER -86.74 -25.29 24.79 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 176.271 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -67.63 104.53 1.63 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.274 178.271 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 716' ' ' ALA . . . . . 0.652 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -60.45 -43.25 97.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.065 -0.516 . . . . 0.0 112.0 -173.071 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.02 -39.64 95.36 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.193 0.521 . . . . 0.0 110.524 179.538 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.04 -49.57 27.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.155 -178.032 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 719' ' ' CYS . . . . . 0.739 ' HB3' ' HB ' ' A' ' 713' ' ' VAL . 28.4 p -64.79 -40.59 95.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.556 -177.928 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 720' ' ' GLN . . . . . 0.554 ' HB2' ' O ' ' A' ' 716' ' ' ALA . 0.0 OUTLIER -63.23 -40.39 97.31 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.382 -179.543 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -57.68 -48.76 78.63 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.958 0.409 . . . . 0.0 110.47 178.842 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 722' ' ' LEU . . . . . 0.469 ' O ' ' HG ' ' A' ' 726' ' ' LEU . 6.4 mt -67.66 -48.19 67.34 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.58 -178.342 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 723' ' ' GLU . . . . . 0.885 ' HA ' HG11 ' A' ' 733' ' ' VAL . 0.0 OUTLIER -62.57 -43.97 97.5 Favored 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 111.579 0.214 . . . . 0.0 111.579 -174.126 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 724' ' ' THR . . . . . 0.512 ' O ' ' HB3' ' A' ' 728' ' ' ARG . 28.1 m -64.83 -39.26 93.29 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.715 0.293 . . . . 0.0 110.811 -179.613 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 44.0 m -65.38 -32.57 74.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.783 0.325 . . . . 0.0 111.388 179.679 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 726' ' ' LEU . . . . . 0.675 HD22 HD12 ' A' ' 731' ' ' ILE . 24.9 mt -81.95 -47.9 12.14 Favored 'General case' 0 C--N 1.322 -0.626 0 O-C-N 122.208 -0.307 . . . . 0.0 110.921 -178.418 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 727' ' ' GLN . . . . . 0.456 ' HG2' ' HA ' ' A' ' 724' ' ' THR . 3.1 pt20 -67.92 -25.08 65.3 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.527 -177.283 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 728' ' ' ARG . . . . . 0.512 ' HB3' ' O ' ' A' ' 724' ' ' THR . 0.0 OUTLIER -64.03 -31.37 72.54 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 121.114 0.483 . . . . 0.0 110.304 178.303 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -85.67 -51.01 6.75 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.378 179.047 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 730' ' ' GLY . . . . . 0.474 ' C ' ' HA ' ' A' ' 705' ' ' SER . . . 154.32 -6.29 0.33 Allowed Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.508 -0.853 . . . . 0.0 112.689 178.448 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 731' ' ' ILE . . . . . 0.675 HD12 HD22 ' A' ' 726' ' ' LEU . 0.2 OUTLIER -75.3 114.08 14.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 176.604 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 732' ' ' VAL . . . . . . . . . . . . . 2.1 p -74.58 113.96 13.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 121.719 0.771 . . . . 0.0 110.78 -176.377 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 733' ' ' VAL . . . . . 0.885 HG11 ' HA ' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -85.94 136.88 21.92 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.861 -179.21 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -145.36 137.7 25.79 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.483 177.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -61.47 124.86 21.81 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 173.81 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 736' ' ' TYR . . . . . 0.471 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 47.2 t80 -55.71 -47.05 77.49 Favored 'General case' 0 C--O 1.232 0.17 0 O-C-N 123.242 0.339 . . . . 0.0 110.278 -179.259 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 54.61 -108.78 0.45 Allowed 'General case' 0 CA--C 1.53 0.183 0 O-C-N 123.728 0.643 . . . . 0.0 110.431 177.354 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -129.62 37.67 2.13 Favored Glycine 0 N--CA 1.445 -0.743 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 176.564 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -84.19 -172.48 4.18 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.002 0.43 . . . . 0.0 111.31 -177.482 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.61 126.89 54.59 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.977 -178.888 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 741' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -71.61 123.46 9.46 Favored 'Trans proline' 0 N--CA 1.462 -0.345 0 C-N-CA 122.612 2.208 . . . . 0.0 111.876 175.14 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 742' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.47 134.93 19.49 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-O 120.699 0.285 . . . . 0.0 111.066 179.691 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 743' ' ' PRO . . . . . 0.514 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 57.3 Cg_endo -71.15 3.72 3.27 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 123.102 2.535 . . . . 0.0 112.464 179.419 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 744' ' ' GLU . . . . . 0.403 ' HB3' ' NZ ' ' A' ' 707' ' ' LYS . 2.2 mm-40 -109.95 -12.29 14.57 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.714 178.792 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 85.2 m-20 -114.47 165.44 12.74 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.722 -172.106 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 746' ' ' VAL . . . . . 0.617 HG21 HD21 ' A' ' 795' ' ' LEU . 18.8 m -117.1 148.43 19.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.965 -175.334 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 747' ' ' LEU . . . . . 0.515 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 0.3 OUTLIER -104.72 113.27 26.75 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.91 175.764 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 3.7 mt -97.45 113.53 32.16 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 175.19 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -114.77 164.74 13.65 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.576 -170.089 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 750' ' ' ASP . . . . . 0.754 ' HB3' HG13 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -125.62 123.35 38.81 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 168.548 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 751' ' ' GLU . . . . . 0.877 ' HG2' HH21 ' A' ' 767' ' ' ARG . 0.0 OUTLIER 61.95 176.84 0.13 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.681 -172.8 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 752' ' ' VAL . . . . . 0.527 HG23 ' HB ' ' A' ' 772' ' ' ILE . 2.6 p -69.86 131.76 33.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.402 -176.182 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 4.4 p -120.41 164.69 16.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.161 179.36 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.2 50.29 1.91 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.879 0.371 . . . . 0.0 111.023 -179.531 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -152.71 132.17 12.95 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.149 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 6.2 tptp -89.97 -18.76 25.44 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.886 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 757' ' ' TRP . . . . . 0.515 ' CD2' ' HB2' ' A' ' 747' ' ' LEU . 73.7 t-105 67.37 96.98 0.06 Allowed 'General case' 0 C--O 1.234 0.248 0 C-N-CA 123.237 0.615 . . . . 0.0 111.928 176.558 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 32.3 tp60 -86.84 58.15 4.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.445 0.641 . . . . 0.0 109.789 173.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 759' ' ' GLY . . . . . 0.514 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -119.25 -147.29 8.06 Favored Glycine 0 N--CA 1.443 -0.834 0 CA-C-N 115.696 -0.684 . . . . 0.0 112.016 -179.075 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 5.3 ttm180 -77.01 -59.74 2.65 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.204 0.526 . . . . 0.0 109.922 177.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -152.88 155.12 36.44 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.0 -179.154 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 2.7 p -128.07 128.53 68.94 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 177.046 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 763' ' ' VAL . . . . . 0.551 HG13 ' HB2' ' A' ' 781' ' ' TRP . 0.1 OUTLIER -118.09 102.94 13.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.48 -178.945 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 764' ' ' THR . . . . . 0.481 ' HB ' HG23 ' A' ' 782' ' ' VAL . 91.0 m -100.66 124.45 46.27 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.798 -0.637 . . . . 0.0 112.022 -174.693 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 765' ' ' PHE . . . . . 0.562 ' HA ' ' O ' ' A' ' 783' ' ' HIS . 34.5 m-85 -79.79 78.49 6.37 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.539 173.345 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 766' ' ' CYS . . . . . 0.472 ' SG ' HG21 ' A' ' 772' ' ' ILE . 0.0 OUTLIER -106.93 133.24 51.88 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.327 -172.195 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 767' ' ' ARG . . . . . 0.877 HH21 ' HG2' ' A' ' 751' ' ' GLU . 0.0 OUTLIER -111.0 -24.62 10.25 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 174.06 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -103.41 -71.33 0.73 Allowed 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.084 175.584 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 769' ' ' HIS . . . . . 0.59 ' HB2' HG22 ' A' ' 772' ' ' ILE . 0.0 OUTLIER 66.6 129.0 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 122.112 0.958 . . . . 0.0 112.377 179.735 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 770' ' ' ILE . . . . . 0.445 HD12 HG11 ' A' ' 752' ' ' VAL . 6.4 mt -128.66 -79.96 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.021 -0.991 . . . . 0.0 109.681 176.05 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -82.69 -21.2 60.19 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.932 -0.651 . . . . 0.0 111.846 177.327 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 772' ' ' ILE . . . . . 0.59 HG22 ' HB2' ' A' ' 769' ' ' HIS . 0.3 OUTLIER -67.45 141.91 95.99 Favored Pre-proline 0 C--O 1.237 0.405 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 176.395 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 773' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -91.05 -143.41 0.02 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.098 0 C-N-CA 123.156 2.57 . . . . 0.0 113.22 -174.04 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 774' ' ' LEU . . . . . 0.547 ' HA ' ' HB ' ' A' ' 782' ' ' VAL . 0.4 OUTLIER -176.24 -172.26 0.47 Allowed 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 -177.729 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 775' ' ' GLU . . . . . 0.552 ' HA ' ' O ' ' A' ' 780' ' ' GLU . 0.6 OUTLIER -65.81 52.73 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 113.021 0.748 . . . . 0.0 113.021 175.745 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.3 -21.55 23.11 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 169.624 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 777' ' ' ALA . . . . . 0.449 ' HB1' ' HD2' ' A' ' 778' ' ' PRO . . . -133.03 157.68 77.75 Favored Pre-proline 0 N--CA 1.449 -0.482 0 CA-C-N 114.382 -1.281 . . . . 0.0 108.443 174.82 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 778' ' ' PRO . . . . . 0.449 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 49.3 Cg_endo -68.58 -4.3 12.81 Favored 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 122.552 2.168 . . . . 0.0 114.089 -173.921 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . -112.58 -4.0 25.16 Favored Glycine 0 N--CA 1.453 -0.167 0 C-N-CA 120.575 -0.821 . . . . 0.0 112.358 -176.76 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 780' ' ' GLU . . . . . 0.552 ' O ' ' HA ' ' A' ' 775' ' ' GLU . 6.7 mt-10 -118.86 125.45 49.55 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 -179.167 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 781' ' ' TRP . . . . . 0.551 ' HB2' HG13 ' A' ' 763' ' ' VAL . 15.2 m95 -130.25 147.16 51.94 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 -177.717 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 782' ' ' VAL . . . . . 0.547 ' HB ' ' HA ' ' A' ' 774' ' ' LEU . 0.4 OUTLIER -142.69 145.94 22.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-O 120.848 0.356 . . . . 0.0 110.5 179.46 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 783' ' ' HIS . . . . . 0.562 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 2.1 t-160 -157.5 135.96 11.24 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.975 178.278 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -98.21 100.85 12.18 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.404 175.832 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 785' ' ' VAL . . . . . 0.488 ' HB ' ' HD3' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -163.21 -172.9 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 179.937 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -117.66 39.28 3.37 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.639 177.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 787' ' ' ALA . . . . . 0.424 ' N ' ' HD3' ' A' ' 788' ' ' PRO . . . 57.87 61.94 5.46 Favored Pre-proline 0 N--CA 1.463 0.213 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.632 -179.186 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 788' ' ' PRO . . . . . 0.488 ' HD3' ' HB ' ' A' ' 785' ' ' VAL . 19.3 Cg_exo -66.93 -65.51 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.433 2.089 . . . . 0.0 111.979 -177.448 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -171.63 -16.61 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 178.17 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 790' ' ' GLU . . . . . . . . . . . . . 6.3 pm0 -76.15 -35.46 59.19 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 121.006 -0.278 . . . . 0.0 111.407 -173.775 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 791' ' ' LEU . . . . . 0.52 HD22 ' CE2' ' A' ' 765' ' ' PHE . 0.2 OUTLIER -73.31 -50.18 6.47 Favored Pre-proline 0 CA--C 1.533 0.308 0 CA-C-O 119.489 -0.291 . . . . 0.0 111.77 -179.128 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 792' ' ' PRO . . . . . 0.477 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 11.0 Cg_endo -57.37 -32.87 95.12 Favored 'Trans proline' 0 C--N 1.357 1.024 0 C-N-CA 121.7 1.6 . . . . 0.0 112.212 175.216 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -70.93 -44.27 66.5 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.952 0.406 . . . . 0.0 110.678 177.198 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -61.9 -40.47 95.56 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.506 178.452 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 795' ' ' LEU . . . . . 0.617 HD21 HG21 ' A' ' 746' ' ' VAL . 0.0 OUTLIER -65.13 -34.7 79.01 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.119 -179.453 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -61.4 -41.73 97.6 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.255 0.55 . . . . 0.0 110.021 176.769 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 797' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 797' ' ' ARG . 2.7 ttt-85 -71.28 -32.37 68.59 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.734 178.614 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 2.8 mt -66.22 -45.75 89.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.826 179.628 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -75.17 -43.55 51.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.149 -176.902 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 4.9 mt 50.47 61.82 3.01 Favored 'General case' 0 C--O 1.236 0.366 0 O-C-N 123.644 0.59 . . . . 0.0 111.534 179.022 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 801' ' ' ILE . . . . . 0.909 ' HB ' ' HA ' ' A' ' 704' ' ' LEU . 1.6 mt -96.32 108.08 20.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.907 177.726 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 802' ' ' GLU . . . . . 0.605 ' HB3' ' HB ' ' A' ' 701' ' ' VAL . 0.2 OUTLIER -85.86 -10.78 54.8 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.972 -178.183 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 803' ' ' MET . . . . . . . . . . . . . 27.4 ttp -72.71 116.23 12.94 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.948 -1.024 . . . . 0.0 109.403 175.302 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 804' ' ' GLU . . . . . 0.425 ' HG2' ' HA3' ' A' ' 703' ' ' GLY . 12.4 mt-10 -100.48 163.54 12.32 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.522 -177.285 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -95.36 -179.93 4.95 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.159 0.504 . . . . 0.0 111.497 -177.798 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -106.4 143.96 33.77 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 169.779 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 807' ' ' ASP . . . . . 0.424 ' HA ' ' HD3' ' A' ' 808' ' ' PRO . 31.5 t70 -105.45 109.44 63.2 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-O 120.992 0.425 . . . . 0.0 111.514 -175.14 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 808' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 807' ' ' ASP . 2.8 Cg_exo -77.46 120.7 5.33 Favored 'Trans proline' 0 C--O 1.235 0.348 0 C-N-CA 123.258 2.639 . . . . 0.0 112.001 176.979 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -104.4 149.65 25.22 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.47 179.848 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -162.15 133.25 5.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.653 0.263 . . . . 0.0 110.781 -178.61 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -142.58 151.96 42.07 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.964 177.475 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -143.0 97.42 5.78 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 120.761 0.315 . . . . 0.0 111.513 -176.662 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -90.0 115.0 0.56 Allowed 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 122.866 2.378 . . . . 0.0 111.851 174.782 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -133.68 137.09 45.14 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.189 -176.823 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -134.03 162.51 31.88 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.046 -179.097 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -131.5 156.71 45.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.751 0.31 . . . . 0.0 110.709 179.066 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -135.49 145.88 47.58 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.613 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -129.17 145.85 51.22 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.946 -179.292 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 4.0 p -155.09 136.87 5.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.151 -179.176 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -141.09 155.45 46.13 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.764 0.316 . . . . 0.0 110.416 177.752 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -149.18 -176.15 5.25 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.279 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -154.49 -89.73 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.543 -0.298 . . . . 0.0 110.664 -178.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 14.6 t70 54.87 77.31 0.21 Allowed 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.394 0.616 . . . . 0.0 110.293 -176.011 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -147.43 82.18 1.53 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.884 -178.949 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -107.6 135.34 49.22 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.404 175.292 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 826' ' ' MET . . . . . 0.653 ' HG3' ' HA ' ' A' ' 869' ' ' ILE . 0.4 OUTLIER -115.76 124.11 49.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.277 0.56 . . . . 0.0 111.587 -173.684 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 827' ' ' ILE . . . . . 0.4 HG23 ' HB ' ' A' ' 871' ' ' ILE . 3.1 mm -117.34 138.77 46.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.086 178.516 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 828' ' ' LEU . . . . . 0.661 ' HB2' HG21 ' A' ' 869' ' ' ILE . 0.5 OUTLIER -105.21 122.39 45.82 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.727 0.299 . . . . 0.0 110.728 179.309 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -104.31 100.82 11.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.993 176.19 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 830' ' ' VAL . . . . . 0.432 HG22 HD22 ' A' ' 828' ' ' LEU . 5.1 t -109.04 112.2 39.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.304 -179.38 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 831' ' ' ASP . . . . . 0.748 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 11.5 t0 -121.58 142.94 49.61 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 178.778 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -78.75 -21.01 48.6 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.699 -178.765 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 15.7 m80 -114.31 109.85 48.49 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.132 177.91 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -51.13 -38.57 60.69 Favored 'Trans proline' 0 CA--C 1.531 0.368 0 C-N-CA 123.766 2.978 . . . . 0.0 114.668 -173.85 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -64.19 -38.99 83.92 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-O 121.223 0.535 . . . . 0.0 110.678 -179.275 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 836' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -73.57 -37.83 65.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.613 178.41 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 837' ' ' ARG . . . . . 0.748 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 16.2 ttp180 -55.83 -44.34 77.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.448 176.579 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 7.1 ttm180 -59.18 -41.78 89.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.789 178.237 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 1.7 tp -58.88 -52.6 65.02 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.744 -179.723 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 840' ' ' LEU . . . . . 0.489 HD11 ' HA ' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -72.99 -30.44 63.8 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 120.79 -0.364 . . . . 0.0 111.597 -177.476 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -66.44 -37.55 85.43 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.097 0.475 . . . . 0.0 110.702 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -67.9 -41.04 83.33 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.301 178.042 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 843' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -62.74 -50.8 69.63 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.679 178.459 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 844' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.48 -35.78 74.75 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.993 178.038 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -62.97 -35.01 91.49 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.058 177.247 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 4.2 m -76.64 -26.81 55.3 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.873 0.368 . . . . 0.0 110.521 178.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 847' ' ' LEU . . . . . 0.611 HD21 ' HG2' ' A' ' 933' ' ' LYS . 3.6 mp -63.13 -33.68 75.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.013 177.503 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 97.59 26.91 9.49 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.692 -0.765 . . . . 0.0 112.918 176.438 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 849' ' ' TYR . . . . . 0.449 ' HE2' HD23 ' A' ' 847' ' ' LEU . 38.9 m-85 -112.09 155.77 23.32 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 176.863 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -69.08 118.0 11.43 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 178.783 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -107.3 126.19 52.12 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.16 0.505 . . . . 0.0 111.399 -173.986 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -111.0 140.44 45.53 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 171.633 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -118.31 144.05 46.14 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 120.559 -0.456 . . . . 0.0 111.643 -174.013 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 854' ' ' ALA . . . . . . . . . . . . . . . -149.21 150.55 32.8 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.157 178.024 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 855' ' ' ASN . . . . . 0.543 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 13.6 t-20 -133.84 74.97 1.57 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.399 175.572 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 856' ' ' ASP . . . . . 0.668 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 4.1 t70 165.53 170.44 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.118 -0.946 . . . . 0.0 108.836 -178.302 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -92.73 -47.29 3.22 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.865 -0.683 . . . . 0.0 111.922 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 858' ' ' VAL . . . . . 0.424 HG22 ' H ' ' A' ' 858' ' ' VAL . 0.0 OUTLIER -71.67 -31.1 40.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.984 0.421 . . . . 0.0 110.661 -178.955 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 859' ' ' ASP . . . . . 0.668 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 0.3 OUTLIER -64.23 -35.4 80.68 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.007 -179.53 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -68.34 -33.64 74.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.181 0.515 . . . . 0.0 110.49 178.65 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 861' ' ' LEU . . . . . 0.595 HD21 ' HG ' ' A' ' 893' ' ' LEU . 15.3 tp -73.59 -32.37 64.07 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.596 179.056 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 -62.82 -47.12 84.8 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.816 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.81 -31.27 50.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 C-N-CA 120.861 -0.336 . . . . 0.0 110.61 177.915 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 864' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.84 -34.84 75.19 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 120.704 0.288 . . . . 0.0 111.138 179.118 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.89 -33.41 34.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.929 0.395 . . . . 0.0 110.482 179.426 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.14 -46.15 78.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.525 179.613 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -144.39 129.33 18.45 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 176.855 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 10.0 t-80 -70.7 88.36 0.71 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.8 0.333 . . . . 0.0 111.291 -177.335 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 869' ' ' ILE . . . . . 0.661 HG21 ' HB2' ' A' ' 828' ' ' LEU . 1.4 mp -65.43 139.91 20.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.524 174.101 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 35.6 m-20 -73.91 -60.34 2.3 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.066 -172.711 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 871' ' ' ILE . . . . . 0.533 HD12 ' HB3' ' A' ' 939' ' ' TYR . 8.0 mm -117.43 128.61 74.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.223 -178.482 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 872' ' ' VAL . . . . . 0.401 HG22 ' HB2' ' A' ' 828' ' ' LEU . 48.1 t -115.33 125.72 72.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.34 179.324 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 873' ' ' LEU . . . . . 0.665 HD22 HD12 ' A' ' 900' ' ' ILE . 0.1 OUTLIER -109.13 121.73 45.77 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 178.956 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -106.78 96.49 6.48 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.033 178.202 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 875' ' ' ASP . . . . . 0.581 ' HA ' HG13 ' A' ' 902' ' ' VAL . 22.1 t0 -97.89 110.29 22.89 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.719 179.388 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -121.89 132.1 71.64 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.41 -173.591 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -99.52 12.2 37.09 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.773 0.797 . . . . 0.0 108.879 171.421 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 878' ' ' MET . . . . . 0.5 ' HA ' ' HD3' ' A' ' 879' ' ' PRO . 6.0 ttm -68.51 137.68 91.0 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 114.68 -1.146 . . . . 0.0 110.27 179.228 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 879' ' ' PRO . . . . . 0.5 ' HD3' ' HA ' ' A' ' 878' ' ' MET . 10.2 Cg_exo -73.07 -140.35 0.02 OUTLIER 'Trans proline' 0 CA--C 1.534 0.525 0 C-N-CA 122.85 2.367 . . . . 0.0 112.822 178.405 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -85.17 159.01 20.22 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.521 -173.744 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 3.3 tpt 83.98 -54.58 0.13 Allowed 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.229 1.011 . . . . 0.0 112.702 170.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 14.6 t0 -87.73 137.24 32.51 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.877 0.37 . . . . 0.0 110.952 -175.553 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . 122.44 -7.78 9.67 Favored Glycine 0 N--CA 1.447 -0.603 0 N-CA-C 111.368 -0.693 . . . . 0.0 111.368 -176.486 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -84.43 -32.43 24.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.519 0.676 . . . . 0.0 109.425 -178.246 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.55 -32.77 63.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.796 178.019 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 4.1 tp -67.06 -51.52 53.56 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.753 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -45.26 92.79 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.213 -178.557 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 888' ' ' GLN . . . . . 0.558 ' HA ' ' HD3' ' A' ' 891' ' ' ARG . 7.7 tp-100 -56.98 -42.6 80.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.164 0.506 . . . . 0.0 110.737 178.609 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.97 -38.65 66.62 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.077 -178.613 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 890' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -69.98 -37.13 71.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.726 0.298 . . . . 0.0 111.203 -176.682 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 891' ' ' ARG . . . . . 0.558 ' HD3' ' HA ' ' A' ' 888' ' ' GLN . 1.9 ptm180 -74.15 -28.7 61.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.824 0.345 . . . . 0.0 110.613 178.005 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -78.07 -27.99 48.74 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.075 0.464 . . . . 0.0 110.752 178.852 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 893' ' ' LEU . . . . . 0.595 ' HG ' HD21 ' A' ' 861' ' ' LEU . 1.8 mm? -80.59 -11.34 59.66 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.239 179.448 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 86.28 56.93 2.19 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.294 178.271 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 895' ' ' LEU . . . . . 0.512 ' O ' ' HG ' ' A' ' 895' ' ' LEU . 0.2 OUTLIER -57.72 135.16 56.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.111 0.481 . . . . 0.0 110.577 178.471 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -141.01 49.47 1.66 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.305 0.574 . . . . 0.0 110.637 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 897' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -157.79 151.73 19.74 Favored Pre-proline 0 C--N 1.32 -0.698 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.704 -177.274 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_exo -73.18 112.93 3.64 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 122.454 2.103 . . . . 0.0 111.496 177.821 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 899' ' ' VAL . . . . . 0.791 HG13 ' HA ' ' A' ' 919' ' ' MET . 0.2 OUTLIER -115.41 130.79 69.4 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 CA-C-O 121.5 0.667 . . . . 0.0 110.126 176.746 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 900' ' ' ILE . . . . . 0.665 HD12 HD22 ' A' ' 873' ' ' LEU . 21.2 mt -96.34 117.0 39.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.719 -176.145 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 901' ' ' GLY . . . . . 0.554 ' HA3' ' HD3' ' A' ' 913' ' ' ARG . . . -92.7 105.82 3.34 Favored Glycine 0 N--CA 1.444 -0.811 0 C-N-CA 120.621 -0.799 . . . . 0.0 111.989 177.785 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 902' ' ' VAL . . . . . 0.836 ' HB ' HD12 ' A' ' 923' ' ' LEU . 0.1 OUTLIER -113.83 126.18 71.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 177.49 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 903' ' ' THR . . . . . 0.442 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.4 OUTLIER -143.87 165.23 28.3 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.679 -0.237 . . . . 0.0 110.398 -175.026 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 904' ' ' ALA . . . . . 0.417 ' HB2' ' CB ' ' A' ' 925' ' ' LYS . . . -119.44 103.12 9.17 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.968 0.414 . . . . 0.0 111.722 -178.464 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 52.22 56.23 8.03 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.064 -0.971 . . . . 0.0 112.856 171.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 906' ' ' ALA . . . . . 0.76 ' HB3' ' HB3' ' A' ' 909' ' ' GLU . . . -95.75 46.91 1.1 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.073 0.463 . . . . 0.0 110.123 174.676 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 907' ' ' LEU . . . . . 0.492 ' HB3' ' H ' ' A' ' 908' ' ' ALA . 0.1 OUTLIER 64.94 -108.71 0.18 Allowed 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.115 -178.998 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 908' ' ' ALA . . . . . 0.492 ' H ' ' HB3' ' A' ' 907' ' ' LEU . . . -98.53 33.56 2.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.96 0.409 . . . . 0.0 110.682 -177.829 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 909' ' ' GLU . . . . . 0.76 ' HB3' ' HB3' ' A' ' 906' ' ' ALA . 0.0 OUTLIER -52.1 -47.15 65.39 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.42 -0.809 . . . . 0.0 112.314 -176.625 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 910' ' ' GLU . . . . . 0.68 ' HA ' ' NH1' ' A' ' 913' ' ' ARG . 1.5 pt-20 -64.82 -37.46 87.68 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.978 -176.668 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.39 -42.34 71.84 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.872 0.368 . . . . 0.0 110.269 178.773 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -61.81 -40.59 95.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.706 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 913' ' ' ARG . . . . . 0.87 ' HD2' ' HB2' ' A' ' 922' ' ' CYS . 3.0 mtm105 -59.81 -45.54 92.03 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.756 178.128 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 80.7 m -64.73 -44.9 88.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.6 178.799 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.83 -43.51 94.54 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.308 -179.535 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.52 -43.21 81.37 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.569 179.536 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 51.67 33.84 11.67 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.139 -175.687 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -106.08 24.66 25.92 Favored Glycine 0 N--CA 1.447 -0.568 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.715 178.397 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 919' ' ' MET . . . . . 0.791 ' HA ' HG13 ' A' ' 899' ' ' VAL . 2.1 mtt -132.2 -94.89 0.35 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 110.328 -0.249 . . . . 0.0 110.328 -177.923 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 920' ' ' ASP . . . . . 0.427 ' H ' ' HB3' ' A' ' 919' ' ' MET . 9.6 t70 166.36 -64.77 0.0 OUTLIER 'General case' 0 CA--C 1.518 -0.279 0 O-C-N 124.205 0.941 . . . . 0.0 109.175 175.433 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 921' ' ' SER . . . . . 0.599 ' HB2' HG23 ' A' ' 900' ' ' ILE . 0.0 OUTLIER -115.08 165.81 12.5 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.799 -177.459 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 922' ' ' CYS . . . . . 0.87 ' HB2' ' HD2' ' A' ' 913' ' ' ARG . 0.0 OUTLIER -147.37 135.12 21.11 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.332 -179.683 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 923' ' ' LEU . . . . . 0.836 HD12 ' HB ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -155.98 -175.8 5.62 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 178.37 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 924' ' ' SER . . . . . 0.716 ' HB2' ' HD2' ' A' ' 926' ' ' PRO . 0.0 OUTLIER -106.29 154.68 20.41 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.916 -178.839 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 925' ' ' LYS . . . . . 0.45 ' HB3' ' HD3' ' A' ' 926' ' ' PRO . 8.4 tttp -52.92 -43.33 93.86 Favored Pre-proline 0 N--CA 1.47 0.531 0 N-CA-C 112.762 0.652 . . . . 0.0 112.762 179.4 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 926' ' ' PRO . . . . . 0.716 ' HD2' ' HB2' ' A' ' 924' ' ' SER . 23.2 Cg_exo -66.5 75.33 0.38 Allowed 'Trans proline' 0 C--N 1.357 0.997 0 C-N-CA 121.983 1.788 . . . . 0.0 111.798 172.474 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -107.09 152.98 8.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.188 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 928' ' ' THR . . . . . 0.408 ' O ' HG22 ' A' ' 932' ' ' ILE . 0.0 OUTLIER -95.06 149.56 21.13 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.913 179.854 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 929' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.93 -37.78 69.4 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.652 -179.029 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.92 -27.21 65.55 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.82 -178.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 931' ' ' VAL . . . . . 0.523 ' O ' ' HG2' ' A' ' 934' ' ' GLN . 93.2 t -75.94 -51.34 20.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.863 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 932' ' ' ILE . . . . . 0.408 HG22 ' O ' ' A' ' 928' ' ' THR . 0.0 OUTLIER -58.52 -37.06 62.4 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-O 121.056 0.455 . . . . 0.0 109.826 178.403 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 933' ' ' LYS . . . . . 0.611 ' HG2' HD21 ' A' ' 847' ' ' LEU . 0.0 OUTLIER -65.37 -47.43 76.43 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.288 -179.978 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 934' ' ' GLN . . . . . 0.554 ' O ' ' HB2' ' A' ' 938' ' ' LEU . 10.2 pt20 -63.72 -41.96 98.0 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.406 -177.049 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 1.3 m -69.44 -39.33 77.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.612 0.244 . . . . 0.0 110.732 -179.449 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 936' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.89 -54.8 29.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.618 179.595 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 74.6 m -60.6 -41.86 95.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.575 -179.076 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 938' ' ' LEU . . . . . 0.554 ' HB2' ' O ' ' A' ' 934' ' ' GLN . 0.1 OUTLIER -68.01 -40.16 83.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.732 0.301 . . . . 0.0 111.416 -178.156 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 939' ' ' TYR . . . . . 0.579 ' HA ' ' HB3' ' A' ' 942' ' ' ARG . 1.6 m-85 -77.19 -27.21 53.5 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.93 -0.308 . . . . 0.0 111.101 -178.087 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -64.28 -43.61 94.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.007 0.432 . . . . 0.0 110.254 174.828 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 941' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -73.73 -21.99 60.04 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.333 177.575 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 942' ' ' ARG . . . . . 0.579 ' HB3' ' HA ' ' A' ' 939' ' ' TYR . 0.0 OUTLIER -67.57 -47.55 69.46 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.266 177.234 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 943' ' ' VAL . . . . . 0.402 ' N ' ' HG3' ' A' ' 942' ' ' ARG . 10.1 m -74.11 -33.07 34.45 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 CA-C-O 120.946 0.403 . . . . 0.0 110.155 178.854 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 19.1 ttt85 -58.56 -48.1 82.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.517 176.472 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.03 -19.33 60.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.199 -179.873 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 71.4 m -71.9 -21.95 61.56 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.09 0.472 . . . . 0.0 109.903 175.722 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.63 -30.21 14.45 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.311 174.489 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -78.78 -46.09 19.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.027 -175.787 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.006 0 CA-C-O 118.289 -0.863 . . . . 0.0 110.448 -176.26 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 4.3 ttp . . . . . 0 N--CA 1.479 1.024 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 110.6 34.09 2.33 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.507 -0.854 . . . . 0.0 111.671 179.119 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . -138.27 129.16 4.45 Favored Glycine 0 N--CA 1.445 -0.758 0 N-CA-C 111.408 -0.677 . . . . 0.0 111.408 178.703 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -142.03 105.89 4.72 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.848 0.356 . . . . 0.0 110.298 -179.61 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . -80.93 68.28 3.44 Favored Glycine 0 N--CA 1.448 -0.516 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.618 -179.203 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -87.67 87.46 2.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 120.872 0.367 . . . . 0.0 110.037 177.469 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -124.08 134.7 53.33 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.635 -179.4 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . 138.1 -54.81 0.69 Allowed Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 121.051 -0.595 . . . . 0.0 112.107 178.237 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 8.3 mt -125.76 -158.91 0.87 Allowed 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 705' ' ' SER . . . . . 0.55 ' HA ' ' O ' ' A' ' 730' ' ' GLY . 1.5 m 55.25 72.88 0.45 Allowed 'General case' 0 CA--C 1.531 0.234 0 O-C-N 123.722 0.639 . . . . 0.0 111.495 177.746 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 170.49 -23.98 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.345 -0.931 . . . . 0.0 112.597 -178.05 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 1.4 mptt -75.16 135.75 41.08 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 -179.778 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 708' ' ' ARG . . . . . 0.654 ' HG2' HG23 ' A' ' 732' ' ' VAL . 0.0 OUTLIER -100.24 155.13 17.94 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.054 0.454 . . . . 0.0 111.612 -174.445 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 709' ' ' CYS . . . . . 0.455 ' SG ' HD13 ' A' ' 726' ' ' LEU . 0.0 OUTLIER -136.47 127.17 27.21 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.812 176.698 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 710' ' ' TRP . . . . . 0.652 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 90.2 m95 -107.07 117.45 34.09 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 177.113 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 711' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -120.27 123.02 42.17 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.233 0.54 . . . . 0.0 111.191 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -121.27 68.92 0.9 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.368 176.595 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 713' ' ' VAL . . . . . 0.618 HG11 ' HB3' ' A' ' 718' ' ' LEU . 55.3 t -117.84 127.98 75.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.182 -178.216 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 714' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 714' ' ' ARG . 3.3 mtt85 -73.53 -35.45 65.56 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.942 0.401 . . . . 0.0 110.667 178.757 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 41.2 t-20 -63.36 112.53 2.76 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.375 177.252 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 716' ' ' ALA . . . . . 0.65 ' O ' ' HB2' ' A' ' 720' ' ' GLN . . . -66.71 -38.1 86.04 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.328 -175.006 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.83 -38.28 83.02 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.935 0.398 . . . . 0.0 110.092 178.662 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 718' ' ' LEU . . . . . 0.646 HD21 ' HD2' ' A' ' 765' ' ' PHE . 0.9 OUTLIER -67.95 -50.22 57.14 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.663 179.908 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 719' ' ' CYS . . . . . 0.581 ' HB3' ' HB ' ' A' ' 713' ' ' VAL . 21.8 p -67.35 -38.46 84.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.65 -177.887 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 720' ' ' GLN . . . . . 0.702 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -63.96 -39.14 93.46 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.176 177.574 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -57.3 -55.17 38.23 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.704 -179.588 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.87 -48.35 77.04 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.952 -179.42 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 723' ' ' GLU . . . . . 0.8 ' HA ' HG11 ' A' ' 733' ' ' VAL . 2.9 pt-20 -60.39 -43.41 96.68 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.67 -174.154 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 724' ' ' THR . . . . . 0.556 ' N ' ' HG3' ' A' ' 723' ' ' GLU . 14.6 m -71.8 -38.55 70.23 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.841 0.353 . . . . 0.0 111.166 -177.846 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 725' ' ' SER . . . . . 0.425 ' O ' ' HG2' ' A' ' 728' ' ' ARG . 37.5 m -69.03 -36.42 77.73 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.877 0.37 . . . . 0.0 111.299 -179.083 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 726' ' ' LEU . . . . . 0.48 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 11.1 mt -82.06 -42.86 18.66 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.869 -176.655 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 727' ' ' GLN . . . . . 0.433 ' HA ' ' O ' ' A' ' 731' ' ' ILE . 8.5 pt20 -62.43 -29.76 70.74 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.57 0.224 . . . . 0.0 111.392 -176.387 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 728' ' ' ARG . . . . . 0.425 ' HG2' ' O ' ' A' ' 725' ' ' SER . 11.7 ptt180 -69.51 -17.83 63.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.956 0.408 . . . . 0.0 111.128 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 1.4 m -99.35 -1.82 37.87 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.094 -178.123 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 730' ' ' GLY . . . . . 0.55 ' O ' ' HA ' ' A' ' 705' ' ' SER . . . 100.31 14.68 32.34 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.35 -0.929 . . . . 0.0 112.578 179.237 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 731' ' ' ILE . . . . . 0.48 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 32.0 mm -90.57 129.07 41.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 176.438 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 732' ' ' VAL . . . . . 0.654 HG23 ' HG2' ' A' ' 708' ' ' ARG . 0.2 OUTLIER -85.78 94.33 4.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 121.981 0.896 . . . . 0.0 110.428 -178.784 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 733' ' ' VAL . . . . . 0.8 HG11 ' HA ' ' A' ' 723' ' ' GLU . 0.1 OUTLIER -83.22 122.8 38.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 114.595 -1.184 . . . . 0.0 111.08 -177.398 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.66 147.91 52.39 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.717 -179.66 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 3.9 m -77.46 119.27 20.82 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.032 0.444 . . . . 0.0 110.766 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 736' ' ' TYR . . . . . 0.652 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 86.0 t80 -81.84 114.58 20.55 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.616 -178.551 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -109.33 -42.59 4.33 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.075 177.313 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 176.97 47.76 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.432 0 N-CA-C 111.208 -0.757 . . . . 0.0 111.208 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 13.3 mp0 -91.79 -176.31 4.42 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.528 -0.336 . . . . 0.0 110.863 -174.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 740' ' ' GLU . . . . . 0.504 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 0.0 OUTLIER -97.78 131.77 26.21 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.455 179.897 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 741' ' ' PRO . . . . . 0.677 ' HG2' ' HB2' ' A' ' 758' ' ' GLN . 6.5 Cg_endo -87.25 127.54 2.49 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 123.348 2.699 . . . . 0.0 113.313 -175.519 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 742' ' ' THR . . . . . 0.817 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.2 OUTLIER -90.92 148.59 38.5 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 172.392 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 743' ' ' PRO . . . . . 0.817 ' HD2' HG22 ' A' ' 742' ' ' THR . 23.8 Cg_endo -61.77 5.01 0.23 Allowed 'Trans proline' 0 N--CA 1.48 0.687 0 C-N-CA 123.208 2.605 . . . . 0.0 113.931 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 744' ' ' GLU . . . . . 0.407 ' HA ' ' HB2' ' A' ' 760' ' ' ARG . 2.1 mt-10 -118.03 -2.57 11.23 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.772 0.32 . . . . 0.0 110.424 175.595 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 745' ' ' ASP . . . . . 0.451 ' HB3' ' HD1' ' A' ' 710' ' ' TRP . 87.1 m-20 -89.38 149.09 23.15 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.746 -176.149 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 746' ' ' VAL . . . . . 0.529 HG11 HD11 ' A' ' 795' ' ' LEU . 2.8 p -120.51 137.25 54.92 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.3 178.458 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 747' ' ' LEU . . . . . 0.414 ' HG ' ' CZ3' ' A' ' 757' ' ' TRP . 0.0 OUTLIER -106.01 100.01 9.57 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.874 0.369 . . . . 0.0 110.903 -179.748 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 12.0 mt -93.78 106.83 18.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 173.783 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 749' ' ' THR . . . . . 0.654 HG21 ' HB ' ' A' ' 753' ' ' VAL . 6.0 t -128.98 160.38 32.9 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 110.113 -0.328 . . . . 0.0 110.113 -177.275 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 750' ' ' ASP . . . . . 0.584 ' HB3' HG13 ' A' ' 713' ' ' VAL . 1.5 p-10 -105.51 145.86 30.34 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.02 0.438 . . . . 0.0 111.171 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 751' ' ' GLU . . . . . 0.509 ' HA ' ' HA ' ' A' ' 766' ' ' CYS . 22.5 mm-40 63.91 -157.06 0.31 Allowed 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.366 -178.656 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 752' ' ' VAL . . . . . 0.578 HG22 ' H ' ' A' ' 771' ' ' GLY . 62.1 t -75.68 127.16 37.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 120.992 0.425 . . . . 0.0 111.287 -176.295 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 753' ' ' VAL . . . . . 0.654 ' HB ' HG21 ' A' ' 749' ' ' THR . 8.6 p -102.12 142.74 15.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.823 175.437 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -94.37 39.84 1.09 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.906 0.384 . . . . 0.0 111.236 -178.266 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.02 148.24 18.67 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.223 178.684 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 6.4 mmtm -97.2 10.51 39.26 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.826 179.092 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 757' ' ' TRP . . . . . 0.597 ' CH2' ' HB3' ' A' ' 741' ' ' PRO . 4.5 t-105 69.61 153.96 0.11 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.419 -0.81 . . . . 0.0 112.123 177.255 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 758' ' ' GLN . . . . . 0.677 ' HB2' ' HG2' ' A' ' 741' ' ' PRO . 4.9 mp0 -135.22 47.96 2.29 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.797 178.249 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 759' ' ' GLY . . . . . 0.55 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -146.1 -140.86 3.54 Favored Glycine 0 N--CA 1.443 -0.87 0 C-N-CA 120.409 -0.901 . . . . 0.0 113.1 -175.481 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 760' ' ' ARG . . . . . 0.407 ' HB2' ' HA ' ' A' ' 744' ' ' GLU . 0.2 OUTLIER -74.31 -59.97 2.48 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 111.597 0.221 . . . . 0.0 111.597 -178.226 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 761' ' ' ALA . . . . . 0.47 ' O ' ' HA ' ' A' ' 746' ' ' VAL . . . -156.99 157.85 35.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.738 -176.235 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 3.2 p -126.59 131.81 70.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.139 177.643 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 763' ' ' VAL . . . . . 0.577 HG11 HD11 ' A' ' 791' ' ' LEU . 92.2 t -111.37 96.66 4.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 178.487 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 764' ' ' THR . . . . . 0.763 HG21 HG13 ' A' ' 772' ' ' ILE . 0.2 OUTLIER -86.39 92.67 8.9 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.083 -178.593 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 765' ' ' PHE . . . . . 0.741 ' CZ ' ' HG ' ' A' ' 791' ' ' LEU . 0.2 OUTLIER -84.23 83.63 7.9 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.207 179.085 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 766' ' ' CYS . . . . . 0.54 ' HB2' HG12 ' A' ' 770' ' ' ILE . 0.0 OUTLIER -94.54 132.85 38.8 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 -175.049 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 5.1 mmm-85 -88.86 -56.15 3.41 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.913 -171.348 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.28 -34.16 2.96 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.271 -176.33 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -108.75 106.59 16.68 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.291 0.567 . . . . 0.0 110.402 -179.425 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 770' ' ' ILE . . . . . 0.54 HG12 ' HB2' ' A' ' 766' ' ' CYS . 24.2 mt -107.26 87.39 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.467 178.377 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 771' ' ' GLY . . . . . 0.578 ' H ' HG22 ' A' ' 752' ' ' VAL . . . -95.28 6.71 68.78 Favored Glycine 0 N--CA 1.454 -0.156 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.693 177.873 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 772' ' ' ILE . . . . . 0.763 HG13 HG21 ' A' ' 764' ' ' THR . 41.9 mm -104.06 141.79 23.26 Favored Pre-proline 0 C--N 1.32 -0.686 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 178.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 773' ' ' PRO . . . . . 0.668 ' O ' ' HB3' ' A' ' 774' ' ' LEU . 50.7 Cg_exo -53.39 -96.83 0.0 OUTLIER 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 123.135 2.557 . . . . 0.0 113.37 178.657 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 774' ' ' LEU . . . . . 0.698 ' HA ' HG13 ' A' ' 782' ' ' VAL . 0.3 OUTLIER 153.05 -161.85 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.462 1.105 . . . . 0.0 109.477 -177.365 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 775' ' ' GLU . . . . . 0.486 ' HA ' ' O ' ' A' ' 780' ' ' GLU . 0.8 OUTLIER -62.65 54.05 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.911 0.884 . . . . 0.0 113.335 177.266 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 776' ' ' LYS . . . . . 0.569 ' HD3' ' HB3' ' A' ' 773' ' ' PRO . 0.1 OUTLIER -118.75 0.41 11.44 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 170.122 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 777' ' ' ALA . . . . . 0.419 ' HB3' ' HB2' ' A' ' 780' ' ' GLU . . . -126.93 150.87 72.96 Favored Pre-proline 0 C--N 1.324 -0.526 0 CA-C-N 114.615 -1.175 . . . . 0.0 109.114 176.123 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_endo -62.14 100.32 0.21 Allowed 'Trans proline' 0 CA--C 1.529 0.232 0 C-N-CA 122.617 2.212 . . . . 0.0 112.626 -178.658 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 96.48 20.11 25.78 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.832 -0.699 . . . . 0.0 113.004 177.475 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 780' ' ' GLU . . . . . 0.486 ' O ' ' HA ' ' A' ' 775' ' ' GLU . 0.1 OUTLIER -109.59 125.06 52.16 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 179.808 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 35.5 m95 -142.66 106.78 4.73 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.853 -0.158 . . . . 0.0 111.152 -175.563 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 782' ' ' VAL . . . . . 0.698 HG13 ' HA ' ' A' ' 774' ' ' LEU . 3.6 m -102.19 156.43 4.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 C-N-CA 120.781 -0.367 . . . . 0.0 110.156 175.19 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 783' ' ' HIS . . . . . 0.43 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.1 OUTLIER -176.36 150.16 0.88 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.61 177.415 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 3.1 m -104.96 100.21 9.82 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.935 0.397 . . . . 0.0 110.533 173.586 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 785' ' ' VAL . . . . . 0.415 HG23 ' CE1' ' A' ' 765' ' ' PHE . 0.1 OUTLIER -159.45 164.55 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 178.239 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -103.56 40.36 1.43 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.997 179.094 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 49.39 64.09 9.18 Favored Pre-proline 0 N--CA 1.469 0.487 0 CA-C-N 115.26 -0.882 . . . . 0.0 112.705 177.379 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 788' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -68.59 -70.37 0.02 OUTLIER 'Trans proline' 0 CA--C 1.533 0.455 0 C-N-CA 122.254 1.969 . . . . 0.0 112.545 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 2.2 p-80 -153.32 -30.82 0.13 Allowed 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -178.487 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 790' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -71.18 -34.28 70.77 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 111.747 0.277 . . . . 0.0 111.747 -174.258 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 791' ' ' LEU . . . . . 0.741 ' HG ' ' CZ ' ' A' ' 765' ' ' PHE . 0.7 OUTLIER -65.46 -55.62 23.68 Favored Pre-proline 0 C--N 1.327 -0.382 0 C-N-CA 120.986 -0.286 . . . . 0.0 111.272 -178.922 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 792' ' ' PRO . . . . . 0.404 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 11.7 Cg_endo -58.55 -26.71 79.79 Favored 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 121.585 1.523 . . . . 0.0 111.871 175.955 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -68.09 -45.69 73.07 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.892 176.479 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 794' ' ' LEU . . . . . 0.506 HD22 ' HA ' ' A' ' 794' ' ' LEU . 0.2 OUTLIER -65.63 -36.89 85.0 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 176.797 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 795' ' ' LEU . . . . . 0.529 HD11 HG11 ' A' ' 746' ' ' VAL . 0.6 OUTLIER -63.04 -44.26 96.36 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.865 179.158 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -63.69 -31.73 72.99 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.148 0.499 . . . . 0.0 110.727 177.053 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.24 -47.18 65.46 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.674 178.69 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 798' ' ' ILE . . . . . 0.437 HG22 ' O ' ' A' ' 795' ' ' LEU . 0.9 OUTLIER -70.1 -16.94 20.58 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.589 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.308 -177.562 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 799' ' ' TYR . . . . . 0.43 ' HD1' ' HA ' ' A' ' 799' ' ' TYR . 2.4 m-30 -78.53 -8.32 58.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.282 175.188 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 34.1 mt 62.17 49.3 4.47 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.532 177.206 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 801' ' ' ILE . . . . . . . . . . . . . 93.6 mt -74.62 -39.49 46.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.236 176.413 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 50.67 70.01 0.57 Allowed 'General case' 0 C--O 1.234 0.264 0 O-C-N 123.943 0.777 . . . . 0.0 110.892 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 803' ' ' MET . . . . . . . . . . . . . 1.8 ttp -82.42 -37.84 24.92 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.385 -174.708 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 804' ' ' GLU . . . . . 0.531 ' H ' ' HG3' ' A' ' 804' ' ' GLU . 0.0 OUTLIER -75.44 99.41 4.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.795 0.331 . . . . 0.0 110.862 -177.499 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -97.01 162.75 13.25 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.172 -179.043 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -146.1 91.25 2.05 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.094 177.423 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 807' ' ' ASP . . . . . 0.433 ' HA ' ' HD3' ' A' ' 808' ' ' PRO . 0.7 OUTLIER -60.25 122.21 65.23 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.001 179.346 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 808' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 807' ' ' ASP . 4.7 Cg_exo -77.38 -170.33 0.91 Allowed 'Trans proline' 0 N--CA 1.462 -0.358 0 C-N-CA 123.281 2.654 . . . . 0.0 112.473 -178.269 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -109.73 163.45 13.48 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.915 177.246 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 17.2 t30 -118.69 128.84 54.89 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.156 0.503 . . . . 0.0 111.04 -178.757 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -141.14 105.77 4.89 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.169 179.206 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 812' ' ' LEU . . . . . 0.457 ' HA ' ' HD3' ' A' ' 813' ' ' PRO . 2.9 tp -88.71 137.56 30.11 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.892 -177.321 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 813' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 812' ' ' LEU . 14.2 Cg_exo -70.07 152.53 67.73 Favored 'Trans proline' 0 N--CA 1.461 -0.428 0 C-N-CA 122.847 2.365 . . . . 0.0 111.96 176.18 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 54.8 m -137.02 138.93 41.0 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 174.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.23 93.97 4.07 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.782 -175.399 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -119.08 120.03 35.95 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.314 -177.039 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 2.0 ttmt -172.57 116.02 0.31 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.952 176.173 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -140.07 146.52 39.05 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.861 0.363 . . . . 0.0 111.516 -178.086 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 2.6 p -175.07 115.5 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.679 -0.692 . . . . 0.0 109.424 176.135 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 1.2 m -151.09 147.78 27.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.702 0.287 . . . . 0.0 111.513 -175.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 29.1 t70 74.23 137.56 0.06 Allowed 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.07 -0.968 . . . . 0.0 112.716 171.765 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 822' ' ' ASN . . . . . 0.408 ' O ' ' HB3' ' A' ' 823' ' ' ASP . 21.7 t30 -159.83 -43.05 0.05 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.878 173.555 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 823' ' ' ASP . . . . . 0.408 ' HB3' ' O ' ' A' ' 822' ' ' ASN . 14.4 t0 70.82 111.34 0.06 Allowed 'General case' 0 N--CA 1.467 0.387 0 O-C-N 123.939 0.775 . . . . 0.0 111.061 -179.397 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -112.55 62.49 0.63 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.513 -175.288 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 825' ' ' MET . . . . . 0.524 ' O ' ' HB3' ' A' ' 849' ' ' TYR . 0.5 OUTLIER -92.29 127.76 37.89 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 -178.501 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 826' ' ' MET . . . . . 0.6 ' HG3' ' HA ' ' A' ' 869' ' ' ILE . 5.0 ptp -125.61 131.02 52.76 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.121 0.486 . . . . 0.0 111.383 -176.763 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 827' ' ' ILE . . . . . . . . . . . . . 10.3 mm -120.71 128.91 76.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.075 176.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 828' ' ' LEU . . . . . 0.7 ' HB3' HD13 ' A' ' 869' ' ' ILE . 0.1 OUTLIER -106.36 134.75 49.01 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.259 0.552 . . . . 0.0 110.768 -178.063 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 829' ' ' VAL . . . . . 0.413 HG23 ' HA ' ' A' ' 853' ' ' THR . 0.0 OUTLIER -112.33 111.73 37.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.509 -177.373 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 830' ' ' VAL . . . . . 0.619 ' HA ' ' O ' ' A' ' 854' ' ' ALA . 48.7 t -112.17 100.59 11.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.316 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 831' ' ' ASP . . . . . 0.746 ' HB2' ' HB3' ' A' ' 875' ' ' ASP . 0.1 OUTLIER -121.26 137.55 54.64 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.935 0.398 . . . . 0.0 110.505 -178.27 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 832' ' ' ASP . . . . . 0.462 ' O ' ' HD3' ' A' ' 834' ' ' PRO . 7.2 t70 -74.24 -37.7 63.73 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.854 -176.181 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -108.49 93.1 11.04 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.28 -174.531 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 834' ' ' PRO . . . . . 0.462 ' HD3' ' O ' ' A' ' 832' ' ' ASP . 98.1 Cg_exo -45.62 -25.34 2.33 Favored 'Trans proline' 0 N--CA 1.482 0.849 0 C-N-CA 125.14 3.893 . . . . 0.0 116.374 -164.0 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 1.2 pp -58.25 -40.49 77.87 Favored 'Isoleucine or valine' 0 C--O 1.239 0.524 0 CA-C-O 121.242 0.544 . . . . 0.0 110.758 179.524 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 836' ' ' ASN . . . . . 0.529 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 2.2 t30 -74.53 -39.82 62.12 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.903 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 837' ' ' ARG . . . . . 0.557 ' HB2' ' OD2' ' A' ' 831' ' ' ASP . 6.7 ttp-105 -53.43 -39.96 64.8 Favored 'General case' 0 CA--C 1.518 -0.281 0 O-C-N 123.338 0.399 . . . . 0.0 110.542 175.856 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 838' ' ' ARG . . . . . 0.433 HH11 ' HG2' ' A' ' 838' ' ' ARG . 0.0 OUTLIER -59.39 -44.0 92.84 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 176.297 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 839' ' ' LEU . . . . . 0.432 ' N ' ' HG3' ' A' ' 838' ' ' ARG . 0.7 OUTLIER -69.04 -45.22 70.98 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.971 -0.559 . . . . 0.0 112.098 -175.279 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 840' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 836' ' ' ASN . 0.0 OUTLIER -67.59 -37.37 82.47 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.183 177.629 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -67.22 -24.25 65.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.005 0.431 . . . . 0.0 110.444 178.517 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.08 -57.76 8.66 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.052 176.011 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 843' ' ' GLN . . . . . 1.03 ' HG2' HD23 ' A' ' 929' ' ' LEU . 4.4 mp0 -68.1 -42.03 80.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.095 -177.654 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 844' ' ' LEU . . . . . 0.434 ' HB2' ' O ' ' A' ' 840' ' ' LEU . 0.0 OUTLIER -66.04 -32.76 74.42 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.11 0.481 . . . . 0.0 110.743 179.263 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -65.46 -38.41 94.8 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.933 -0.651 . . . . 0.0 111.874 178.766 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -70.98 -44.38 66.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.618 0.247 . . . . 0.0 111.099 179.09 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -161.23 78.65 0.58 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.065 0.459 . . . . 0.0 111.39 178.971 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . -147.8 32.5 1.31 Allowed Glycine 0 N--CA 1.445 -0.753 0 C-N-CA 120.673 -0.775 . . . . 0.0 111.786 176.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 849' ' ' TYR . . . . . 0.524 ' HB3' ' O ' ' A' ' 825' ' ' MET . 70.0 m-85 62.89 -156.9 0.33 Allowed 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 -178.895 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -77.24 108.81 10.62 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.866 0.365 . . . . 0.0 110.298 179.211 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -96.6 134.3 40.0 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.256 -176.228 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.43 122.44 36.69 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.069 177.095 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 853' ' ' THR . . . . . 0.433 HG22 ' HG2' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -92.94 137.25 32.53 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -175.668 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 854' ' ' ALA . . . . . 0.619 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -150.65 161.66 42.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.952 176.258 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 855' ' ' ASN . . . . . 0.452 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 16.1 p-10 -147.29 74.83 1.35 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.271 0.558 . . . . 0.0 111.647 -179.813 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 856' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' A' ' 855' ' ' ASN . 7.3 t0 172.86 147.9 0.05 Allowed 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 114.999 -1.0 . . . . 0.0 109.613 175.127 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -74.06 -35.31 53.88 Favored Glycine 0 N--CA 1.443 -0.861 0 C-N-CA 120.949 -0.643 . . . . 0.0 111.685 179.515 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 858' ' ' VAL . . . . . 0.427 HG22 ' OD1' ' A' ' 856' ' ' ASP . 19.4 m -73.09 -31.37 34.77 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 CA-C-O 120.899 0.38 . . . . 0.0 110.645 -179.749 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 859' ' ' ASP . . . . . 0.41 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 2.2 t70 -70.55 -38.52 74.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.051 179.003 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 860' ' ' ALA . . . . . 0.615 ' O ' ' HG ' ' A' ' 864' ' ' LEU . . . -61.33 -42.44 98.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.12 176.278 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 861' ' ' LEU . . . . . 0.47 HD23 HD12 ' A' ' 864' ' ' LEU . 1.3 mt -60.13 -41.63 93.06 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.719 177.604 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -63.88 -39.89 95.25 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.793 179.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 863' ' ' VAL . . . . . 0.586 HG11 HD13 ' A' ' 828' ' ' LEU . 0.3 OUTLIER -66.14 -33.9 66.63 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.764 -177.997 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 864' ' ' LEU . . . . . 0.615 ' HG ' ' O ' ' A' ' 860' ' ' ALA . 4.9 mt -69.85 -35.06 74.43 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.048 0.451 . . . . 0.0 110.109 176.27 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 4.1 m -81.5 -6.63 59.15 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.074 -178.646 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 17.2 mtpt -99.99 -45.59 5.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.729 176.009 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 867' ' ' ASN . . . . . 0.433 ' HB3' ' H ' ' A' ' 868' ' ' HIS . 22.9 t-20 -124.68 -112.16 0.3 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.518 -178.66 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 868' ' ' HIS . . . . . 0.433 ' H ' ' HB3' ' A' ' 867' ' ' ASN . 11.5 t60 -161.68 -67.27 0.06 Allowed 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 179.237 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 869' ' ' ILE . . . . . 0.7 HD13 ' HB3' ' A' ' 828' ' ' LEU . 35.7 mt 66.07 147.42 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 O-C-N 123.846 0.716 . . . . 0.0 110.468 -175.828 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -96.69 -36.42 10.69 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.251 -0.58 . . . . 0.0 112.421 -171.495 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 871' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -136.51 133.88 49.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.908 0.385 . . . . 0.0 110.837 -178.366 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 872' ' ' VAL . . . . . 0.581 HG13 HD21 ' A' ' 828' ' ' LEU . 12.0 t -101.81 124.83 55.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.444 177.67 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 873' ' ' LEU . . . . . 0.492 HD11 HD11 ' A' ' 936' ' ' LEU . 45.5 mt -104.85 100.06 9.68 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 174.616 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -95.52 96.31 8.98 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.626 -178.252 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 875' ' ' ASP . . . . . 0.746 ' HB3' ' HB2' ' A' ' 831' ' ' ASP . 25.0 t0 -93.19 106.91 18.81 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.988 -177.842 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 876' ' ' VAL . . . . . 0.581 ' HB ' HG23 ' A' ' 903' ' ' THR . 21.6 t -108.61 135.77 46.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.091 -170.662 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 877' ' ' ASN . . . . . 0.843 ' HB2' ' HE3' ' A' ' 925' ' ' LYS . 10.9 t-20 -163.6 80.37 0.44 Allowed 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.7 176.205 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 878' ' ' MET . . . . . 0.463 ' HA ' ' HD3' ' A' ' 879' ' ' PRO . 0.0 OUTLIER -145.54 142.96 18.73 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.81 178.598 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 879' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' A' ' 878' ' ' MET . 3.0 Cg_exo -75.78 39.33 0.63 Allowed 'Trans proline' 0 CA--C 1.53 0.303 0 C-N-CA 123.273 2.649 . . . . 0.0 112.587 -178.414 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -145.42 127.54 15.65 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 -179.576 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.44 78.96 3.16 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.66 0.743 . . . . 0.0 111.421 -178.08 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -86.22 21.83 1.94 Allowed 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.264 175.069 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -75.63 49.7 2.42 Favored Glycine 0 C--N 1.331 0.292 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.58 177.633 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 884' ' ' TYR . . . . . 0.417 ' O ' ' HB2' ' A' ' 888' ' ' GLN . 54.6 t80 -158.99 -54.99 0.06 Allowed 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 -179.752 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 885' ' ' ARG . . . . . 0.742 ' O ' ' HB2' ' A' ' 889' ' ' ARG . 0.0 OUTLIER -58.39 -50.73 72.64 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.409 -179.486 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.43 -52.61 17.57 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.815 -176.435 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -60.87 -48.36 82.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 0.0 112.141 -174.878 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 888' ' ' GLN . . . . . 0.502 ' O ' ' HB2' ' A' ' 892' ' ' GLN . 3.8 mm-40 -68.68 -45.22 72.26 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.956 -0.297 . . . . 0.0 110.745 -178.124 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 889' ' ' ARG . . . . . 0.742 ' HB2' ' O ' ' A' ' 885' ' ' ARG . 0.0 OUTLIER -61.38 -48.09 82.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.595 0.236 . . . . 0.0 111.223 -177.724 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 890' ' ' ILE . . . . . 0.644 HG12 HD13 ' A' ' 895' ' ' LEU . 0.7 OUTLIER -62.71 -42.69 97.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.25 -175.94 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 891' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.45 -28.53 59.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.652 0.263 . . . . 0.0 111.04 -178.84 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 892' ' ' GLN . . . . . 0.502 ' HB2' ' O ' ' A' ' 888' ' ' GLN . 0.0 OUTLIER -70.15 -36.05 74.46 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.046 179.312 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -83.58 -3.58 57.81 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.889 -176.536 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 109.32 30.76 3.48 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.122 -1.037 . . . . 0.0 114.313 172.708 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 895' ' ' LEU . . . . . 0.644 HD13 HG12 ' A' ' 890' ' ' ILE . 0.2 OUTLIER -66.79 112.03 4.03 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 117.393 0.596 . . . . 0.0 109.524 172.837 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 8.4 t -130.16 59.67 1.63 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 122.08 0.943 . . . . 0.0 110.537 -177.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 897' ' ' LEU . . . . . 0.406 HD21 HD22 ' A' ' 864' ' ' LEU . 1.0 OUTLIER -156.07 151.73 22.18 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.655 178.454 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -58.03 116.39 3.2 Favored 'Trans proline' 0 C--O 1.235 0.327 0 C-N-CA 122.956 2.437 . . . . 0.0 113.117 -176.216 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 899' ' ' VAL . . . . . 0.509 HG13 ' HB ' ' A' ' 872' ' ' VAL . 16.2 t -103.38 124.91 57.89 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.634 177.037 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 900' ' ' ILE . . . . . 0.668 HG23 ' HB2' ' A' ' 921' ' ' SER . 8.7 mt -104.74 102.03 13.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 177.06 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 901' ' ' GLY . . . . . 0.489 ' O ' ' HA ' ' A' ' 922' ' ' CYS . . . -83.5 112.73 3.59 Favored Glycine 0 N--CA 1.444 -0.799 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.0 -178.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 902' ' ' VAL . . . . . 0.868 ' HB ' HD12 ' A' ' 923' ' ' LEU . 0.2 OUTLIER -104.23 114.55 44.15 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.915 0 N-CA-C 109.268 -0.642 . . . . 0.0 109.268 178.311 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 903' ' ' THR . . . . . 0.581 HG23 ' HB ' ' A' ' 876' ' ' VAL . 0.1 OUTLIER -119.86 152.76 36.84 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.546 -176.347 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -76.14 103.84 6.38 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.749 -179.213 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 57.88 79.07 0.21 Allowed 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.751 178.649 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 906' ' ' ALA . . . . . 0.497 ' HB3' ' HG3' ' A' ' 909' ' ' GLU . . . -85.16 -11.92 53.95 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.744 179.161 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 907' ' ' LEU . . . . . 0.417 ' HB2' ' O ' ' A' ' 906' ' ' ALA . 1.5 mt 73.86 -54.25 0.68 Allowed 'General case' 0 N--CA 1.471 0.599 0 O-C-N 124.048 0.842 . . . . 0.0 111.27 176.631 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -132.85 72.3 1.49 Allowed 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 177.006 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 909' ' ' GLU . . . . . 0.497 ' HG3' ' HB3' ' A' ' 906' ' ' ALA . 1.8 mp0 -46.61 -52.46 13.56 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.377 -0.828 . . . . 0.0 112.304 -176.028 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 910' ' ' GLU . . . . . 0.446 ' O ' ' HB3' ' A' ' 913' ' ' ARG . 1.0 OUTLIER -56.77 -46.44 81.49 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 120.946 0.403 . . . . 0.0 111.575 -179.136 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -66.53 -37.32 84.77 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.23 0.538 . . . . 0.0 110.692 -178.135 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -63.3 -31.29 72.4 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.039 177.23 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 913' ' ' ARG . . . . . 0.663 ' HB2' ' SG ' ' A' ' 922' ' ' CYS . 13.6 ttp180 -67.12 -38.88 86.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.444 177.536 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 13.3 m -63.45 -27.94 69.63 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.037 0.446 . . . . 0.0 110.32 176.831 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.02 -49.68 42.34 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.641 177.31 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 916' ' ' GLU . . . . . 0.445 ' HG3' ' H ' ' A' ' 916' ' ' GLU . 0.0 OUTLIER -74.18 -50.28 19.93 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 121.106 -0.237 . . . . 0.0 111.266 -176.535 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 50.38 40.95 24.03 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.802 -175.575 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -136.9 -29.38 0.3 Allowed Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.572 -0.823 . . . . 0.0 113.483 -176.837 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 919' ' ' MET . . . . . 0.584 ' O ' ' HB2' ' A' ' 920' ' ' ASP . 0.3 OUTLIER -84.23 -87.53 0.11 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 117.183 0.491 . . . . 0.0 110.826 -176.763 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 920' ' ' ASP . . . . . 0.584 ' HB2' ' O ' ' A' ' 919' ' ' MET . 25.6 t70 164.32 -53.15 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.533 0.733 . . . . 0.0 110.39 176.081 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 921' ' ' SER . . . . . 0.668 ' HB2' HG23 ' A' ' 900' ' ' ILE . 1.0 OUTLIER -134.81 171.06 14.91 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.871 179.819 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 922' ' ' CYS . . . . . 0.663 ' SG ' ' HB2' ' A' ' 913' ' ' ARG . 0.4 OUTLIER -149.59 145.43 26.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.815 0.34 . . . . 0.0 111.372 -178.213 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 923' ' ' LEU . . . . . 0.868 HD12 ' HB ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -145.82 -176.86 5.31 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.933 175.654 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 924' ' ' SER . . . . . 0.54 ' HB3' ' HD2' ' A' ' 926' ' ' PRO . 4.1 m -103.55 144.55 31.27 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.802 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 925' ' ' LYS . . . . . 0.843 ' HE3' ' HB2' ' A' ' 877' ' ' ASN . 12.9 tttm -54.44 -45.85 99.25 Favored Pre-proline 0 CA--C 1.539 0.547 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 -179.154 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 926' ' ' PRO . . . . . 0.54 ' HD2' ' HB3' ' A' ' 924' ' ' SER . 14.8 Cg_exo -69.93 71.96 1.57 Allowed 'Trans proline' 0 C--N 1.356 0.953 0 C-N-CA 121.851 1.701 . . . . 0.0 111.923 175.157 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 10.0 p -95.04 140.75 16.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.992 -178.655 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -92.56 159.56 15.43 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.857 179.182 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 929' ' ' LEU . . . . . 1.03 HD23 ' HG2' ' A' ' 843' ' ' GLN . 1.3 tm? -52.69 -43.26 65.48 Favored 'General case' 0 N--CA 1.464 0.271 0 O-C-N 123.468 0.48 . . . . 0.0 111.027 179.269 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.39 -37.71 88.47 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.97 0.414 . . . . 0.0 110.659 -177.282 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 44.2 t -75.6 -47.14 34.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.147 -176.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 932' ' ' ILE . . . . . 0.419 ' O ' ' HB2' ' A' ' 936' ' ' LEU . 0.0 OUTLIER -63.59 -40.1 87.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 121.148 -0.221 . . . . 0.0 110.702 -179.329 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 1.8 tmmt? -62.96 -48.47 78.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.066 0.46 . . . . 0.0 110.33 177.829 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -62.34 -49.35 75.92 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.379 -177.603 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 4.7 m -63.87 -44.8 92.0 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.386 -177.776 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 936' ' ' LEU . . . . . 0.492 HD11 HD11 ' A' ' 873' ' ' LEU . 0.1 OUTLIER -63.9 -47.64 79.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.558 -179.045 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 55.0 m -63.27 -45.95 89.09 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.308 -179.458 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 938' ' ' LEU . . . . . 0.473 ' O ' ' HB2' ' A' ' 942' ' ' ARG . 0.4 OUTLIER -64.01 -43.19 96.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.254 -178.372 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -73.89 -32.57 63.64 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 121.084 -0.246 . . . . 0.0 111.082 -177.304 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -69.54 -45.99 67.5 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.806 0.336 . . . . 0.0 110.678 177.653 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 941' ' ' GLU . . . . . 0.438 ' HA ' ' HB2' ' A' ' 944' ' ' ARG . 1.7 pt-20 -70.42 -23.78 62.8 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.833 0.349 . . . . 0.0 110.463 178.524 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 942' ' ' ARG . . . . . 0.473 ' HB2' ' O ' ' A' ' 938' ' ' LEU . 0.4 OUTLIER -66.13 -48.47 70.73 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.724 178.722 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 2.8 m -72.69 -30.44 33.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.046 0.45 . . . . 0.0 110.043 178.785 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 944' ' ' ARG . . . . . 0.438 ' HB2' ' HA ' ' A' ' 941' ' ' GLU . 0.9 OUTLIER -62.68 -48.74 77.96 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.981 177.37 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -74.48 -16.13 60.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.769 0.318 . . . . 0.0 111.26 -179.562 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 63.4 m -79.29 -26.78 42.26 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.15 0.5 . . . . 0.0 109.971 174.088 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 1.6 mpp_? -82.63 -38.49 23.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.647 175.729 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 948' ' ' ASP . . . . . 0.439 ' HB3' ' H ' ' A' ' 949' ' ' SER . 0.5 OUTLIER -96.12 -127.02 0.14 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.856 177.764 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 949' ' ' SER . . . . . 0.439 ' H ' ' HB3' ' A' ' 948' ' ' ASP . 2.3 m . . . . . 0 C--O 1.25 1.116 0 CA-C-O 118.89 -0.576 . . . . 0.0 109.983 176.528 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.928 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . -146.01 92.19 0.16 Allowed Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.996 -0.621 . . . . 0.0 111.679 -179.281 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . -94.2 82.54 0.97 Allowed Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.761 -0.733 . . . . 0.0 111.805 -177.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 5.8 m -147.34 101.65 3.4 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.055 0.455 . . . . 0.0 110.799 179.041 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . -142.25 50.02 0.73 Allowed Glycine 0 N--CA 1.445 -0.724 0 N-CA-C 110.763 -0.935 . . . . 0.0 110.763 175.628 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -142.1 135.52 28.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 120.939 0.399 . . . . 0.0 111.058 -176.028 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -83.62 80.1 9.23 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 173.68 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . -51.71 -46.12 54.34 Favored Glycine 0 C--N 1.332 0.333 0 CA-C-N 115.544 -0.753 . . . . 0.0 113.361 -175.364 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.656 HD22 HG12 ' A' ' 801' ' ' ILE . 1.7 pt? -151.73 -48.88 0.11 Allowed 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 121.291 -0.164 . . . . 0.0 110.581 179.69 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 705' ' ' SER . . . . . 0.581 ' N ' ' HG ' ' A' ' 704' ' ' LEU . 3.7 m 58.44 -177.45 0.08 Allowed 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.827 178.506 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 67.68 15.72 66.87 Favored Glycine 0 CA--C 1.52 0.346 0 CA-C-N 116.142 -0.481 . . . . 0.0 113.603 175.025 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 707' ' ' LYS . . . . . 0.536 ' HB2' HD12 ' A' ' 731' ' ' ILE . 10.0 mmmt -118.88 148.34 43.01 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 708' ' ' ARG . . . . . 0.401 ' HG2' HG13 ' A' ' 732' ' ' VAL . 0.5 OUTLIER -109.38 122.96 48.52 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.058 0.456 . . . . 0.0 110.863 -176.9 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -101.86 113.79 27.29 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 175.507 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 710' ' ' TRP . . . . . 0.456 ' O ' HD23 ' A' ' 747' ' ' LEU . 87.8 m95 -89.91 115.38 27.17 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -178.851 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 711' ' ' LEU . . . . . 0.497 HD11 ' HB2' ' A' ' 719' ' ' CYS . 0.0 OUTLIER -114.87 125.48 53.7 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.75 -172.158 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -126.29 43.37 3.11 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.191 177.256 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 713' ' ' VAL . . . . . 0.764 ' HA ' ' CB ' ' A' ' 750' ' ' ASP . 25.2 t -98.82 133.76 40.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.63 -0.713 . . . . 0.0 110.652 -178.053 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -98.3 -34.04 10.84 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.639 -176.647 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -69.96 122.52 19.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.436 178.819 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 716' ' ' ALA . . . . . 0.732 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -64.18 -37.59 88.02 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.087 -0.506 . . . . 0.0 112.066 -173.404 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 717' ' ' SER . . . . . 0.431 ' O ' ' HB2' ' A' ' 721' ' ' PHE . 1.7 m -63.09 -45.61 91.27 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.116 0.484 . . . . 0.0 110.24 179.126 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 718' ' ' LEU . . . . . 0.644 ' HB3' HG11 ' A' ' 713' ' ' VAL . 0.4 OUTLIER -68.93 -49.74 55.47 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.514 -0.767 . . . . 0.0 111.566 -179.534 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 719' ' ' CYS . . . . . 0.732 ' SG ' ' HA ' ' A' ' 716' ' ' ALA . 30.5 p -67.13 -51.02 59.17 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.212 -174.675 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 720' ' ' GLN . . . . . 0.419 ' HA ' ' CG ' ' A' ' 723' ' ' GLU . 4.6 tp60 -60.24 -39.23 86.0 Favored 'General case' 0 C--N 1.332 -0.163 0 O-C-N 122.997 0.185 . . . . 0.0 111.37 -178.21 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 721' ' ' PHE . . . . . 0.431 ' HB2' ' O ' ' A' ' 717' ' ' SER . 10.6 t80 -55.87 -55.8 28.19 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.021 0.438 . . . . 0.0 110.433 179.755 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 722' ' ' LEU . . . . . 0.635 HD13 HG21 ' A' ' 748' ' ' ILE . 20.5 mt -68.42 -46.54 69.62 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.427 -176.918 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 723' ' ' GLU . . . . . 0.419 ' CG ' ' HA ' ' A' ' 720' ' ' GLN . 0.0 OUTLIER -64.66 -44.23 91.07 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.549 0.203 . . . . 0.0 111.549 -173.892 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 724' ' ' THR . . . . . 0.64 ' O ' ' HG3' ' A' ' 728' ' ' ARG . 55.4 m -67.36 -36.76 82.04 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.769 0.318 . . . . 0.0 110.804 -179.189 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 24.5 m -70.67 -49.08 51.08 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.737 0.304 . . . . 0.0 111.467 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 726' ' ' LEU . . . . . . . . . . . . . 9.6 mt -68.6 -37.09 79.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.649 -175.032 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.61 -18.96 65.71 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.044 0.45 . . . . 0.0 110.88 -179.707 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 728' ' ' ARG . . . . . 0.64 ' HG3' ' O ' ' A' ' 724' ' ' THR . 8.9 mtm180 -74.69 -11.25 60.13 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.013 0.435 . . . . 0.0 110.74 178.297 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -103.7 8.02 37.34 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.045 0.45 . . . . 0.0 110.803 178.959 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 730' ' ' GLY . . . . . 0.477 ' O ' ' HA ' ' A' ' 705' ' ' SER . . . 89.86 13.17 61.24 Favored Glycine 0 C--N 1.329 0.169 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.784 179.006 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 731' ' ' ILE . . . . . 0.536 HD12 ' HB2' ' A' ' 707' ' ' LYS . 15.2 mm -90.35 128.94 41.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 O-C-N 122.791 -0.24 . . . . 0.0 110.475 179.686 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 732' ' ' VAL . . . . . 0.401 HG13 ' HG2' ' A' ' 708' ' ' ARG . 1.4 p -90.01 115.81 30.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.201 0.524 . . . . 0.0 110.566 -179.604 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 733' ' ' VAL . . . . . . . . . . . . . 10.1 t -86.81 137.14 21.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.195 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -141.48 137.34 32.04 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.827 0.346 . . . . 0.0 110.948 -177.845 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.72 116.6 7.82 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.632 178.548 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -85.4 80.01 9.27 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.401 0.619 . . . . 0.0 110.873 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 737' ' ' GLU . . . . . 0.462 ' HG3' ' H ' ' A' ' 737' ' ' GLU . 0.0 OUTLIER -79.01 -29.41 43.65 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.065 176.26 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 146.77 67.49 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.57 178.845 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 739' ' ' GLN . . . . . 0.451 ' HB2' ' H ' ' A' ' 740' ' ' GLU . 0.1 OUTLIER -112.99 -119.96 0.3 Allowed 'General case' 0 C--N 1.329 -0.312 0 O-C-N 122.879 -0.189 . . . . 0.0 110.817 179.304 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 740' ' ' GLU . . . . . 0.496 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 17.2 mm-40 -112.5 134.14 21.67 Favored Pre-proline 0 C--N 1.326 -0.432 0 CA-C-O 120.659 0.266 . . . . 0.0 111.045 -177.065 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 741' ' ' PRO . . . . . 0.496 ' HD3' ' HA ' ' A' ' 740' ' ' GLU . 4.5 Cg_endo -88.0 125.81 1.98 Allowed 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 123.434 2.756 . . . . 0.0 111.98 175.607 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 742' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -95.71 125.17 50.14 Favored Pre-proline 0 N--CA 1.449 -0.525 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.377 176.777 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 743' ' ' PRO . . . . . 0.675 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 34.0 Cg_endo -64.28 -9.41 19.79 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.834 2.356 . . . . 0.0 112.465 -179.314 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -104.85 -6.96 19.74 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.055 -179.902 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -117.13 167.28 11.32 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.519 -173.364 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 746' ' ' VAL . . . . . 0.652 HG21 HD11 ' A' ' 795' ' ' LEU . 33.0 m -118.91 148.21 21.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.352 0.596 . . . . 0.0 112.417 -171.454 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 747' ' ' LEU . . . . . 0.456 HD23 ' O ' ' A' ' 710' ' ' TRP . 0.3 OUTLIER -107.89 115.14 29.59 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.481 175.141 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 748' ' ' ILE . . . . . 0.635 HG21 HD13 ' A' ' 722' ' ' LEU . 19.3 mt -98.86 107.55 20.67 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 172.92 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 749' ' ' THR . . . . . 0.501 HG21 ' HB ' ' A' ' 753' ' ' VAL . 0.0 OUTLIER -102.68 160.55 14.48 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.319 -0.855 . . . . 0.0 112.192 -170.388 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 750' ' ' ASP . . . . . 0.764 ' CB ' ' HA ' ' A' ' 713' ' ' VAL . 36.7 t0 -124.14 121.61 35.59 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 171.426 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 64.84 -165.77 0.23 Allowed 'General case' 0 C--N 1.327 -0.385 0 O-C-N 123.785 0.678 . . . . 0.0 110.715 -174.288 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 752' ' ' VAL . . . . . 0.929 HG21 ' HB ' ' A' ' 770' ' ' ILE . 42.0 t -82.46 122.4 37.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.06 0.457 . . . . 0.0 111.317 -175.164 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 753' ' ' VAL . . . . . 0.501 ' HB ' HG21 ' A' ' 749' ' ' THR . 8.7 p -93.21 -7.16 10.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.269 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 54.72 51.24 14.17 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.388 -178.666 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.72 167.87 28.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.713 178.196 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -101.77 -29.47 11.86 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 123.108 0.255 . . . . 0.0 110.987 -179.686 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 757' ' ' TRP . . . . . 0.526 ' CD1' ' HB ' ' A' ' 762' ' ' VAL . 68.9 t-105 65.03 94.01 0.06 Allowed 'General case' 0 N--CA 1.464 0.271 0 O-C-N 123.794 0.684 . . . . 0.0 111.007 -179.724 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.81 64.58 8.13 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.255 0.55 . . . . 0.0 110.326 177.447 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 759' ' ' GLY . . . . . 0.675 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -123.44 -151.82 8.33 Favored Glycine 0 N--CA 1.446 -0.644 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.457 178.885 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.14 -51.01 19.49 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.993 0.425 . . . . 0.0 110.051 178.563 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -162.39 151.17 15.03 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.377 178.841 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 762' ' ' VAL . . . . . 0.526 ' HB ' ' CD1' ' A' ' 757' ' ' TRP . 2.7 p -128.15 117.04 44.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.606 176.754 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 1.6 t -109.49 104.19 16.69 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.693 -178.2 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 764' ' ' THR . . . . . 0.622 ' HB ' HG12 ' A' ' 782' ' ' VAL . 90.4 m -95.43 121.44 37.12 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.951 -175.132 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 765' ' ' PHE . . . . . 0.852 ' HE1' HG23 ' A' ' 785' ' ' VAL . 5.6 m-85 -91.13 89.3 7.31 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.334 173.629 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -110.61 133.54 53.22 Favored 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.57 -175.593 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.79 61.06 4.08 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.98 0.419 . . . . 0.0 110.053 179.565 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 768' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 768' ' ' ARG . 3.3 mtm180 57.39 29.9 17.69 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.868 178.648 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -96.17 118.66 33.19 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.114 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 770' ' ' ILE . . . . . 0.929 ' HB ' HG21 ' A' ' 752' ' ' VAL . 53.6 mt 71.31 -70.01 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 O-C-N 123.76 0.662 . . . . 0.0 111.477 178.123 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . 126.73 96.93 0.99 Allowed Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 120.504 -0.855 . . . . 0.0 113.248 178.524 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 772' ' ' ILE . . . . . 0.736 HG12 HG22 ' A' ' 752' ' ' VAL . 39.2 mm -104.42 129.28 25.33 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 171.49 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 773' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -75.12 170.91 19.35 Favored 'Trans proline' 0 CA--C 1.53 0.279 0 C-N-CA 122.578 2.186 . . . . 0.0 113.184 -178.311 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 774' ' ' LEU . . . . . 0.578 ' O ' ' HB3' ' A' ' 780' ' ' GLU . 0.7 OUTLIER -101.93 -148.88 0.38 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.459 -178.706 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 775' ' ' GLU . . . . . 0.495 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 1.7 mp0 -65.38 60.56 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -179.688 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -102.01 -16.06 16.59 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 170.75 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -132.26 149.25 72.67 Favored Pre-proline 0 N--CA 1.449 -0.514 0 CA-C-N 114.188 -1.369 . . . . 0.0 108.423 175.349 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -60.67 100.41 0.16 Allowed 'Trans proline' 0 C--O 1.232 0.206 0 C-N-CA 122.572 2.181 . . . . 0.0 112.956 -176.695 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 123.05 -17.28 8.09 Favored Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.693 -0.765 . . . . 0.0 113.109 175.52 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 780' ' ' GLU . . . . . 0.578 ' HB3' ' O ' ' A' ' 774' ' ' LEU . 1.1 tt0 -81.07 126.29 31.26 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 117.13 0.465 . . . . 0.0 111.418 -175.9 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 32.3 m95 -138.68 143.07 39.0 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 176.645 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 782' ' ' VAL . . . . . 0.622 HG12 ' HB ' ' A' ' 764' ' ' THR . 1.2 m -143.93 155.35 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-O 121.121 0.486 . . . . 0.0 111.633 178.015 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 783' ' ' HIS . . . . . 0.485 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 1.4 t-160 -161.52 139.98 9.54 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.565 174.167 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -105.4 99.36 8.97 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 175.623 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 785' ' ' VAL . . . . . 0.852 HG23 ' HE1' ' A' ' 765' ' ' PHE . 0.0 OUTLIER -171.29 -160.98 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.953 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 786' ' ' ALA . . . . . 0.447 ' H ' ' HB ' ' A' ' 785' ' ' VAL . . . -133.33 68.15 1.51 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.796 -0.184 . . . . 0.0 110.659 177.713 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 50.2 67.95 3.9 Favored Pre-proline 0 N--CA 1.468 0.447 0 CA-C-N 115.878 -0.601 . . . . 0.0 112.011 178.095 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 788' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -87.36 46.77 1.41 Allowed 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 122.595 2.197 . . . . 0.0 112.947 -174.336 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 71.21 -32.26 0.24 Allowed 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.415 0.686 . . . . 0.0 112.85 175.726 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 790' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -71.19 -37.92 72.13 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -175.78 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 791' ' ' LEU . . . . . 0.715 HD22 ' HE2' ' A' ' 765' ' ' PHE . 0.2 OUTLIER -71.12 -48.3 13.58 Favored Pre-proline 0 C--N 1.327 -0.372 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -176.362 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 792' ' ' PRO . . . . . 0.466 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 2.9 Cg_endo -53.65 -33.08 67.75 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 121.373 1.382 . . . . 0.0 112.119 173.855 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -66.79 -44.65 80.74 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 120.909 0.385 . . . . 0.0 110.464 175.829 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -59.75 -44.36 93.86 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.292 177.155 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 795' ' ' LEU . . . . . 0.652 HD11 HG21 ' A' ' 746' ' ' VAL . 0.2 OUTLIER -59.84 -47.36 86.04 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.096 -179.282 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -62.13 -45.06 95.14 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.097 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.02 -24.63 62.4 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.352 -178.008 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -77.62 -28.65 15.96 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 CA-C-O 120.732 0.301 . . . . 0.0 111.116 -179.135 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 799' ' ' TYR . . . . . 0.462 ' HD1' ' HA ' ' A' ' 799' ' ' TYR . 0.2 OUTLIER -81.45 -16.96 50.42 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.445 178.488 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 1.8 mt 58.69 83.37 0.12 Allowed 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.426 -0.807 . . . . 0.0 111.92 174.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 801' ' ' ILE . . . . . 0.656 HG12 HD22 ' A' ' 704' ' ' LEU . 1.8 mt -102.58 109.26 26.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.815 -179.517 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -107.84 9.85 28.77 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.293 177.882 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 803' ' ' MET . . . . . 0.468 ' HB3' ' H ' ' A' ' 804' ' ' GLU . 0.0 OUTLIER 56.91 -121.14 1.48 Allowed 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.475 -177.397 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 804' ' ' GLU . . . . . 0.468 ' H ' ' HB3' ' A' ' 803' ' ' MET . 0.0 OUTLIER -155.55 161.33 40.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.716 0.293 . . . . 0.0 110.345 178.872 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 3.2 m -147.89 109.01 4.26 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.121 0.486 . . . . 0.0 109.936 177.169 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -105.76 119.84 40.17 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.767 -175.732 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 33.0 t0 -171.22 84.51 0.5 Allowed Pre-proline 0 C--N 1.327 -0.396 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.938 178.346 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 808' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_exo -65.78 147.4 85.51 Favored 'Trans proline' 0 C--O 1.233 0.269 0 C-N-CA 123.045 2.497 . . . . 0.0 112.779 -177.108 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -88.11 159.8 18.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.262 176.424 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 14.6 t30 -124.9 114.77 19.62 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.803 0.335 . . . . 0.0 110.562 -177.466 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -116.55 149.61 39.33 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.95 -178.406 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 812' ' ' LEU . . . . . 0.562 HD22 ' HD2' ' A' ' 813' ' ' PRO . 0.4 OUTLIER -139.77 108.3 7.08 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.459 179.228 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 813' ' ' PRO . . . . . 0.562 ' HD2' HD22 ' A' ' 812' ' ' LEU . 67.8 Cg_endo -77.15 146.48 25.4 Favored 'Trans proline' 0 CA--C 1.53 0.314 0 C-N-CA 122.494 2.129 . . . . 0.0 112.324 176.792 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -114.5 133.03 56.08 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.466 -0.333 . . . . 0.0 110.617 179.278 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 1.1 m -95.51 139.16 32.18 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.099 -179.344 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -116.63 159.3 22.38 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 176.523 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.11 139.2 52.64 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.252 0.548 . . . . 0.0 112.07 -172.131 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -145.22 161.99 38.2 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.023 174.265 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -148.8 136.74 14.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.184 0.516 . . . . 0.0 111.282 -176.384 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -127.66 153.63 46.23 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.812 174.476 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -163.98 133.59 4.0 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.767 -0.197 . . . . 0.0 110.601 179.655 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -167.44 108.11 0.6 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.297 176.503 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -145.25 138.25 26.32 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 172.582 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -159.07 -97.49 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.779 0.324 . . . . 0.0 111.576 -175.277 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.32 103.53 12.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.743 0.306 . . . . 0.0 111.049 -176.462 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 826' ' ' MET . . . . . 0.43 ' SD ' ' HA ' ' A' ' 869' ' ' ILE . 0.0 OUTLIER -100.55 117.08 33.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.495 178.949 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 827' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -113.66 120.14 62.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.93 178.811 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 828' ' ' LEU . . . . . 0.808 ' HB3' HG22 ' A' ' 872' ' ' VAL . 2.2 tm? -95.55 129.72 42.64 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 -179.03 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 829' ' ' VAL . . . . . 0.611 ' HB ' ' CZ ' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -123.44 124.22 69.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 120.725 0.298 . . . . 0.0 110.667 179.329 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 830' ' ' VAL . . . . . 0.553 HG13 ' HA ' ' A' ' 874' ' ' SER . 2.2 p -122.25 105.29 16.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.993 0.425 . . . . 0.0 111.338 -176.799 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 831' ' ' ASP . . . . . 0.693 ' HA ' ' O ' ' A' ' 875' ' ' ASP . 4.7 t0 -110.11 155.42 21.93 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.276 0.56 . . . . 0.0 111.415 -175.541 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -93.24 -21.45 19.61 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.031 -0.986 . . . . 0.0 109.496 175.184 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 10.9 m170 -110.75 118.1 49.21 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.837 -179.025 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -61.2 -40.5 49.86 Favored 'Trans proline' 0 C--O 1.234 0.313 0 C-N-CA 122.892 2.394 . . . . 0.0 112.66 -178.125 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -61.04 -40.92 87.26 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.421 178.925 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 836' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -66.46 -46.1 77.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.638 178.282 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 837' ' ' ARG . . . . . 0.697 HH21 HD11 ' A' ' 840' ' ' LEU . 0.0 OUTLIER -52.06 -53.3 43.86 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.653 179.926 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 838' ' ' ARG . . . . . 0.487 ' HG3' ' N ' ' A' ' 839' ' ' LEU . 0.0 OUTLIER -64.24 -42.46 96.52 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.728 0.299 . . . . 0.0 111.37 -175.728 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 839' ' ' LEU . . . . . 0.487 ' N ' ' HG3' ' A' ' 838' ' ' ARG . 0.2 OUTLIER -76.3 -49.02 18.06 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -171.347 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 840' ' ' LEU . . . . . 0.697 HD11 HH21 ' A' ' 837' ' ' ARG . 1.7 pp -75.15 -30.04 60.64 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.387 -0.525 . . . . 0.0 111.168 -176.624 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -71.87 -25.26 61.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.822 0.344 . . . . 0.0 110.24 175.493 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -63.59 -44.66 93.37 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 172.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 843' ' ' GLN . . . . . 0.452 ' HG2' HD23 ' A' ' 929' ' ' LEU . 1.4 mt-30 -62.7 -38.3 89.88 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.286 176.397 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 844' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.81 -34.91 76.78 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.229 0.538 . . . . 0.0 110.416 175.12 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -68.45 -31.77 74.44 Favored Glycine 0 N--CA 1.446 -0.644 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.993 176.37 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -68.65 -24.85 64.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.939 0.4 . . . . 0.0 110.413 177.088 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 847' ' ' LEU . . . . . 0.513 HD22 HD22 ' A' ' 936' ' ' LEU . 0.2 OUTLIER -68.29 -38.38 81.61 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.442 174.995 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 92.0 55.66 1.71 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.742 -0.742 . . . . 0.0 113.094 175.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 849' ' ' TYR . . . . . 0.402 ' HE2' HD23 ' A' ' 847' ' ' LEU . 92.8 m-85 -136.14 164.18 28.62 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 177.396 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 850' ' ' GLN . . . . . 0.406 ' O ' ' HA ' ' A' ' 826' ' ' MET . 0.0 OUTLIER -80.65 108.34 14.22 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 -179.45 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -112.16 148.37 34.15 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.634 -176.122 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 852' ' ' LYS . . . . . 0.405 ' HB3' HD23 ' A' ' 828' ' ' LEU . 0.0 OUTLIER -121.51 116.83 25.41 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 175.007 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 32.8 p -92.68 128.62 38.61 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.836 -178.532 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 854' ' ' ALA . . . . . 0.507 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -137.35 132.35 33.45 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.367 176.796 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -112.21 73.7 0.83 Allowed 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 172.235 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 856' ' ' ASP . . . . . 0.645 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 2.1 t0 -173.56 126.82 0.41 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.074 -0.966 . . . . 0.0 109.689 -170.929 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -71.86 -61.87 3.61 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.197 -177.707 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 858' ' ' VAL . . . . . 0.449 HG22 ' H ' ' A' ' 858' ' ' VAL . 0.0 OUTLIER -59.23 -31.51 46.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 111.933 0.346 . . . . 0.0 111.933 -178.43 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 859' ' ' ASP . . . . . 0.645 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 0.2 OUTLIER -68.91 -20.85 64.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.578 0.227 . . . . 0.0 111.364 -178.049 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 860' ' ' ALA . . . . . 0.457 ' O ' ' HB2' ' A' ' 864' ' ' LEU . . . -64.77 -36.27 83.78 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.975 0.417 . . . . 0.0 110.078 176.165 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 861' ' ' LEU . . . . . . . . . . . . . 1.3 mt -71.56 -37.22 71.1 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.706 175.582 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 36.4 t-20 -56.18 -53.16 60.46 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 114.98 -1.009 . . . . 0.0 111.034 179.636 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 8.3 p -72.79 -32.71 41.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.49 -178.054 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 864' ' ' LEU . . . . . 0.457 ' HB2' ' O ' ' A' ' 860' ' ' ALA . 0.2 OUTLIER -62.71 -45.87 90.75 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.024 0.44 . . . . 0.0 110.857 -179.956 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 1.4 m -80.2 -20.05 45.61 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.015 -178.035 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -74.09 -52.14 13.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.072 0.463 . . . . 0.0 110.58 178.104 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -109.84 -88.22 0.5 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.02 -179.659 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 868' ' ' HIS . . . . . 0.506 ' O ' ' HB ' ' A' ' 869' ' ' ILE . 0.2 OUTLIER 172.73 -64.87 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 O-C-N 123.267 0.355 . . . . 0.0 110.662 -179.409 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 869' ' ' ILE . . . . . 0.776 HG12 ' HB2' ' A' ' 828' ' ' LEU . 1.7 mp 71.89 142.66 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 O-C-N 123.783 0.677 . . . . 0.0 110.496 -175.368 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -87.01 -42.66 12.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.883 0.373 . . . . 0.0 111.323 -176.118 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 871' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -141.07 136.16 33.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.158 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 872' ' ' VAL . . . . . 0.808 HG22 ' HB3' ' A' ' 828' ' ' LEU . 3.2 t -115.1 131.57 66.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.725 -178.728 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 873' ' ' LEU . . . . . 0.489 HD12 HG13 ' A' ' 829' ' ' VAL . 1.9 mt -113.35 118.84 35.69 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 173.635 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 874' ' ' SER . . . . . 0.553 ' HA ' HG13 ' A' ' 830' ' ' VAL . 72.1 p -105.56 97.02 6.91 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.046 0.45 . . . . 0.0 110.282 -178.726 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 875' ' ' ASP . . . . . 0.693 ' O ' ' HA ' ' A' ' 831' ' ' ASP . 0.0 OUTLIER -87.9 105.8 17.67 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.841 -179.317 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 876' ' ' VAL . . . . . 0.673 HG22 ' H ' ' A' ' 878' ' ' MET . 5.1 p -127.19 143.11 41.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-O 121.226 0.536 . . . . 0.0 111.14 -176.203 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -98.12 -0.41 44.43 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.599 179.205 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 878' ' ' MET . . . . . 0.673 ' H ' HG22 ' A' ' 876' ' ' VAL . 2.2 tpp -132.57 80.64 61.73 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.516 -179.692 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 879' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -98.98 57.6 0.06 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.838 0 C-N-CA 123.377 2.718 . . . . 0.0 113.187 -178.577 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -156.32 -88.52 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.183 -177.799 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -71.15 -39.4 71.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.051 0.453 . . . . 0.0 110.373 179.804 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -108.8 -177.46 3.32 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 174.231 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . 79.58 -52.88 4.2 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 121.088 -0.577 . . . . 0.0 113.039 176.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 1.7 p90 -63.52 -22.11 66.71 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.982 0.42 . . . . 0.0 111.541 -174.836 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 885' ' ' ARG . . . . . 0.435 ' H ' ' HG3' ' A' ' 885' ' ' ARG . 0.2 OUTLIER -66.27 -31.8 72.83 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.865 0.364 . . . . 0.0 110.139 176.594 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -69.39 -49.59 53.89 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 178.618 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.57 -39.62 94.26 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.072 0.463 . . . . 0.0 110.935 179.797 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 888' ' ' GLN . . . . . 0.788 ' HA ' ' HD3' ' A' ' 891' ' ' ARG . 1.4 tp-100 -61.01 -45.51 94.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.972 175.23 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.34 -42.95 96.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.777 179.564 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 890' ' ' ILE . . . . . 0.507 HG22 ' HB3' ' A' ' 895' ' ' LEU . 11.4 mm -58.69 -52.3 61.59 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.024 179.657 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 891' ' ' ARG . . . . . 0.788 ' HD3' ' HA ' ' A' ' 888' ' ' GLN . 0.4 OUTLIER -68.38 -30.09 68.94 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.42 -178.153 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -74.23 -34.85 63.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.594 -177.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.16 -46.73 32.29 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.838 177.608 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 133.23 89.01 0.38 Allowed Glycine 0 N--CA 1.443 -0.89 0 C-N-CA 120.638 -0.792 . . . . 0.0 112.42 179.534 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 895' ' ' LEU . . . . . 0.507 ' HB3' HG22 ' A' ' 890' ' ' ILE . 0.0 OUTLIER -77.93 150.26 34.06 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.041 0.448 . . . . 0.0 110.783 177.918 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -135.54 13.74 3.46 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.985 -178.569 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 897' ' ' LEU . . . . . 0.721 HD11 HG23 ' A' ' 872' ' ' VAL . 1.7 pt? -149.03 154.41 39.48 Favored Pre-proline 0 C--N 1.32 -0.706 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.409 -173.609 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 898' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 897' ' ' LEU . 18.4 Cg_exo -67.2 122.57 9.87 Favored 'Trans proline' 0 C--O 1.238 0.517 0 C-N-CA 122.873 2.382 . . . . 0.0 112.153 178.346 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 899' ' ' VAL . . . . . 0.828 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 18.9 t -103.19 108.3 24.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 121.266 0.555 . . . . 0.0 110.451 178.048 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 900' ' ' ILE . . . . . 0.481 ' O ' ' HA ' ' A' ' 873' ' ' LEU . 8.1 mt -96.15 102.84 14.0 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.717 178.355 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -89.94 124.71 7.55 Favored Glycine 0 N--CA 1.44 -1.049 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.475 -176.739 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 902' ' ' VAL . . . . . 0.635 ' HB ' HD12 ' A' ' 923' ' ' LEU . 0.1 OUTLIER -103.33 106.84 20.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 174.438 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 903' ' ' THR . . . . . 0.424 HG22 HG12 ' A' ' 876' ' ' VAL . 17.8 p -108.53 144.63 35.94 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.063 -173.447 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 904' ' ' ALA . . . . . 0.494 ' HA ' ' HB2' ' A' ' 925' ' ' LYS . . . -74.59 103.26 4.83 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.789 -0.364 . . . . 0.0 110.586 177.95 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 42.34 73.33 0.14 Allowed 'General case' 0 N--CA 1.468 0.44 0 O-C-N 124.225 0.953 . . . . 0.0 112.854 176.428 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -81.2 -14.08 57.92 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.244 177.839 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 51.8 mt 74.29 -60.44 0.52 Allowed 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.501 179.135 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -107.64 54.97 0.65 Allowed 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 175.085 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -44.71 -46.74 10.52 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.506 -0.77 . . . . 0.0 112.287 -177.09 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 910' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -44.97 95.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.809 0.338 . . . . 0.0 111.413 -177.829 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.82 -38.26 79.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.012 0.434 . . . . 0.0 110.462 -178.847 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 912' ' ' GLN . . . . . 0.648 ' O ' ' HG2' ' A' ' 916' ' ' GLU . 1.7 tt0 -60.81 -45.91 92.59 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.0 176.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -57.76 -35.27 70.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.305 178.523 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 61.7 m -68.72 -35.64 77.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.475 177.811 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 915' ' ' LEU . . . . . 0.488 ' HA ' HD22 ' A' ' 915' ' ' LEU . 0.3 OUTLIER -70.17 -32.69 70.75 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.055 0.455 . . . . 0.0 110.424 177.769 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 916' ' ' GLU . . . . . 0.648 ' HG2' ' O ' ' A' ' 912' ' ' GLN . 53.3 mm-40 -67.9 -38.72 83.32 Favored 'General case' 0 C--O 1.226 -0.178 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.651 176.844 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 50.06 24.66 1.45 Allowed 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.379 0.671 . . . . 0.0 112.755 176.55 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 918' ' ' GLY . . . . . 0.46 ' HA3' ' HB3' ' A' ' 891' ' ' ARG . . . -147.49 25.94 1.52 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.143 -177.502 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 919' ' ' MET . . . . . 0.828 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 2.1 mtt -118.18 -116.89 0.32 Allowed 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.614 0.245 . . . . 0.0 110.671 -175.234 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 920' ' ' ASP . . . . . 0.519 ' H ' ' HB3' ' A' ' 919' ' ' MET . 3.6 t70 175.56 -59.36 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.261 177.017 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 37.6 m -136.6 157.81 45.91 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.876 178.222 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 922' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -132.12 142.58 49.55 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.688 0.28 . . . . 0.0 111.031 -177.343 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 923' ' ' LEU . . . . . 0.635 HD12 ' HB ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -145.14 170.35 16.4 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 174.362 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 17.3 m -93.33 153.87 18.3 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 120.636 0.255 . . . . 0.0 111.13 -178.173 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 925' ' ' LYS . . . . . 0.588 ' HE3' ' HB3' ' A' ' 875' ' ' ASP . 0.0 OUTLIER -50.02 -49.2 76.34 Favored Pre-proline 0 CA--C 1.538 0.513 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 -178.64 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 926' ' ' PRO . . . . . 0.498 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 16.0 Cg_endo -58.15 103.03 0.14 Allowed 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 121.984 1.789 . . . . 0.0 111.714 174.558 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -125.73 154.72 34.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.709 -175.169 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 928' ' ' THR . . . . . 0.44 ' H ' HG12 ' A' ' 931' ' ' VAL . 0.8 OUTLIER -115.03 161.32 18.51 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.129 177.676 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 929' ' ' LEU . . . . . 0.452 HD23 ' HG2' ' A' ' 843' ' ' GLN . 0.6 OUTLIER -61.74 -42.24 98.71 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.849 0.357 . . . . 0.0 110.418 178.877 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -60.21 -50.01 75.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.275 -179.542 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 931' ' ' VAL . . . . . 0.44 HG12 ' H ' ' A' ' 928' ' ' THR . 1.4 p -71.65 -30.46 38.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-O 120.516 0.198 . . . . 0.0 111.254 -177.592 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 932' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -70.48 -38.42 73.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 177.723 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 933' ' ' LYS . . . . . 0.511 ' HA ' HD21 ' A' ' 847' ' ' LEU . 1.5 tmtm? -67.82 -42.16 81.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.02 176.163 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -48.96 79.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.929 179.383 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 11.9 m -63.72 -43.95 95.02 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.333 -179.239 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 936' ' ' LEU . . . . . 0.513 HD22 HD22 ' A' ' 847' ' ' LEU . 0.0 OUTLIER -62.22 -56.83 14.76 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.773 179.995 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 25.5 m -59.04 -48.23 82.35 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.708 -178.542 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.02 -45.97 86.04 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.353 -175.283 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 939' ' ' TYR . . . . . 0.451 ' HA ' ' HB3' ' A' ' 942' ' ' ARG . 0.6 OUTLIER -80.81 -31.48 35.59 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.696 -0.402 . . . . 0.0 111.524 -176.647 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -61.26 -43.75 98.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.94 0.4 . . . . 0.0 110.451 176.407 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 941' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.45 -34.59 70.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.341 177.736 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 942' ' ' ARG . . . . . 0.451 ' HB3' ' HA ' ' A' ' 939' ' ' TYR . 6.8 ttt85 -65.08 -48.06 75.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.979 -177.906 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 26.9 m -71.27 -30.76 41.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.799 0.333 . . . . 0.0 110.558 -178.412 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 19.5 mtp85 -71.38 -37.5 71.58 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.819 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.15 -23.95 35.31 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.683 0.278 . . . . 0.0 111.135 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 57.1 m -76.24 -28.54 57.18 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.192 0.52 . . . . 0.0 110.281 175.576 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 1.7 mtp180 -84.94 -19.52 32.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.571 173.144 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 27.7 t0 69.8 79.77 0.19 Allowed 'General case' 0 CA--C 1.521 -0.165 0 CA-C-N 114.587 -1.188 . . . . 0.0 110.843 -177.759 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.253 1.272 0 CA-C-O 117.68 -1.153 . . . . 0.0 109.148 176.582 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 1.9 ttp . . . . . 0 N--CA 1.478 0.944 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 143.02 -99.84 0.23 Allowed Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.957 -0.64 . . . . 0.0 111.802 -179.165 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 698' ' ' GLY . . . . . 0.46 ' O ' HG22 ' A' ' 701' ' ' VAL . . . 84.57 -64.9 4.18 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.942 -0.647 . . . . 0.0 112.812 179.03 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.93 119.82 11.99 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.805 0.336 . . . . 0.0 110.705 -179.26 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . 135.49 -24.28 3.37 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.349 -178.533 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 701' ' ' VAL . . . . . 0.46 HG22 ' O ' ' A' ' 698' ' ' GLY . 35.5 m -87.27 -169.61 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.649 0.262 . . . . 0.0 110.976 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -58.45 129.13 40.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.38 177.565 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 703' ' ' GLY . . . . . 0.537 ' HA2' ' SD ' ' A' ' 803' ' ' MET . . . -85.24 132.71 11.27 Favored Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.804 -175.878 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.894 HD13 ' HA ' ' A' ' 801' ' ' ILE . 5.7 tp 53.74 -100.2 0.1 Allowed 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 123.392 0.677 . . . . 0.0 112.432 175.054 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 705' ' ' SER . . . . . 0.505 ' HA ' ' HA3' ' A' ' 730' ' ' GLY . 2.6 m 69.95 160.05 0.2 Allowed 'General case' 0 CA--C 1.533 0.325 0 O-C-N 123.818 0.699 . . . . 0.0 111.846 -176.332 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 100.1 -23.09 37.29 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.872 -0.68 . . . . 0.0 113.098 174.788 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 17.4 mmtt -82.3 153.0 26.06 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 122.803 -0.234 . . . . 0.0 110.438 -179.7 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 708' ' ' ARG . . . . . 0.487 ' HG2' HG13 ' A' ' 732' ' ' VAL . 0.0 OUTLIER -103.38 159.42 15.58 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.871 0.367 . . . . 0.0 110.863 -176.828 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 709' ' ' CYS . . . . . 0.495 ' HB2' HG22 ' A' ' 731' ' ' ILE . 0.0 OUTLIER -142.44 119.54 11.4 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.635 175.049 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 710' ' ' TRP . . . . . . . . . . . . . 86.5 m95 -98.21 123.57 42.35 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.894 0.378 . . . . 0.0 110.047 -179.712 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 711' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 711' ' ' LEU . 0.6 OUTLIER -119.99 123.33 43.22 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 121.527 0.679 . . . . 0.0 110.899 -179.164 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -105.82 32.73 4.16 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.111 175.364 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 713' ' ' VAL . . . . . 0.766 HG13 ' HB2' ' A' ' 750' ' ' ASP . 4.0 t -79.53 102.28 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.894 179.173 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 714' ' ' ARG . . . . . 0.537 ' H ' ' HB3' ' A' ' 750' ' ' ASP . 2.9 mtp180 -73.35 -18.28 61.2 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.682 -178.904 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -77.36 111.1 12.67 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.591 -0.732 . . . . 0.0 109.789 176.355 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 716' ' ' ALA . . . . . 0.572 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -63.61 -37.85 88.9 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.769 0.285 . . . . 0.0 111.769 -173.579 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.89 -47.31 75.27 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.008 0.432 . . . . 0.0 110.372 179.64 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 718' ' ' LEU . . . . . 0.49 HD11 ' HA ' ' A' ' 786' ' ' ALA . 0.2 OUTLIER -69.22 -43.54 73.88 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.198 179.229 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 719' ' ' CYS . . . . . 0.572 ' SG ' ' HA ' ' A' ' 716' ' ' ALA . 2.5 p -65.5 -46.54 79.28 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.094 -176.263 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 720' ' ' GLN . . . . . 0.407 ' N ' ' SG ' ' A' ' 719' ' ' CYS . 2.0 tt0 -61.66 -43.32 99.07 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 121.041 -0.263 . . . . 0.0 110.692 -179.73 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -59.53 -57.65 12.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.029 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 9.5 mt -56.73 -46.1 81.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.078 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 723' ' ' GLU . . . . . 0.546 ' HA ' HG11 ' A' ' 733' ' ' VAL . 0.0 OUTLIER -59.85 -40.42 88.48 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.861 -177.264 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 724' ' ' THR . . . . . 0.418 ' HA ' ' HG2' ' A' ' 727' ' ' GLN . 9.6 m -67.55 -43.28 81.07 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.793 0.33 . . . . 0.0 111.071 -179.223 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 48.7 m -64.2 -32.92 74.69 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.657 -179.239 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 726' ' ' LEU . . . . . . . . . . . . . 3.5 mt -82.15 -45.79 14.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.576 -178.432 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 727' ' ' GLN . . . . . 0.418 ' HG2' ' HA ' ' A' ' 724' ' ' THR . 13.8 pt20 -64.95 -22.23 66.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.698 0.285 . . . . 0.0 111.343 -177.43 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 1.7 ptt-85 -65.61 -21.88 66.62 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.109 0.481 . . . . 0.0 110.629 177.186 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 3.2 m -100.98 16.13 26.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.15 0.5 . . . . 0.0 110.727 178.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 730' ' ' GLY . . . . . 0.505 ' HA3' ' HA ' ' A' ' 705' ' ' SER . . . 83.74 14.88 71.93 Favored Glycine 0 N--CA 1.449 -0.451 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.921 176.333 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 731' ' ' ILE . . . . . 0.495 HG22 ' HB2' ' A' ' 709' ' ' CYS . 8.0 mm -95.37 105.28 16.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-O 120.841 0.353 . . . . 0.0 110.114 179.491 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 732' ' ' VAL . . . . . 0.487 HG13 ' HG2' ' A' ' 708' ' ' ARG . 1.1 p -69.07 110.14 2.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.684 0.754 . . . . 0.0 110.555 -177.061 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 733' ' ' VAL . . . . . 0.546 HG11 ' HA ' ' A' ' 723' ' ' GLU . 0.1 OUTLIER -87.47 134.63 27.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.755 -178.138 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -138.72 139.15 38.27 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.555 -178.656 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 1.9 m -69.12 123.49 21.24 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.641 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 33.1 t80 -84.66 101.75 12.41 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.886 -178.375 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.2 -50.46 4.13 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.841 176.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -169.6 42.9 0.21 Allowed Glycine 0 N--CA 1.447 -0.592 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.352 178.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 13.9 mp0 -86.39 175.1 8.58 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.731 0.301 . . . . 0.0 110.871 -177.331 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.38 146.16 50.04 Favored Pre-proline 0 C--N 1.325 -0.496 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.001 -176.508 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 741' ' ' PRO . . . . . 0.535 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 85.3 Cg_endo -83.82 146.91 11.92 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 122.809 2.339 . . . . 0.0 112.731 178.365 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 742' ' ' THR . . . . . 0.694 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.2 OUTLIER -133.18 141.91 42.49 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.407 178.538 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 743' ' ' PRO . . . . . 0.694 ' HD2' HG22 ' A' ' 742' ' ' THR . 38.2 Cg_endo -66.57 -9.23 23.53 Favored 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 123.025 2.483 . . . . 0.0 113.447 -178.649 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -107.21 -3.55 19.69 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.963 0.411 . . . . 0.0 110.456 176.928 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -102.36 144.12 31.25 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.847 -174.221 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 3.4 p -114.9 139.49 40.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.44 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 747' ' ' LEU . . . . . 0.504 HD12 ' HB2' ' A' ' 757' ' ' TRP . 0.1 OUTLIER -104.17 110.7 23.0 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.28 177.893 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -97.26 107.53 20.12 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 176.388 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 749' ' ' THR . . . . . 0.401 HG21 HG11 ' A' ' 753' ' ' VAL . 17.6 p -104.56 148.57 26.35 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.001 0.429 . . . . 0.0 111.735 -172.715 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 750' ' ' ASP . . . . . 0.766 ' HB2' HG13 ' A' ' 713' ' ' VAL . 2.9 t70 -96.52 108.78 21.41 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 170.389 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 751' ' ' GLU . . . . . 0.476 ' HB3' ' H ' ' A' ' 752' ' ' VAL . 18.2 mm-40 62.93 -147.3 0.36 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.238 -174.757 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 752' ' ' VAL . . . . . 0.476 ' H ' ' HB3' ' A' ' 751' ' ' GLU . 2.1 t -79.86 133.78 28.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.758 -174.367 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 753' ' ' VAL . . . . . 0.401 HG11 HG21 ' A' ' 749' ' ' THR . 11.3 p -117.97 141.32 37.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.417 178.291 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.67 53.31 2.72 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.225 -178.804 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -157.85 131.76 8.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.422 -179.193 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 756' ' ' LYS . . . . . 0.487 ' HA ' ' HD2' ' A' ' 756' ' ' LYS . 0.1 OUTLIER -91.01 81.9 5.61 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.229 0.537 . . . . 0.0 110.114 177.869 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 757' ' ' TRP . . . . . 0.535 ' CH2' ' HA ' ' A' ' 741' ' ' PRO . 64.3 t-105 -65.24 124.57 22.53 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.604 178.304 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -131.49 62.56 1.62 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.206 0.527 . . . . 0.0 110.227 176.394 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 759' ' ' GLY . . . . . . . . . . . . . . . -109.8 -118.98 4.07 Favored Glycine 0 N--CA 1.444 -0.783 0 C-N-CA 120.786 -0.721 . . . . 0.0 111.565 178.397 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -78.45 -49.66 13.05 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.078 0.466 . . . . 0.0 110.102 177.145 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -168.16 164.64 13.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.533 179.425 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 2.5 p -141.1 126.66 19.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.453 175.195 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 763' ' ' VAL . . . . . 0.408 HG11 HD13 ' A' ' 791' ' ' LEU . 3.6 t -119.52 114.7 45.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.631 -176.308 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 764' ' ' THR . . . . . . . . . . . . . 23.7 m -95.45 113.29 24.93 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.226 -179.114 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 765' ' ' PHE . . . . . 0.443 ' HA ' ' O ' ' A' ' 783' ' ' HIS . 30.4 m-85 -84.85 109.3 18.0 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 174.998 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 766' ' ' CYS . . . . . 0.564 ' O ' ' HA ' ' A' ' 784' ' ' SER . 0.0 OUTLIER -96.48 153.9 17.58 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.911 -174.075 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 11.9 ptt85 -140.39 -37.98 0.45 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.123 176.231 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.26 34.52 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -179.313 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 769' ' ' HIS . . . . . 0.438 ' HB2' ' CD ' ' A' ' 751' ' ' GLU . 0.1 OUTLIER -135.65 -71.41 0.47 Allowed 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 110.089 -0.337 . . . . 0.0 110.089 174.016 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 3.9 mt 64.09 101.19 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.403 176.264 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 771' ' ' GLY . . . . . 0.452 ' N ' HG22 ' A' ' 752' ' ' VAL . . . -125.13 -4.92 6.95 Favored Glycine 0 N--CA 1.451 -0.306 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.014 176.731 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 772' ' ' ILE . . . . . 0.434 HG23 ' HD2' ' A' ' 773' ' ' PRO . 1.1 mp -104.33 146.45 32.62 Favored Pre-proline 0 C--N 1.325 -0.461 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 178.266 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 773' ' ' PRO . . . . . 0.519 ' HB2' ' H ' ' A' ' 774' ' ' LEU . 32.8 Cg_exo -60.01 -100.77 0.0 OUTLIER 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.932 2.421 . . . . 0.0 112.627 179.387 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 774' ' ' LEU . . . . . 0.877 ' HA ' HG13 ' A' ' 782' ' ' VAL . 0.4 OUTLIER 172.49 -167.52 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -179.582 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 775' ' ' GLU . . . . . 0.671 ' HG3' ' HA ' ' A' ' 781' ' ' TRP . 1.5 mp0 -61.42 69.24 0.01 OUTLIER 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.824 0.821 . . . . 0.0 112.393 173.455 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.04 6.02 2.36 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 114.573 -1.194 . . . . 0.0 108.771 173.441 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 777' ' ' ALA . . . . . 0.626 ' HB3' ' HB2' ' A' ' 780' ' ' GLU . . . -127.72 162.49 48.97 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-N 114.745 -1.116 . . . . 0.0 109.409 -179.625 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 778' ' ' PRO . . . . . 0.557 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 55.6 Cg_endo -68.99 66.67 1.31 Allowed 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 122.977 2.451 . . . . 0.0 113.474 -177.196 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 118.48 31.23 1.54 Allowed Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.631 178.038 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 780' ' ' GLU . . . . . 0.626 ' HB2' ' HB3' ' A' ' 777' ' ' ALA . 1.4 tt0 -115.29 129.04 56.5 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 178.445 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 781' ' ' TRP . . . . . 0.671 ' HA ' ' HG3' ' A' ' 775' ' ' GLU . 26.6 m95 -134.3 144.58 48.4 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 -179.356 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 782' ' ' VAL . . . . . 0.877 HG13 ' HA ' ' A' ' 774' ' ' LEU . 10.7 m -134.55 151.76 32.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 120.834 0.35 . . . . 0.0 110.63 172.613 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 783' ' ' HIS . . . . . 0.443 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.3 OUTLIER -162.98 121.88 2.12 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.664 176.362 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 784' ' ' SER . . . . . 0.564 ' HA ' ' O ' ' A' ' 766' ' ' CYS . 0.3 OUTLIER -88.65 100.91 13.47 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.582 177.274 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 785' ' ' VAL . . . . . 0.893 HG13 ' H ' ' A' ' 787' ' ' ALA . 2.0 p 178.55 170.34 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.158 -0.473 . . . . 0.0 109.893 -173.501 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 786' ' ' ALA . . . . . 0.49 ' HA ' HD11 ' A' ' 718' ' ' LEU . . . -103.59 32.23 3.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.575 0.226 . . . . 0.0 111.265 179.83 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 787' ' ' ALA . . . . . 0.893 ' H ' HG13 ' A' ' 785' ' ' VAL . . . 57.2 70.45 1.36 Allowed Pre-proline 0 N--CA 1.468 0.43 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.145 177.906 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 788' ' ' PRO . . . . . 0.615 ' HD2' ' OE1' ' A' ' 790' ' ' GLU . 24.2 Cg_exo -63.29 -50.15 3.9 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.727 2.284 . . . . 0.0 112.534 -178.213 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 6.5 p-80 -177.12 -29.5 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -178.01 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 790' ' ' GLU . . . . . 0.615 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -74.22 -50.38 19.37 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 111.833 0.308 . . . . 0.0 111.833 -171.105 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 791' ' ' LEU . . . . . 0.487 ' N ' ' HD2' ' A' ' 792' ' ' PRO . 0.2 OUTLIER -65.4 -47.47 69.44 Favored Pre-proline 0 CA--C 1.538 0.503 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -176.81 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 792' ' ' PRO . . . . . 0.487 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 9.2 Cg_endo -58.35 -32.01 95.15 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 121.254 1.302 . . . . 0.0 112.03 174.013 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -70.45 -37.0 74.26 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 120.83 0.347 . . . . 0.0 110.749 177.222 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 794' ' ' LEU . . . . . 0.413 HD13 ' HG2' ' A' ' 797' ' ' ARG . 0.1 OUTLIER -61.51 -42.26 98.55 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.021 176.016 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 795' ' ' LEU . . . . . 0.438 HD22 ' HA ' ' A' ' 795' ' ' LEU . 0.1 OUTLIER -59.66 -42.56 93.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.395 178.354 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -64.76 -37.64 88.27 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.002 178.478 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 797' ' ' ARG . . . . . 0.413 ' HG2' HD13 ' A' ' 794' ' ' LEU . 0.0 OUTLIER -70.3 -26.5 63.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.393 179.075 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -69.12 -36.45 73.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.35 0.595 . . . . 0.0 109.915 177.137 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -77.34 -18.53 57.35 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.195 177.27 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 800' ' ' LEU . . . . . 0.718 ' HB3' ' HG2' ' A' ' 802' ' ' GLU . 2.9 tp 73.02 -41.04 0.49 Allowed 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 124.244 1.018 . . . . 0.0 112.904 175.455 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 801' ' ' ILE . . . . . 0.894 ' HA ' HD13 ' A' ' 704' ' ' LEU . 2.2 mt 55.57 56.97 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.903 0.859 . . . . 0.0 110.159 -175.454 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 802' ' ' GLU . . . . . 0.718 ' HG2' ' HB3' ' A' ' 800' ' ' LEU . 0.0 OUTLIER -79.85 -0.41 34.6 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.81 -177.572 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 803' ' ' MET . . . . . 0.537 ' SD ' ' HA2' ' A' ' 703' ' ' GLY . 45.5 mmm 67.31 161.56 0.17 Allowed 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.432 -0.804 . . . . 0.0 112.109 179.079 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 804' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -115.79 -163.7 0.91 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.803 -178.314 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -88.57 172.83 9.02 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.574 -179.673 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 20.4 t0 -77.19 88.03 3.65 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 177.252 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -56.18 117.66 17.39 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.585 -176.157 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 808' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -65.73 118.8 5.79 Favored 'Trans proline' 0 C--O 1.235 0.329 0 C-N-CA 122.71 2.273 . . . . 0.0 111.749 177.871 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -73.87 165.27 25.43 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.075 -179.303 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -97.59 84.15 3.35 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.476 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -92.85 140.95 28.97 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.029 177.226 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.09 137.01 40.4 Favored Pre-proline 0 C--N 1.323 -0.572 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.252 -176.337 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -85.14 -150.39 0.04 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 122.83 2.353 . . . . 0.0 111.059 171.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 6.5 m -69.14 93.7 0.62 Allowed 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 121.311 0.576 . . . . 0.0 109.927 177.621 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -95.67 170.38 9.37 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.677 -177.112 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.23 121.55 15.92 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 178.154 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 817' ' ' LYS . . . . . 0.443 ' HD3' ' HA ' ' A' ' 817' ' ' LYS . 9.0 mmtp -69.01 -38.47 79.26 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.786 -176.796 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -136.85 155.98 49.08 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.162 177.827 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 2.8 t -94.95 142.11 14.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 175.172 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -50.76 148.11 4.3 Favored 'General case' 0 C--O 1.241 0.615 0 O-C-N 123.602 0.563 . . . . 0.0 112.061 -176.571 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 20.0 p-10 -74.18 61.59 0.87 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.479 178.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -77.82 56.57 1.55 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.438 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -101.41 109.61 21.47 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.224 -0.898 . . . . 0.0 108.999 177.693 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -112.99 -68.79 0.9 Allowed 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.353 -178.393 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 17.5 ttm -109.8 108.25 18.51 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.734 178.582 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 826' ' ' MET . . . . . 0.404 ' O ' HG23 ' A' ' 869' ' ' ILE . 0.5 OUTLIER -95.72 108.79 21.13 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.19 0.519 . . . . 0.0 110.139 -179.346 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 827' ' ' ILE . . . . . . . . . . . . . 1.6 mt -110.32 125.65 67.57 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.299 179.112 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 828' ' ' LEU . . . . . 0.519 HD23 ' HB3' ' A' ' 852' ' ' LYS . 1.7 tm? -94.9 123.09 38.17 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.859 -178.126 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -117.93 118.03 56.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.05 0.452 . . . . 0.0 110.651 179.704 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 830' ' ' VAL . . . . . 0.817 HG23 ' HA ' ' A' ' 874' ' ' SER . 0.0 OUTLIER -119.52 84.92 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.498 178.497 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 831' ' ' ASP . . . . . 0.918 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 27.1 t0 -95.28 120.62 35.82 Favored 'General case' 0 CA--C 1.515 -0.39 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 -179.685 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 832' ' ' ASP . . . . . 0.474 ' OD2' ' HB2' ' A' ' 877' ' ' ASN . 0.0 OUTLIER -52.69 -27.49 17.68 Favored 'General case' 0 CA--C 1.537 0.466 0 O-C-N 123.482 0.489 . . . . 0.0 112.187 -177.582 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 833' ' ' HIS . . . . . 0.441 ' HA ' ' HD2' ' A' ' 834' ' ' PRO . 0.5 OUTLIER -98.43 109.56 53.09 Favored Pre-proline 0 C--N 1.325 -0.471 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 -177.99 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 834' ' ' PRO . . . . . 0.441 ' HD2' ' HA ' ' A' ' 833' ' ' HIS . 9.5 Cg_endo -51.59 -44.18 45.77 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 123.443 2.762 . . . . 0.0 113.445 -175.819 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 835' ' ' ILE . . . . . 0.47 ' HA ' HD13 ' A' ' 835' ' ' ILE . 0.2 OUTLIER -68.32 -39.17 80.56 Favored 'Isoleucine or valine' 0 C--O 1.237 0.415 0 CA-C-O 120.754 0.311 . . . . 0.0 110.972 -177.222 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 836' ' ' ASN . . . . . 0.565 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 1.2 t-20 -73.55 -39.83 64.42 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 179.618 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 837' ' ' ARG . . . . . 0.918 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 1.5 ttt180 -53.85 -42.62 68.74 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.171 176.473 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.56 -43.52 89.6 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.839 178.841 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.38 -48.17 71.0 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.143 -172.834 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 840' ' ' LEU . . . . . 0.565 ' HG ' ' O ' ' A' ' 836' ' ' ASN . 0.3 OUTLIER -74.38 -27.27 60.58 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.502 -0.479 . . . . 0.0 111.016 -179.072 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -68.88 -29.9 68.29 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.138 0.494 . . . . 0.0 109.848 175.364 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -64.77 -42.55 95.02 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.729 174.842 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 843' ' ' GLN . . . . . 0.584 ' HG2' HD23 ' A' ' 929' ' ' LEU . 41.5 mt-30 -62.75 -45.49 92.47 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.267 175.859 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 844' ' ' LEU . . . . . 0.613 HD12 HD11 ' A' ' 932' ' ' ILE . 0.1 OUTLIER -58.24 -46.16 86.43 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.244 179.008 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -64.15 -39.75 97.43 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 121.09 -0.576 . . . . 0.0 112.365 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 5.8 m -67.26 -23.44 65.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.884 0.373 . . . . 0.0 110.959 179.101 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 81.4 mt -75.13 -21.43 58.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.927 0.394 . . . . 0.0 110.455 177.445 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 106.62 3.7 37.28 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.618 177.494 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 849' ' ' TYR . . . . . 0.584 ' HB2' HD23 ' A' ' 844' ' ' LEU . 39.2 m-85 -95.55 140.4 30.45 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.936 0.398 . . . . 0.0 110.753 -178.305 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 5.3 mp0 -76.43 115.66 16.38 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.066 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 851' ' ' CYS . . . . . 0.471 ' HB3' HD22 ' A' ' 844' ' ' LEU . 0.0 OUTLIER -107.97 135.51 49.23 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.774 -175.32 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 852' ' ' LYS . . . . . 0.519 ' HB3' HD23 ' A' ' 828' ' ' LEU . 0.0 OUTLIER -107.17 110.74 22.89 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 173.463 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 853' ' ' THR . . . . . 0.616 HG22 ' HG3' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -90.69 121.55 32.69 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.991 -0.55 . . . . 0.0 112.479 -171.563 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 854' ' ' ALA . . . . . 0.462 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -147.97 171.27 16.07 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.062 174.688 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 13.9 p-10 -144.95 75.8 1.46 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.754 0.788 . . . . 0.0 111.258 178.142 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 856' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -171.41 136.1 0.98 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.49 177.323 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -66.69 -41.44 93.83 Favored Glycine 0 N--CA 1.448 -0.512 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.895 -178.633 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 858' ' ' VAL . . . . . 0.404 ' H ' HG23 ' A' ' 858' ' ' VAL . 1.5 t -74.29 -36.24 42.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.645 0.26 . . . . 0.0 111.285 -177.418 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -63.18 -23.95 67.66 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.847 0.356 . . . . 0.0 111.196 -179.194 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -61.82 -35.61 78.73 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.151 0.5 . . . . 0.0 110.347 176.007 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 861' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.05 -35.8 61.87 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.478 177.074 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -63.01 -49.32 75.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.528 179.106 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 6.5 p -66.13 -31.3 53.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.941 178.862 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 864' ' ' LEU . . . . . 0.662 ' HG ' HD11 ' A' ' 895' ' ' LEU . 0.7 OUTLIER -59.55 -40.77 88.37 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.061 0.458 . . . . 0.0 110.327 175.041 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 1.5 m -79.27 -30.22 42.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.99 -179.135 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.44 -60.53 2.37 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.309 0.576 . . . . 0.0 110.773 178.489 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 867' ' ' ASN . . . . . 0.452 ' HB3' ' H ' ' A' ' 868' ' ' HIS . 1.4 t-20 -104.95 -119.44 0.22 Allowed 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 177.914 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 868' ' ' HIS . . . . . 0.452 ' H ' ' HB3' ' A' ' 867' ' ' ASN . 0.1 OUTLIER -163.8 -45.58 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 110.499 -0.186 . . . . 0.0 110.499 173.183 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 869' ' ' ILE . . . . . 0.447 ' HB ' ' O ' ' A' ' 868' ' ' HIS . 2.7 mp 73.32 146.93 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 O-C-N 123.613 0.571 . . . . 0.0 111.293 174.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 65.2 m-20 -85.54 -49.97 7.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.204 0.526 . . . . 0.0 110.672 -179.491 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 871' ' ' ILE . . . . . 0.69 HG12 ' HD2' ' A' ' 939' ' ' TYR . 0.8 OUTLIER -135.42 133.64 52.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.936 -0.575 . . . . 0.0 109.905 -179.729 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 872' ' ' VAL . . . . . 0.43 HG13 HD12 ' A' ' 828' ' ' LEU . 64.6 t -115.87 127.94 73.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.592 -178.315 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 873' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -120.14 115.07 22.93 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.144 0.497 . . . . 0.0 110.196 175.298 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 874' ' ' SER . . . . . 0.817 ' HA ' HG23 ' A' ' 830' ' ' VAL . 0.3 OUTLIER -100.19 125.93 46.4 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.162 179.364 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 875' ' ' ASP . . . . . 0.732 ' HB3' ' HA ' ' A' ' 831' ' ' ASP . 1.2 t70 -109.6 123.89 50.22 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.336 0.588 . . . . 0.0 111.012 -179.291 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 876' ' ' VAL . . . . . 0.421 HG23 HG23 ' A' ' 903' ' ' THR . 0.1 OUTLIER -116.29 94.56 3.18 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.285 177.827 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 877' ' ' ASN . . . . . 0.474 ' HB2' ' OD2' ' A' ' 832' ' ' ASP . 68.6 m-80 -63.11 -27.18 69.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.792 174.28 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 878' ' ' MET . . . . . 0.527 ' SD ' ' HB3' ' A' ' 880' ' ' ASN . 0.0 OUTLIER -120.74 104.65 41.88 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.447 174.893 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 879' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -70.4 -13.75 33.38 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.885 2.39 . . . . 0.0 112.731 -177.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 880' ' ' ASN . . . . . 0.527 ' HB3' ' SD ' ' A' ' 878' ' ' MET . 21.7 t30 -75.18 127.05 32.3 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.092 -178.542 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 20.4 ttp 73.25 -65.67 0.34 Allowed 'General case' 0 N--CA 1.467 0.375 0 O-C-N 123.914 0.759 . . . . 0.0 111.708 175.21 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 882' ' ' ASP . . . . . 0.402 ' C ' ' H ' ' A' ' 884' ' ' TYR . 0.4 OUTLIER -70.81 -34.11 71.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.586 0.231 . . . . 0.0 110.572 -177.129 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -77.3 40.89 1.77 Allowed Glycine 0 C--N 1.331 0.264 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.017 176.193 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 884' ' ' TYR . . . . . 0.402 ' H ' ' C ' ' A' ' 882' ' ' ASP . 8.7 t80 -160.78 -49.01 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 179.453 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -61.6 -46.48 89.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.877 179.436 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.93 -43.9 82.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.72 -178.031 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.23 -47.2 83.5 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.242 -179.021 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -59.41 -44.21 92.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.11 -179.314 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -70.13 -38.28 75.52 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.298 -177.518 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 890' ' ' ILE . . . . . 0.702 HG23 HD13 ' A' ' 895' ' ' LEU . 9.8 mt -59.63 -49.21 84.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.041 0.448 . . . . 0.0 110.985 -179.909 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 891' ' ' ARG . . . . . . . . . . . . . 35.9 ptt85 -75.69 -23.67 56.18 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.102 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.25 -44.66 94.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.158 176.854 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.15 -31.06 64.04 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.943 174.55 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 90.7 66.64 1.18 Allowed Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.25 177.088 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 895' ' ' LEU . . . . . 0.702 HD13 HG23 ' A' ' 890' ' ' ILE . 0.1 OUTLIER -65.78 111.54 3.29 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 110.016 -0.365 . . . . 0.0 110.016 177.889 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.63 -11.99 54.86 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.755 -175.668 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 897' ' ' LEU . . . . . 0.599 HD11 HD21 ' A' ' 864' ' ' LEU . 0.0 OUTLIER -92.64 148.03 35.37 Favored Pre-proline 0 C--N 1.323 -0.548 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.403 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -60.08 128.62 27.11 Favored 'Trans proline' 0 C--O 1.239 0.552 0 C-N-CA 122.844 2.363 . . . . 0.0 112.731 -177.274 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 899' ' ' VAL . . . . . 0.695 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 1.8 t -111.56 129.55 66.73 Favored 'Isoleucine or valine' 0 C--O 1.236 0.387 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.922 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 900' ' ' ILE . . . . . 0.505 HG12 ' CE2' ' A' ' 939' ' ' TYR . 0.0 OUTLIER -107.57 111.31 35.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.096 176.978 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -97.0 105.97 3.28 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.14 -177.201 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 902' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -93.32 130.41 42.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 177.611 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 903' ' ' THR . . . . . 0.642 HG21 ' HG2' ' A' ' 909' ' ' GLU . 0.2 OUTLIER -123.46 138.36 54.6 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.199 -178.431 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 904' ' ' ALA . . . . . 0.829 ' HA ' ' HB2' ' A' ' 925' ' ' LYS . . . -79.08 117.26 19.97 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.973 176.799 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 61.73 54.93 2.81 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-O 121.327 0.584 . . . . 0.0 110.323 -178.552 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 906' ' ' ALA . . . . . 0.485 ' HB1' ' HB2' ' A' ' 909' ' ' GLU . . . -69.94 85.23 0.51 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.465 178.732 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 907' ' ' LEU . . . . . 0.464 HD13 ' HA ' ' A' ' 907' ' ' LEU . 0.8 OUTLIER -83.91 -41.1 17.75 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.891 -178.979 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -127.7 4.02 6.1 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-O 121.412 0.625 . . . . 0.0 110.472 -178.378 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 909' ' ' GLU . . . . . 0.642 ' HG2' HG21 ' A' ' 903' ' ' THR . 5.7 mp0 -69.7 -17.01 63.44 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.794 -173.136 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 910' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.11 -37.8 84.51 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.14 0.495 . . . . 0.0 109.921 176.393 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.07 -34.42 66.24 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.806 177.186 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 6.4 mm100 -65.06 -36.82 85.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.483 177.036 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -62.34 -41.45 98.59 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.454 177.182 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 58.8 m -70.89 -31.15 67.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.748 178.783 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 915' ' ' LEU . . . . . 0.419 HD12 ' HA ' ' A' ' 915' ' ' LEU . 2.9 tp -70.67 -52.12 23.2 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.065 -179.881 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -74.18 -44.76 52.2 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.336 -177.302 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 51.22 46.6 26.22 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.336 -175.546 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -115.89 24.86 9.86 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.785 -177.127 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 919' ' ' MET . . . . . 0.695 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -141.15 -94.71 0.14 Allowed 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.955 -0.298 . . . . 0.0 110.878 -177.876 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 920' ' ' ASP . . . . . 0.489 ' H ' ' CG ' ' A' ' 919' ' ' MET . 29.7 t70 171.42 -57.2 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 123.934 0.894 . . . . 0.0 108.656 176.176 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -133.17 163.13 29.96 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.517 176.046 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 922' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -123.94 136.63 54.45 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.412 176.466 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 923' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -123.45 173.45 8.0 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.554 -179.094 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 924' ' ' SER . . . . . 0.812 ' HB2' ' HD2' ' A' ' 926' ' ' PRO . 0.4 OUTLIER -95.11 158.77 15.32 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.336 179.709 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 925' ' ' LYS . . . . . 0.829 ' HB2' ' HA ' ' A' ' 904' ' ' ALA . 0.0 OUTLIER -60.34 -46.95 97.64 Favored Pre-proline 0 CA--C 1.538 0.516 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.544 173.537 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 926' ' ' PRO . . . . . 0.812 ' HD2' ' HB2' ' A' ' 924' ' ' SER . 52.8 Cg_exo -58.05 88.82 0.05 OUTLIER 'Trans proline' 0 C--N 1.36 1.142 0 C-N-CA 122.161 1.907 . . . . 0.0 112.552 174.122 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 12.6 t -128.56 114.62 34.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.225 177.709 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.74 -177.08 3.37 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.83 -179.088 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 929' ' ' LEU . . . . . 0.584 HD23 ' HG2' ' A' ' 843' ' ' GLN . 1.0 OUTLIER -54.07 -45.75 71.81 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 111.917 0.339 . . . . 0.0 111.917 -175.994 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.98 -36.19 81.62 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.131 0.491 . . . . 0.0 110.669 -177.499 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 69.2 t -76.01 -43.0 38.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.588 -175.249 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 932' ' ' ILE . . . . . 0.613 HD11 HD12 ' A' ' 844' ' ' LEU . 15.4 tt -63.01 -38.95 83.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 178.524 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 2.2 tmmt? -65.12 -48.42 73.68 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.407 178.179 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -59.26 -49.33 78.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.328 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 17.6 m -64.92 -44.02 90.91 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.526 -178.394 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 936' ' ' LEU . . . . . 0.496 HD21 ' HG ' ' A' ' 844' ' ' LEU . 0.8 OUTLIER -62.62 -43.33 99.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.452 179.7 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 937' ' ' THR . . . . . 0.421 ' O ' ' HG2' ' A' ' 941' ' ' GLU . 27.5 m -68.34 -36.25 78.97 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.208 -179.776 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 3.5 tp -64.55 -35.42 80.93 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.956 0.408 . . . . 0.0 110.748 178.493 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 939' ' ' TYR . . . . . 0.69 ' HD2' HG12 ' A' ' 871' ' ' ILE . 1.1 m-85 -79.17 -36.6 40.06 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.732 178.72 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -64.91 -41.6 95.44 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.928 179.211 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 941' ' ' GLU . . . . . 0.421 ' HG2' ' O ' ' A' ' 937' ' ' THR . 9.7 pt-20 -69.06 -36.07 77.26 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.159 -0.312 . . . . 0.0 110.159 177.518 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 942' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -49.17 78.48 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.801 179.093 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 30.9 m -72.38 -30.61 35.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 C-N-CA 120.821 -0.351 . . . . 0.0 110.717 179.774 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 1.9 ttt-85 -63.56 -50.34 69.89 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.895 179.246 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.07 -19.89 61.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.856 0.36 . . . . 0.0 111.278 -178.141 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 17.6 m -81.37 -24.84 36.76 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.061 0.457 . . . . 0.0 110.416 175.6 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -84.05 -53.51 5.49 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.2 0.524 . . . . 0.0 110.443 178.502 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -141.45 145.01 34.73 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.659 -174.73 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 71.4 m . . . . . 0 C--O 1.247 0.921 0 CA-C-O 118.786 -0.625 . . . . 0.0 109.369 176.628 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.48 1.043 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 84.38 -100.19 2.33 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.556 -0.83 . . . . 0.0 111.066 -175.486 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . 121.21 -32.01 4.88 Favored Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.675 175.211 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.43 138.64 47.27 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.034 0.445 . . . . 0.0 110.728 179.707 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . 179.2 150.52 9.02 Favored Glycine 0 N--CA 1.445 -0.749 0 N-CA-C 110.894 -0.882 . . . . 0.0 110.894 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 2.6 t 54.19 53.51 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-O 121.529 0.681 . . . . 0.0 110.196 -177.359 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -83.08 -12.49 57.07 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.933 -178.422 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . 162.9 -48.97 0.32 Allowed Glycine 0 N--CA 1.448 -0.561 0 CA-C-N 115.866 -0.607 . . . . 0.0 111.806 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 20.0 mt -104.58 -177.92 3.51 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 178.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 59.97 34.48 21.52 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 121.1 0.476 . . . . 0.0 110.995 -178.286 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . -173.31 19.51 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.951 -0.643 . . . . 0.0 112.159 -179.787 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 8.6 mmtm -121.45 145.59 47.77 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 178.179 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 708' ' ' ARG . . . . . 0.523 ' HG2' HG13 ' A' ' 732' ' ' VAL . 24.3 mtm180 -102.13 161.77 13.43 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.372 0.605 . . . . 0.0 110.685 -178.549 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 1.6 m -135.77 110.5 8.68 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.241 -0.891 . . . . 0.0 108.822 170.552 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 710' ' ' TRP . . . . . 0.51 ' CZ3' ' HB ' ' A' ' 734' ' ' THR . 97.2 m95 -90.53 103.77 16.43 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.951 -175.489 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 711' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 711' ' ' LEU . 0.8 OUTLIER -102.3 120.48 40.56 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 121.596 0.713 . . . . 0.0 110.655 -177.969 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -104.29 43.46 1.1 Allowed 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.355 -0.839 . . . . 0.0 108.926 175.018 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 713' ' ' VAL . . . . . 0.746 ' HA ' ' CB ' ' A' ' 750' ' ' ASP . 16.4 t -101.42 124.18 54.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.426 -177.8 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 5.5 mtm-85 -108.43 0.57 21.12 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.404 0.621 . . . . 0.0 110.115 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -82.09 111.11 17.93 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.436 173.099 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -54.46 -55.03 33.09 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -171.685 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 717' ' ' SER . . . . . 0.417 ' O ' ' HB2' ' A' ' 721' ' ' PHE . 0.3 OUTLIER -60.4 -36.97 79.37 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.174 0.511 . . . . 0.0 110.926 -178.66 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 718' ' ' LEU . . . . . 0.594 ' HG ' ' HB2' ' A' ' 787' ' ' ALA . 0.9 OUTLIER -73.97 -49.81 22.82 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.206 -177.547 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 719' ' ' CYS . . . . . 0.452 ' O ' ' HB3' ' A' ' 723' ' ' GLU . 19.7 p -67.7 -44.09 78.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.622 -176.393 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.6 -43.65 98.47 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.101 -179.035 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 721' ' ' PHE . . . . . 0.417 ' HB2' ' O ' ' A' ' 717' ' ' SER . 0.8 OUTLIER -58.62 -55.97 28.2 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.911 0.386 . . . . 0.0 111.058 -179.806 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.36 -44.81 93.74 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.127 -177.214 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 723' ' ' GLU . . . . . 0.612 ' HA ' HG11 ' A' ' 733' ' ' VAL . 0.4 OUTLIER -60.68 -48.26 82.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.288 -176.247 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 724' ' ' THR . . . . . . . . . . . . . 8.3 m -63.48 -36.99 85.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.995 0.426 . . . . 0.0 111.087 -177.843 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 725' ' ' SER . . . . . 0.451 ' HA ' ' HD3' ' A' ' 728' ' ' ARG . 12.4 m -70.09 -37.11 75.32 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.203 -179.921 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 726' ' ' LEU . . . . . . . . . . . . . 20.9 mt -75.15 -43.94 49.6 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.239 -177.445 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -69.04 -10.63 58.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.133 0.492 . . . . 0.0 111.029 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 728' ' ' ARG . . . . . 0.451 ' HD3' ' HA ' ' A' ' 725' ' ' SER . 0.0 OUTLIER -67.84 -33.05 74.02 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.303 176.6 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.31 5.94 49.81 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.655 -176.152 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 730' ' ' GLY . . . . . . . . . . . . . . . 86.98 14.66 64.27 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.439 -0.886 . . . . 0.0 112.422 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 731' ' ' ILE . . . . . . . . . . . . . 14.9 mm -86.63 129.41 38.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 174.113 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 732' ' ' VAL . . . . . 0.523 HG13 ' HG2' ' A' ' 708' ' ' ARG . 1.4 p -83.97 103.94 11.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.636 0.731 . . . . 0.0 110.441 -177.426 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 733' ' ' VAL . . . . . 0.612 HG11 ' HA ' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -80.71 115.41 23.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.358 178.543 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 734' ' ' THR . . . . . 0.51 ' HB ' ' CZ3' ' A' ' 710' ' ' TRP . 0.2 OUTLIER -122.9 131.22 53.64 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.431 -177.605 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.27 122.53 17.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.304 -179.06 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 736' ' ' TYR . . . . . 0.446 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 21.8 t80 -86.57 98.0 10.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.157 0.504 . . . . 0.0 110.919 -178.572 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -95.71 -28.64 14.69 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.382 174.359 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 161.2 52.96 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.512 0 N-CA-C 110.774 -0.93 . . . . 0.0 110.774 179.394 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 8.4 mp0 -101.75 -171.32 1.96 Allowed 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -171.149 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 740' ' ' GLU . . . . . 0.5 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 1.0 OUTLIER -69.5 134.68 88.61 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.799 -176.719 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 741' ' ' PRO . . . . . 0.5 ' HD3' ' HA ' ' A' ' 740' ' ' GLU . 3.9 Cg_endo -88.42 137.41 3.58 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 123.478 2.785 . . . . 0.0 111.614 174.017 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 742' ' ' THR . . . . . 0.658 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.2 OUTLIER -131.55 140.21 37.67 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-O 120.777 0.322 . . . . 0.0 111.082 -179.362 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 743' ' ' PRO . . . . . 0.658 ' HD2' HG22 ' A' ' 742' ' ' THR . 38.3 Cg_endo -66.13 -11.19 30.11 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 123.364 2.71 . . . . 0.0 113.254 -177.401 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -108.95 2.71 21.58 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.05 0.453 . . . . 0.0 110.399 178.328 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 745' ' ' ASP . . . . . 0.444 ' CG ' ' HB2' ' A' ' 708' ' ' ARG . 56.5 m-20 -109.63 152.04 26.06 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.45 -175.625 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 746' ' ' VAL . . . . . 0.658 HG21 HD11 ' A' ' 795' ' ' LEU . 29.2 m -120.25 147.02 24.23 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.082 -178.159 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 747' ' ' LEU . . . . . 0.56 HD12 ' HB2' ' A' ' 757' ' ' TRP . 0.3 OUTLIER -105.05 108.72 20.38 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.112 177.153 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 19.8 mt -94.56 106.54 18.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 N-CA-C 108.82 -0.808 . . . . 0.0 108.82 173.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.94 153.76 19.24 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 116.056 -0.52 . . . . 0.0 112.23 -170.842 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 750' ' ' ASP . . . . . 0.746 ' CB ' ' HA ' ' A' ' 713' ' ' VAL . 9.3 t0 -113.27 113.41 25.25 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 175.361 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 751' ' ' GLU . . . . . 0.552 ' HG3' ' H ' ' A' ' 752' ' ' VAL . 3.1 tp10 68.15 -173.71 0.19 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.274 179.754 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 752' ' ' VAL . . . . . 0.552 ' H ' ' HG3' ' A' ' 751' ' ' GLU . 0.9 OUTLIER -61.0 127.17 20.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.5 178.092 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 8.8 p -114.93 -12.91 11.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.896 179.256 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 6.6 m 55.53 53.43 9.72 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.404 -178.193 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.03 167.96 28.6 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.407 178.612 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 756' ' ' LYS . . . . . 0.464 ' O ' ' HB3' ' A' ' 757' ' ' TRP . 6.1 tptm -111.3 -40.16 4.49 Favored 'General case' 0 C--N 1.322 -0.587 0 O-C-N 123.118 0.261 . . . . 0.0 110.705 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 757' ' ' TRP . . . . . 0.56 ' HB2' HD12 ' A' ' 747' ' ' LEU . 5.5 t-105 73.11 134.86 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.294 0 O-C-N 124.094 0.871 . . . . 0.0 111.005 179.024 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -114.0 115.4 27.55 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.065 178.014 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 759' ' ' GLY . . . . . . . . . . . . . . . -177.25 -139.65 3.37 Favored Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.826 -0.702 . . . . 0.0 111.813 -178.603 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 8.2 ttt180 -79.22 -54.5 5.91 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.885 0.374 . . . . 0.0 110.08 177.025 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -162.69 163.95 26.71 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.583 179.395 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 2.5 p -131.88 126.43 56.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.233 -0.44 . . . . 0.0 109.996 176.804 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 1.9 t -119.97 109.59 26.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.953 -178.577 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 764' ' ' THR . . . . . 0.412 ' O ' ' HA ' ' A' ' 782' ' ' VAL . 42.5 m -104.35 121.29 43.05 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.169 0.509 . . . . 0.0 112.072 -174.909 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 765' ' ' PHE . . . . . 0.448 ' CE1' HD22 ' A' ' 791' ' ' LEU . 29.9 m-85 -75.98 150.21 37.47 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 171.772 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -132.75 137.8 46.97 Favored 'General case' 0 C--N 1.318 -0.803 0 C-N-CA 120.923 -0.311 . . . . 0.0 110.591 179.65 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 767' ' ' ARG . . . . . 0.506 ' HB2' ' OE1' ' A' ' 751' ' ' GLU . 6.6 mmm-85 -117.78 43.73 2.33 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.162 0.506 . . . . 0.0 109.732 175.786 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 70.69 12.0 7.24 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 114.976 -1.011 . . . . 0.0 112.331 176.671 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 769' ' ' HIS . . . . . 0.512 ' HB2' ' CD ' ' A' ' 751' ' ' GLU . 41.1 m80 -102.8 60.66 0.8 Allowed 'General case' 0 C--N 1.328 -0.345 0 O-C-N 122.219 -0.301 . . . . 0.0 110.391 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 49.6 mt 73.11 130.45 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.101 -178.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -92.91 145.25 17.51 Favored Glycine 0 N--CA 1.444 -0.81 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.973 -179.037 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 772' ' ' ILE . . . . . 0.961 HG13 ' HD2' ' A' ' 773' ' ' PRO . 1.0 OUTLIER -89.31 161.9 38.69 Favored Pre-proline 0 C--N 1.323 -0.563 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 174.658 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 773' ' ' PRO . . . . . 0.961 ' HD2' HG13 ' A' ' 772' ' ' ILE . 10.3 Cg_endo -54.37 125.39 18.76 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.512 2.141 . . . . 0.0 112.581 177.021 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 774' ' ' LEU . . . . . 0.553 ' HB3' HG22 ' A' ' 782' ' ' VAL . 0.8 OUTLIER -93.29 -151.0 0.29 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.162 178.486 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 775' ' ' GLU . . . . . 0.536 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 2.8 mp0 -68.68 50.76 0.07 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.85 0.833 . . . . 0.0 112.947 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 776' ' ' LYS . . . . . 0.446 ' HG2' ' H ' ' A' ' 776' ' ' LYS . 0.0 OUTLIER -103.88 2.12 32.23 Favored 'General case' 0 C--N 1.308 -1.207 0 N-CA-C 107.152 -1.425 . . . . 0.0 107.152 168.342 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 777' ' ' ALA . . . . . 0.446 ' HB1' ' CD ' ' A' ' 778' ' ' PRO . . . -136.51 170.36 11.08 Favored Pre-proline 0 N--CA 1.447 -0.62 0 CA-C-N 113.816 -1.538 . . . . 0.0 109.003 -179.181 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 778' ' ' PRO . . . . . 0.446 ' CD ' ' HB1' ' A' ' 777' ' ' ALA . 31.1 Cg_exo -59.6 -26.94 83.69 Favored 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 122.943 2.429 . . . . 0.0 115.707 -169.011 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . -155.47 32.28 0.64 Allowed Glycine 0 C--N 1.331 0.266 0 C-N-CA 119.777 -1.201 . . . . 0.0 112.671 -174.39 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 780' ' ' GLU . . . . . 0.536 ' O ' ' HG3' ' A' ' 775' ' ' GLU . 10.9 mp0 -103.62 130.04 51.01 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 -177.592 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 22.9 m95 -134.94 151.64 51.03 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.655 -0.248 . . . . 0.0 110.438 -176.492 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 782' ' ' VAL . . . . . 0.553 HG22 ' HB3' ' A' ' 774' ' ' LEU . 35.2 m -139.33 157.72 27.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.377 173.643 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 783' ' ' HIS . . . . . 0.4 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 2.6 t-160 -167.3 121.63 1.01 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.97 0.414 . . . . 0.0 110.633 173.484 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -90.37 101.38 14.11 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.476 176.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -157.84 179.39 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.937 179.48 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -108.12 31.81 5.26 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.013 179.682 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 787' ' ' ALA . . . . . 0.594 ' HB2' ' HG ' ' A' ' 718' ' ' LEU . . . 63.6 71.74 0.6 Allowed Pre-proline 0 C--O 1.232 0.141 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.8 178.032 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 788' ' ' PRO . . . . . 0.469 ' HB2' ' H ' ' A' ' 789' ' ' HIS . 5.9 Cg_exo -79.95 -119.25 0.01 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 123.033 2.489 . . . . 0.0 110.885 172.455 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 789' ' ' HIS . . . . . 0.583 ' HA ' ' HG2' ' A' ' 792' ' ' PRO . 0.4 OUTLIER -130.77 12.57 5.3 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.037 -0.665 . . . . 0.0 111.835 175.993 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 790' ' ' GLU . . . . . 0.44 ' HG3' ' H ' ' A' ' 790' ' ' GLU . 0.0 OUTLIER -83.95 -54.02 5.16 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.103 -179.275 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 791' ' ' LEU . . . . . 0.521 ' N ' ' HD2' ' A' ' 792' ' ' PRO . 0.3 OUTLIER -63.31 -47.38 84.58 Favored Pre-proline 0 CA--C 1.535 0.396 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 179.32 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 792' ' ' PRO . . . . . 0.583 ' HG2' ' HA ' ' A' ' 789' ' ' HIS . 9.4 Cg_endo -55.81 -29.95 74.34 Favored 'Trans proline' 0 C--N 1.357 0.975 0 C-N-CA 121.775 1.65 . . . . 0.0 112.19 175.102 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -69.24 -41.23 77.27 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-O 120.881 0.372 . . . . 0.0 110.317 176.431 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.71 -43.33 97.96 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.825 176.23 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 795' ' ' LEU . . . . . 0.658 HD11 HG21 ' A' ' 746' ' ' VAL . 1.1 mm? -63.34 -45.07 92.94 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.782 178.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 796' ' ' ALA . . . . . 0.832 ' HA ' HD12 ' A' ' 801' ' ' ILE . . . -63.4 -37.38 87.06 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.227 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.91 -34.66 71.76 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.455 -0.338 . . . . 0.0 110.372 178.887 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -62.47 -42.37 95.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.585 179.661 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -88.15 4.63 44.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.766 0.317 . . . . 0.0 110.913 179.743 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 40.1 mt 57.17 46.08 19.52 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.843 178.148 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 801' ' ' ILE . . . . . 0.832 HD12 ' HA ' ' A' ' 796' ' ' ALA . 12.9 mt -73.21 -46.88 49.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 176.682 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 54.62 62.55 2.5 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.663 -0.699 . . . . 0.0 112.096 175.028 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 803' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -134.23 91.65 2.83 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.899 0.38 . . . . 0.0 111.335 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 804' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -142.68 19.09 2.01 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.452 0.644 . . . . 0.0 110.025 177.723 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.14 140.46 30.18 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.636 -174.134 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -160.25 122.48 3.27 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.727 176.023 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -127.76 126.96 24.03 Favored Pre-proline 0 C--N 1.326 -0.443 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -175.814 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 808' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -78.85 88.14 1.48 Allowed 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 122.666 2.244 . . . . 0.0 111.299 172.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -79.99 -37.62 33.89 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.082 -0.508 . . . . 0.0 112.225 -173.31 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 21.2 t30 -108.31 120.49 42.54 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.936 0.398 . . . . 0.0 111.879 -173.32 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -169.74 78.95 0.1 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.439 176.685 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -143.79 102.95 4.91 Favored Pre-proline 0 C--N 1.327 -0.376 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 -171.721 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -91.75 144.07 2.95 Favored 'Trans proline' 0 CA--C 1.535 0.544 0 C-N-CA 123.222 2.615 . . . . 0.0 111.703 170.73 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -141.2 115.97 9.7 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 111.842 0.312 . . . . 0.0 111.842 -179.443 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -157.34 124.47 5.15 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.058 175.314 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -135.39 125.08 25.29 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.864 0.364 . . . . 0.0 110.382 177.835 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.26 61.37 1.03 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.376 0.607 . . . . 0.0 110.134 -177.091 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -93.14 100.78 13.11 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.711 -178.8 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 5.4 p -142.04 143.94 25.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 120.935 0.397 . . . . 0.0 110.672 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -130.6 175.7 8.79 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.442 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -85.53 159.99 19.77 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.016 0.436 . . . . 0.0 110.725 178.308 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 822' ' ' ASN . . . . . 0.535 ' HB3' ' H ' ' A' ' 823' ' ' ASP . 0.6 OUTLIER -84.79 -105.95 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.216 -178.411 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 823' ' ' ASP . . . . . 0.535 ' H ' ' HB3' ' A' ' 822' ' ' ASN . 37.9 t70 50.8 99.32 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.766 0 O-C-N 123.92 0.762 . . . . 0.0 112.513 -176.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -155.51 91.71 1.34 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.133 0.492 . . . . 0.0 110.805 -179.335 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -98.12 101.13 12.52 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.346 177.8 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 826' ' ' MET . . . . . . . . . . . . . 2.6 tpp -104.76 116.54 32.19 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.84 -178.047 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 827' ' ' ILE . . . . . 0.672 ' HB ' HD21 ' A' ' 844' ' ' LEU . 14.4 mm -114.44 137.19 48.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.309 -179.536 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 828' ' ' LEU . . . . . 0.644 HD11 HG13 ' A' ' 863' ' ' VAL . 0.4 OUTLIER -98.24 131.84 44.24 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.709 -179.479 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 829' ' ' VAL . . . . . 0.744 HG23 HD12 ' A' ' 840' ' ' LEU . 0.2 OUTLIER -122.1 104.09 14.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 174.919 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 830' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -120.67 100.57 9.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.196 -177.838 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 831' ' ' ASP . . . . . 0.807 ' HB2' ' HB3' ' A' ' 875' ' ' ASP . 0.2 OUTLIER -117.63 154.4 31.64 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.36 -177.173 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -94.01 -16.42 23.91 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -173.411 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 833' ' ' HIS . . . . . 0.421 ' HB2' ' HB2' ' A' ' 877' ' ' ASN . 1.1 m170 -124.5 98.87 37.05 Favored Pre-proline 0 C--N 1.328 -0.354 0 O-C-N 122.068 -0.395 . . . . 0.0 111.196 -178.427 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_exo -30.64 -39.34 0.06 OUTLIER 'Trans proline' 0 C--N 1.353 0.793 1 C-N-CA 126.032 4.488 . . . . 0.0 116.871 -168.654 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 835' ' ' ILE . . . . . 0.532 ' O ' ' HG3' ' A' ' 838' ' ' ARG . 8.2 tp -59.38 -41.57 84.78 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-N 117.846 0.293 . . . . 0.0 111.689 -176.625 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 836' ' ' ASN . . . . . 0.586 ' HA ' ' HB2' ' A' ' 839' ' ' LEU . 0.8 OUTLIER -79.79 -31.95 40.8 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 -178.802 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 837' ' ' ARG . . . . . 0.435 ' HB2' ' OD2' ' A' ' 831' ' ' ASP . 0.7 OUTLIER -52.73 -48.01 66.98 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.4 176.217 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 838' ' ' ARG . . . . . 0.532 ' HG3' ' O ' ' A' ' 835' ' ' ILE . 0.0 OUTLIER -73.99 -28.72 61.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.737 177.609 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 839' ' ' LEU . . . . . 0.586 ' HB2' ' HA ' ' A' ' 836' ' ' ASN . 0.2 OUTLIER -62.35 -53.92 47.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.728 -0.215 . . . . 0.0 111.442 -178.342 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 840' ' ' LEU . . . . . 0.744 HD12 HG23 ' A' ' 829' ' ' VAL . 0.0 OUTLIER -74.21 -29.55 61.78 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.393 -0.523 . . . . 0.0 110.731 -179.502 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -64.49 -38.65 91.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.233 0.539 . . . . 0.0 110.509 177.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -61.6 -49.53 76.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.408 -0.814 . . . . 0.0 109.941 176.725 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 843' ' ' GLN . . . . . 0.869 ' HG3' HD23 ' A' ' 929' ' ' LEU . 0.0 OUTLIER -58.99 -46.46 88.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.84 -179.811 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 844' ' ' LEU . . . . . 0.672 HD21 ' HB ' ' A' ' 827' ' ' ILE . 0.0 OUTLIER -60.07 -39.87 87.55 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.635 178.073 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -61.71 -39.29 97.22 Favored Glycine 0 N--CA 1.448 -0.506 0 CA-C-N 115.697 -0.683 . . . . 0.0 112.317 176.841 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.24 -30.49 66.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.972 0.415 . . . . 0.0 110.485 179.769 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 29.3 mt -73.98 -21.25 60.07 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.812 178.252 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 86.86 38.28 8.1 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 121.087 -0.578 . . . . 0.0 112.962 175.675 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 849' ' ' TYR . . . . . 0.414 ' HB2' HD23 ' A' ' 844' ' ' LEU . 75.0 m-85 -118.2 150.54 39.23 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 178.263 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -72.25 109.67 6.15 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 179.344 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 851' ' ' CYS . . . . . 0.609 ' HB3' HD22 ' A' ' 844' ' ' LEU . 0.0 OUTLIER -102.15 112.07 24.6 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.241 -174.61 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -86.99 108.9 19.04 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 176.079 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 853' ' ' THR . . . . . 0.422 ' HA ' HG13 ' A' ' 829' ' ' VAL . 0.3 OUTLIER -104.1 123.43 47.24 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.015 0.436 . . . . 0.0 111.89 -171.355 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 854' ' ' ALA . . . . . . . . . . . . . . . -140.16 146.9 39.38 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.474 176.62 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 855' ' ' ASN . . . . . 0.436 ' HA ' ' O ' ' A' ' 831' ' ' ASP . 6.1 t-20 -114.76 76.47 0.99 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.109 0.48 . . . . 0.0 110.479 179.629 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 856' ' ' ASP . . . . . . . . . . . . . 8.8 t0 178.95 167.97 0.93 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.154 178.788 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -91.25 -53.39 2.18 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 121.21 -0.519 . . . . 0.0 111.831 178.344 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 6.6 m -58.23 -32.12 43.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.73 0.3 . . . . 0.0 111.707 -179.653 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -68.23 -20.1 64.79 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.41 -177.906 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -67.39 -39.9 85.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.171 0.51 . . . . 0.0 110.059 176.647 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 861' ' ' LEU . . . . . 0.582 HD11 ' HG ' ' A' ' 893' ' ' LEU . 0.2 OUTLIER -74.31 -37.37 63.64 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.126 176.784 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -65.37 -43.26 91.36 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.137 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 863' ' ' VAL . . . . . 0.644 HG13 HD11 ' A' ' 828' ' ' LEU . 9.3 p -71.88 -31.54 41.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.739 -0.209 . . . . 0.0 110.662 179.229 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 864' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.92 -36.06 71.95 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.175 0.512 . . . . 0.0 109.886 173.546 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 3.6 m -87.13 -16.7 34.67 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.718 178.546 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 866' ' ' LYS . . . . . 0.637 ' HB2' ' HA ' ' A' ' 863' ' ' VAL . 17.8 mttt -70.76 -55.42 8.65 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.39 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -143.67 -174.81 4.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.197 179.225 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -98.03 125.31 42.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.076 0.465 . . . . 0.0 111.354 -177.064 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 869' ' ' ILE . . . . . 0.638 HG21 ' HB2' ' A' ' 828' ' ' LEU . 3.4 mp -122.27 148.54 25.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.825 179.288 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -94.58 -58.79 2.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.782 0.325 . . . . 0.0 111.314 -176.292 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 871' ' ' ILE . . . . . 0.649 HG13 ' HG2' ' A' ' 898' ' ' PRO . 0.9 OUTLIER -116.27 135.72 55.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 179.227 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 872' ' ' VAL . . . . . . . . . . . . . 97.3 t -119.08 125.26 74.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.802 -178.854 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 873' ' ' LEU . . . . . 0.464 HD23 HD12 ' A' ' 900' ' ' ILE . 0.0 OUTLIER -109.79 116.0 30.87 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.908 0.385 . . . . 0.0 109.979 174.791 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -104.11 112.57 25.62 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 177.825 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 875' ' ' ASP . . . . . 0.807 ' HB3' ' HB2' ' A' ' 831' ' ' ASP . 58.6 t0 -109.52 124.54 51.26 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.576 -175.144 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -124.75 133.86 68.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.024 0.44 . . . . 0.0 110.721 -177.767 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 877' ' ' ASN . . . . . 0.502 ' HA ' ' HD2' ' A' ' 925' ' ' LYS . 0.1 OUTLIER -88.38 -18.32 28.65 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.067 176.886 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 28.1 mmt -102.06 156.52 35.13 Favored Pre-proline 0 C--N 1.321 -0.665 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.85 179.12 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 879' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -58.79 164.26 9.97 Favored 'Trans proline' 0 C--O 1.236 0.415 0 C-N-CA 122.775 2.317 . . . . 0.0 112.128 176.804 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 10.4 t30 -76.01 54.63 0.86 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.277 0.56 . . . . 0.0 111.749 -175.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 1.2 tpp -95.58 -40.53 9.38 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.002 177.121 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -84.54 -34.29 23.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.894 177.77 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -80.36 59.54 4.59 Favored Glycine 0 C--O 1.223 -0.566 0 CA-C-N 115.465 -0.789 . . . . 0.0 113.025 -176.655 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 22.2 t80 -118.16 -50.37 2.47 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 173.585 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 885' ' ' ARG . . . . . 0.418 ' O ' ' HB2' ' A' ' 889' ' ' ARG . 0.0 OUTLIER -64.53 -34.44 78.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.438 179.067 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -62.54 -52.76 62.17 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 116.253 -0.43 . . . . 0.0 109.848 177.19 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -60.67 -42.79 97.79 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.171 0.51 . . . . 0.0 111.094 -178.849 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 888' ' ' GLN . . . . . 0.413 ' HA ' ' OE1' ' A' ' 888' ' ' GLN . 2.5 tp-100 -62.66 -42.81 99.82 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.892 178.592 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 889' ' ' ARG . . . . . 0.509 ' HA ' ' HD3' ' A' ' 889' ' ' ARG . 0.0 OUTLIER -71.82 -44.18 64.34 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.546 -176.32 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 890' ' ' ILE . . . . . 0.467 HG23 HD12 ' A' ' 895' ' ' LEU . 3.3 tt -67.08 -37.54 79.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.826 -0.17 . . . . 0.0 111.449 -176.496 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 891' ' ' ARG . . . . . 0.812 ' HA ' ' HB2' ' A' ' 895' ' ' LEU . 5.6 ptm180 -72.01 -35.49 69.45 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.808 -0.357 . . . . 0.0 110.493 178.602 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -73.24 -22.71 60.36 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.994 -179.567 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 893' ' ' LEU . . . . . 0.582 ' HG ' HD11 ' A' ' 861' ' ' LEU . 0.1 OUTLIER -82.53 0.94 40.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.131 -178.538 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 101.11 51.45 1.15 Allowed Glycine 0 N--CA 1.448 -0.511 0 CA-C-N 115.712 -0.677 . . . . 0.0 112.484 176.569 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 895' ' ' LEU . . . . . 0.812 ' HB2' ' HA ' ' A' ' 891' ' ' ARG . 0.4 OUTLIER -72.91 114.21 10.81 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.975 0.417 . . . . 0.0 110.34 178.435 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -120.66 -12.74 8.83 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.075 -179.789 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 897' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -100.08 153.5 37.73 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.474 -175.877 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 898' ' ' PRO . . . . . 0.649 ' HG2' HG13 ' A' ' 871' ' ' ILE . 55.1 Cg_endo -71.12 126.56 12.54 Favored 'Trans proline' 0 C--O 1.239 0.527 0 C-N-CA 122.592 2.195 . . . . 0.0 112.697 -178.913 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 899' ' ' VAL . . . . . 0.74 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 97.7 t -112.4 119.38 60.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.117 177.305 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 900' ' ' ILE . . . . . 0.464 HD12 HD23 ' A' ' 873' ' ' LEU . 5.5 mt -95.8 115.58 35.3 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.977 179.597 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -95.06 93.79 1.66 Allowed Glycine 0 N--CA 1.444 -0.796 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.666 -174.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 902' ' ' VAL . . . . . 0.618 ' O ' ' HA ' ' A' ' 875' ' ' ASP . 1.3 t -76.8 125.24 36.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 175.584 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -139.35 149.24 43.93 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.233 0.539 . . . . 0.0 111.134 -179.019 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -71.13 113.67 8.41 Favored 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 168.447 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -52.43 102.64 0.05 Allowed 'General case' 0 C--O 1.234 0.246 0 O-C-N 123.463 0.477 . . . . 0.0 110.531 -176.161 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 906' ' ' ALA . . . . . 0.502 ' HB3' ' OE1' ' A' ' 909' ' ' GLU . . . -102.53 -77.68 0.55 Allowed 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.824 -174.625 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 5.7 mt -147.9 -86.97 0.09 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.847 0.356 . . . . 0.0 111.748 -176.559 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 908' ' ' ALA . . . . . 0.406 ' O ' ' HG2' ' A' ' 912' ' ' GLN . . . -102.0 24.88 9.4 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -170.073 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 909' ' ' GLU . . . . . 0.502 ' OE1' ' HB3' ' A' ' 906' ' ' ALA . 3.8 mp0 -56.73 -33.46 66.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.97 -179.849 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 910' ' ' GLU . . . . . 0.439 ' H ' ' HG3' ' A' ' 910' ' ' GLU . 0.0 OUTLIER -63.21 -50.89 68.46 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.667 179.14 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -58.21 -47.73 82.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.822 178.215 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 912' ' ' GLN . . . . . 0.406 ' HG2' ' O ' ' A' ' 908' ' ' ALA . 10.7 mm100 -61.14 -45.73 93.46 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.227 -178.211 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 913' ' ' ARG . . . . . 0.473 ' HD2' ' SG ' ' A' ' 922' ' ' CYS . 0.0 OUTLIER -55.78 -44.35 77.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.225 -178.729 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 10.8 m -73.83 -34.04 64.38 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.161 -178.37 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 2.8 tp -70.31 -40.47 74.21 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.796 0.331 . . . . 0.0 111.4 -178.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -77.95 -44.5 26.64 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.122 179.436 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 50.45 45.1 26.76 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.8 -0.637 . . . . 0.0 111.278 -177.635 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -116.42 24.68 9.65 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.814 -0.708 . . . . 0.0 111.948 -179.011 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 919' ' ' MET . . . . . 0.74 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -137.0 -100.44 0.2 Allowed 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 179.555 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 920' ' ' ASP . . . . . 0.471 ' H ' ' HB2' ' A' ' 919' ' ' MET . 15.4 t70 171.46 -64.96 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.45 175.358 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -121.59 175.34 6.27 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.649 -177.532 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 922' ' ' CYS . . . . . 0.473 ' SG ' ' HD2' ' A' ' 913' ' ' ARG . 0.4 OUTLIER -137.14 135.26 37.22 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.325 176.78 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 923' ' ' LEU . . . . . 0.669 HD11 HG21 ' A' ' 935' ' ' THR . 13.7 mt -120.67 167.62 12.25 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.284 -179.029 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -93.43 135.01 35.09 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 174.748 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 925' ' ' LYS . . . . . 0.502 ' HD2' ' HA ' ' A' ' 877' ' ' ASN . 0.1 OUTLIER -49.16 -44.17 71.76 Favored Pre-proline 0 CA--C 1.539 0.555 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -177.647 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -66.01 75.85 0.33 Allowed 'Trans proline' 0 C--N 1.356 0.935 0 C-N-CA 122.03 1.82 . . . . 0.0 112.402 174.215 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -87.96 159.43 3.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.395 179.495 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 928' ' ' THR . . . . . 0.47 ' O ' ' HB ' ' A' ' 932' ' ' ILE . 0.0 OUTLIER -131.97 172.9 11.77 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.639 -179.623 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 929' ' ' LEU . . . . . 0.869 HD23 ' HG3' ' A' ' 843' ' ' GLN . 1.3 tm? -61.67 -48.25 81.68 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.695 0.283 . . . . 0.0 111.699 -176.201 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -78.01 -32.0 50.89 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.864 -0.334 . . . . 0.0 111.327 -175.264 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -74.74 -36.19 39.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 C-N-CA 120.964 -0.295 . . . . 0.0 110.667 179.48 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 932' ' ' ILE . . . . . 0.789 HG21 ' HB3' ' A' ' 843' ' ' GLN . 0.4 OUTLIER -69.03 -34.73 65.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 174.611 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.9 -46.01 91.23 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.991 -0.55 . . . . 0.0 109.876 174.508 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -54.81 -58.27 8.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.766 177.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 935' ' ' THR . . . . . 0.669 HG21 HD11 ' A' ' 923' ' ' LEU . 1.9 m -57.55 -51.46 69.39 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.96 -178.363 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 936' ' ' LEU . . . . . 0.572 HD11 HG21 ' A' ' 827' ' ' ILE . 1.8 tp -61.68 -45.72 92.79 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.513 -177.014 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 41.3 m -67.4 -36.31 81.05 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.377 -178.257 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 938' ' ' LEU . . . . . 0.465 ' O ' ' HG3' ' A' ' 941' ' ' GLU . 3.6 tp -71.43 -36.64 71.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.158 0.504 . . . . 0.0 111.307 -178.894 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 939' ' ' TYR . . . . . 0.714 ' HA ' ' HB2' ' A' ' 942' ' ' ARG . 40.0 m-85 -86.49 -25.63 25.03 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 121.877 -0.514 . . . . 0.0 111.521 -178.076 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -67.53 -39.82 85.04 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.947 0.403 . . . . 0.0 110.282 173.655 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 941' ' ' GLU . . . . . 0.465 ' HG3' ' O ' ' A' ' 938' ' ' LEU . 0.2 OUTLIER -72.53 -27.91 62.53 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 174.647 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 942' ' ' ARG . . . . . 0.714 ' HB2' ' HA ' ' A' ' 939' ' ' TYR . 0.0 OUTLIER -60.5 -49.42 77.63 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.881 -179.578 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 6.5 m -72.46 -31.87 39.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.711 178.272 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.61 -36.17 82.94 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.226 -179.404 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.58 -23.51 29.61 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.596 0.236 . . . . 0.0 111.067 179.393 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 51.0 m -72.66 -39.03 67.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.129 0.49 . . . . 0.0 109.963 177.004 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 2.3 mtp180 -84.35 -30.05 25.8 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.579 177.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 58.63 77.27 0.31 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.466 -175.256 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 13.0 m . . . . . 0 C--O 1.253 1.26 0 CA-C-N 114.966 -1.015 . . . . 0.0 110.889 -178.3 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.935 0 CA-C-O 120.8 0.334 . . . . 0.0 110.276 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 143.41 92.77 0.17 Allowed Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 111.254 -0.738 . . . . 0.0 111.254 -179.065 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . -113.39 152.37 18.03 Favored Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.997 -0.621 . . . . 0.0 112.773 -177.519 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -107.56 135.27 49.3 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.634 0.254 . . . . 0.0 110.357 179.354 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . -134.41 145.67 17.73 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.896 -0.669 . . . . 0.0 112.111 -178.66 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 10.1 t 59.55 77.77 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-O 121.248 0.547 . . . . 0.0 110.587 -179.736 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -80.58 -77.22 0.2 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.845 -178.753 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 703' ' ' GLY . . . . . 0.463 ' O ' ' HE2' ' A' ' 707' ' ' LYS . . . -128.92 -84.67 0.41 Allowed Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.018 -179.448 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.57 HD13 ' HB3' ' A' ' 729' ' ' SER . 58.0 mt -79.63 73.4 6.33 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.252 0.549 . . . . 0.0 110.184 -179.003 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -151.81 70.41 0.94 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.933 -178.369 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 119.31 20.72 3.9 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.269 -178.134 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 707' ' ' LYS . . . . . 0.686 ' HB2' HG12 ' A' ' 731' ' ' ILE . 15.0 mmtt -81.79 165.38 20.95 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 177.67 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 708' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -121.01 130.51 53.82 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -172.859 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -118.02 111.71 19.29 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.345 177.074 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 710' ' ' TRP . . . . . 0.447 ' O ' HD23 ' A' ' 747' ' ' LEU . 98.3 m95 -97.24 112.08 24.04 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 175.337 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 711' ' ' LEU . . . . . 0.565 HD11 ' SG ' ' A' ' 719' ' ' CYS . 0.1 OUTLIER -121.87 131.64 54.14 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.16 0.505 . . . . 0.0 111.285 -174.741 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -125.23 57.57 1.3 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.598 179.152 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 713' ' ' VAL . . . . . 0.823 ' HA ' ' HB2' ' A' ' 750' ' ' ASP . 12.5 t -103.97 125.15 58.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.566 -177.004 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 714' ' ' ARG . . . . . 0.485 ' NH2' ' HG3' ' A' ' 751' ' ' GLU . 18.9 mtm180 -82.66 -38.38 23.54 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.029 0.442 . . . . 0.0 109.883 179.262 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -65.83 102.75 0.8 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.74 176.03 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 716' ' ' ALA . . . . . 0.53 ' HA ' ' HB3' ' A' ' 719' ' ' CYS . . . -63.63 -26.32 68.62 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.071 -174.856 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 4.3 m -65.01 -46.22 82.3 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.118 0.485 . . . . 0.0 109.913 176.006 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 718' ' ' LEU . . . . . 0.419 ' HB3' HG11 ' A' ' 713' ' ' VAL . 0.9 OUTLIER -74.14 -39.57 63.2 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.543 178.385 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 719' ' ' CYS . . . . . 0.648 ' HB2' ' HB ' ' A' ' 713' ' ' VAL . 0.7 OUTLIER -59.59 -51.56 69.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.7 179.683 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 720' ' ' GLN . . . . . 0.793 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -64.99 -33.7 76.67 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.524 -179.383 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -54.73 -55.8 26.07 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.172 0.511 . . . . 0.0 110.145 177.322 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -68.26 -48.5 64.9 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.177 -177.874 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 723' ' ' GLU . . . . . 0.793 ' HG2' ' HA ' ' A' ' 720' ' ' GLN . 10.4 pt-20 -60.77 -41.86 96.33 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 111.601 0.222 . . . . 0.0 111.601 -174.495 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 724' ' ' THR . . . . . . . . . . . . . 53.7 m -67.35 -44.37 79.2 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.948 0.404 . . . . 0.0 110.732 -179.239 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 74.0 m -66.57 -39.48 88.51 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.717 -177.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 726' ' ' LEU . . . . . . . . . . . . . 67.1 mt -74.96 -39.37 61.36 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.264 -178.253 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 1.6 pp0? -72.07 -23.75 61.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.792 -0.185 . . . . 0.0 111.062 -179.169 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 9.1 ptt85 -66.74 -22.25 66.05 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 121.278 0.561 . . . . 0.0 110.42 177.801 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 729' ' ' SER . . . . . 0.57 ' HB3' HD13 ' A' ' 704' ' ' LEU . 19.9 m -88.01 -78.39 0.32 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.299 179.695 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 730' ' ' GLY . . . . . 0.535 ' HA3' ' O ' ' A' ' 704' ' ' LEU . . . 177.76 39.85 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 111.053 -0.819 . . . . 0.0 111.053 179.176 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 731' ' ' ILE . . . . . 0.686 HG12 ' HB2' ' A' ' 707' ' ' LYS . 27.0 mt -119.24 127.98 75.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 115.165 -0.518 . . . . 0.0 110.165 -177.454 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 732' ' ' VAL . . . . . 0.403 HG22 ' O ' ' A' ' 707' ' ' LYS . 10.6 m -81.21 118.45 29.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.339 0.59 . . . . 0.0 110.538 179.311 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 733' ' ' VAL . . . . . 0.521 ' CG1' HD22 ' A' ' 711' ' ' LEU . 21.9 t -89.71 125.04 42.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.628 -178.105 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 734' ' ' THR . . . . . 0.431 ' HB ' ' CZ3' ' A' ' 710' ' ' TRP . 0.3 OUTLIER -133.11 136.26 45.72 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.438 0.637 . . . . 0.0 110.571 -178.898 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.29 113.56 3.68 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.759 -1.11 . . . . 0.0 111.075 178.145 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -80.09 78.95 6.7 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.455 0.645 . . . . 0.0 109.605 176.714 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -78.36 -28.78 47.17 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.031 179.694 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 164.89 55.08 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.53 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 179.395 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 17.3 mp0 -96.63 -171.41 2.26 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.851 0.358 . . . . 0.0 111.331 -174.058 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -98.94 147.37 33.12 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.776 -176.714 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 741' ' ' PRO . . . . . 0.581 ' HA ' ' CZ3' ' A' ' 757' ' ' TRP . 73.0 Cg_endo -78.43 131.1 10.35 Favored 'Trans proline' 0 N--CA 1.463 -0.314 0 C-N-CA 122.825 2.35 . . . . 0.0 113.132 179.266 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 742' ' ' THR . . . . . 0.493 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.2 OUTLIER -118.21 135.39 23.49 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.394 176.411 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 743' ' ' PRO . . . . . 0.876 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 19.6 Cg_endo -60.7 -18.15 53.8 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 123.149 2.566 . . . . 0.0 113.152 -177.64 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -105.89 10.52 32.43 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.55 -0.296 . . . . 0.0 110.608 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -118.74 156.31 29.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.203 -174.342 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 746' ' ' VAL . . . . . 0.405 HG12 ' HB3' ' A' ' 760' ' ' ARG . 1.5 m -122.29 147.67 26.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.277 -178.395 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 747' ' ' LEU . . . . . 0.653 ' HB3' HG23 ' A' ' 762' ' ' VAL . 0.3 OUTLIER -118.13 134.65 54.8 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.97 178.944 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -127.58 107.79 17.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 172.846 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 749' ' ' THR . . . . . 0.429 HG23 ' HA ' ' A' ' 764' ' ' THR . 1.4 t -109.07 146.04 34.66 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.467 0.651 . . . . 0.0 112.016 -172.629 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 750' ' ' ASP . . . . . 0.823 ' HB2' ' HA ' ' A' ' 713' ' ' VAL . 59.8 t0 -91.88 108.56 20.01 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.968 -1.015 . . . . 0.0 109.442 175.569 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 751' ' ' GLU . . . . . 0.485 ' HG3' ' NH2' ' A' ' 714' ' ' ARG . 3.1 mm-40 63.47 -159.74 0.31 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.865 -174.858 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 752' ' ' VAL . . . . . . . . . . . . . 3.8 t -86.58 119.78 35.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.02 0.438 . . . . 0.0 112.099 -170.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 3.4 m -107.51 -3.31 10.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.462 172.878 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 13.0 m 53.88 55.02 8.93 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.61 -179.556 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.48 137.62 52.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.541 -179.335 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 20.7 tptt -100.4 87.48 3.41 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.346 0.593 . . . . 0.0 109.674 176.914 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 757' ' ' TRP . . . . . 0.581 ' CZ3' ' HA ' ' A' ' 741' ' ' PRO . 76.1 t-105 -67.93 106.03 2.19 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.631 -178.747 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.95 87.83 6.36 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 173.64 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 759' ' ' GLY . . . . . 0.876 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -159.18 -139.58 2.71 Favored Glycine 0 N--CA 1.444 -0.811 0 C-N-CA 120.512 -0.852 . . . . 0.0 112.377 -178.159 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 760' ' ' ARG . . . . . 0.405 ' HB3' HG12 ' A' ' 746' ' ' VAL . 0.7 OUTLIER -71.18 -55.64 7.73 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.989 -0.284 . . . . 0.0 110.573 178.6 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -170.59 150.69 3.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.874 179.664 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 762' ' ' VAL . . . . . 0.653 HG23 ' HB3' ' A' ' 747' ' ' LEU . 4.5 p -130.23 127.44 63.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.248 175.446 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 763' ' ' VAL . . . . . 0.694 HG11 HD21 ' A' ' 791' ' ' LEU . 85.6 t -112.46 128.65 69.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.515 178.455 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 764' ' ' THR . . . . . 0.429 ' HA ' HG23 ' A' ' 749' ' ' THR . 35.5 m -109.17 118.27 36.31 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.105 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 765' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -84.51 107.29 16.67 Favored 'General case' 0 C--O 1.223 -0.313 0 N-CA-C 109.813 -0.439 . . . . 0.0 109.813 177.341 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.06 134.31 36.61 Favored 'General case' 0 C--N 1.317 -0.848 0 C-N-CA 120.844 -0.343 . . . . 0.0 110.196 -175.474 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.79 -65.35 1.07 Allowed 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.803 -0.359 . . . . 0.0 111.312 -179.632 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 3.7 mtp85 -143.67 -4.82 0.84 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -176.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 2.3 m170 -84.17 -67.74 0.77 Allowed 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.294 -0.562 . . . . 0.0 110.863 -178.448 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 25.4 mt 68.65 144.6 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 CA-C-O 121.202 0.525 . . . . 0.0 111.395 -179.447 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . 158.88 -32.2 0.47 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.825 -0.703 . . . . 0.0 111.624 -178.297 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 772' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -82.09 154.24 69.73 Favored Pre-proline 0 C--N 1.324 -0.531 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 176.136 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 773' ' ' PRO . . . . . 0.506 ' HB2' ' H ' ' A' ' 774' ' ' LEU . 12.7 Cg_exo -70.58 -119.88 0.01 OUTLIER 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.792 2.328 . . . . 0.0 112.913 -179.732 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 774' ' ' LEU . . . . . 0.767 ' HA ' HG13 ' A' ' 782' ' ' VAL . 1.1 pt? 178.25 -167.04 0.06 Allowed 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 122.676 0.39 . . . . 0.0 110.105 -177.606 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 775' ' ' GLU . . . . . 0.723 ' HG3' ' HA ' ' A' ' 781' ' ' TRP . 2.4 mp0 -63.03 68.87 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 121.603 0.716 . . . . 0.0 112.631 174.472 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -127.82 6.61 6.11 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 114.642 -1.163 . . . . 0.0 108.214 171.712 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -145.42 144.3 22.61 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 114.314 -1.312 . . . . 0.0 108.946 179.233 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -60.62 100.57 0.16 Allowed 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 122.496 2.131 . . . . 0.0 112.97 -177.64 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 116.75 -3.92 19.36 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.996 176.436 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 780' ' ' GLU . . . . . 0.622 ' O ' ' HG3' ' A' ' 775' ' ' GLU . 10.2 tt0 -103.71 123.67 47.45 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 -177.296 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 781' ' ' TRP . . . . . 0.723 ' HA ' ' HG3' ' A' ' 775' ' ' GLU . 23.2 m95 -134.76 137.41 43.41 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 -179.606 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 782' ' ' VAL . . . . . 0.767 HG13 ' HA ' ' A' ' 774' ' ' LEU . 3.6 m -136.28 151.65 28.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 120.775 0.322 . . . . 0.0 110.29 173.075 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 783' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -167.5 129.18 1.56 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.477 -0.328 . . . . 0.0 110.492 178.858 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.61 101.92 11.11 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 174.255 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 785' ' ' VAL . . . . . 0.846 HG13 ' H ' ' A' ' 787' ' ' ALA . 1.8 p -170.91 168.15 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.202 -175.802 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -108.58 27.78 9.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.754 0.311 . . . . 0.0 110.781 -179.677 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 787' ' ' ALA . . . . . 0.846 ' H ' HG13 ' A' ' 785' ' ' VAL . . . 49.12 57.27 18.35 Favored Pre-proline 0 N--CA 1.47 0.527 0 CA-C-N 115.209 -0.905 . . . . 0.0 112.905 178.877 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 788' ' ' PRO . . . . . 0.509 ' HD3' ' N ' ' A' ' 787' ' ' ALA . 2.7 Cg_exo -76.35 -42.26 0.39 Allowed 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 122.285 1.99 . . . . 0.0 113.414 -178.049 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 4.9 p-80 -151.64 -14.62 0.2 Allowed 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 -170.005 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 790' ' ' GLU . . . . . 0.457 ' H ' ' CD ' ' A' ' 790' ' ' GLU . 0.0 OUTLIER -112.75 -41.92 3.71 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -169.393 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 791' ' ' LEU . . . . . 0.694 HD21 HG11 ' A' ' 763' ' ' VAL . 0.3 OUTLIER -67.89 -50.42 33.04 Favored Pre-proline 0 C--N 1.325 -0.487 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.035 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 792' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -63.9 -26.73 66.94 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 121.3 1.333 . . . . 0.0 111.411 179.253 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -75.0 -39.11 61.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.33 176.359 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -62.66 -41.07 98.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.76 176.382 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 795' ' ' LEU . . . . . 0.516 HD22 ' HA ' ' A' ' 795' ' ' LEU . 0.2 OUTLIER -60.26 -45.53 92.96 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.454 177.624 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -63.54 -38.72 92.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.925 178.456 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 797' ' ' ARG . . . . . 0.514 ' HA ' HD12 ' A' ' 800' ' ' LEU . 0.0 OUTLIER -67.18 -32.71 73.98 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.9 0.381 . . . . 0.0 110.526 178.959 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -70.77 -28.04 32.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.063 0.459 . . . . 0.0 110.694 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 799' ' ' TYR . . . . . 0.528 ' CE2' ' HB3' ' A' ' 707' ' ' LYS . 0.2 OUTLIER -104.26 9.32 36.06 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.171 176.882 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 800' ' ' LEU . . . . . 0.514 HD12 ' HA ' ' A' ' 797' ' ' ARG . 3.9 mt -76.07 -18.68 59.1 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 177.121 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 801' ' ' ILE . . . . . . . . . . . . . 1.5 mm 56.06 54.55 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 CA-C-O 122.356 1.074 . . . . 0.0 110.322 176.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 802' ' ' GLU . . . . . 0.412 ' HG3' ' H ' ' A' ' 802' ' ' GLU . 0.0 OUTLIER -88.22 48.93 1.71 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.275 -1.329 . . . . 0.0 110.745 -176.373 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 803' ' ' MET . . . . . 0.511 ' O ' ' HG2' ' A' ' 803' ' ' MET . 0.0 OUTLIER -138.97 133.04 31.24 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.861 -179.075 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 804' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -170.05 -175.45 2.02 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.549 175.827 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 52.73 -94.97 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 123.557 0.743 . . . . 0.0 111.86 -176.322 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 806' ' ' ASP . . . . . 0.452 ' O ' ' HD3' ' A' ' 808' ' ' PRO . 6.2 t70 -161.15 -37.3 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.767 -172.036 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -109.77 104.16 54.8 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.006 -173.406 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 808' ' ' PRO . . . . . 0.452 ' HD3' ' O ' ' A' ' 806' ' ' ASP . 6.0 Cg_exo -80.73 -46.77 0.08 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.449 0 C-N-CA 123.052 2.501 . . . . 0.0 111.644 169.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . 56.83 -154.36 0.34 Allowed 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.477 0.711 . . . . 0.0 112.627 178.066 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 810' ' ' ASN . . . . . 0.486 ' HB3' ' H ' ' A' ' 811' ' ' ALA . 2.1 t-20 63.85 -95.73 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.846 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 811' ' ' ALA . . . . . 0.486 ' H ' ' HB3' ' A' ' 810' ' ' ASN . . . -75.86 86.47 2.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.942 0.401 . . . . 0.0 110.95 -176.62 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 9.5 tp -148.63 96.25 3.88 Favored Pre-proline 0 C--N 1.322 -0.615 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.159 -178.127 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_exo -72.51 -65.57 0.03 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 122.678 2.252 . . . . 0.0 111.203 176.465 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -148.43 154.66 40.19 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.835 178.379 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 815' ' ' THR . . . . . 0.407 HG22 ' HB2' ' A' ' 818' ' ' ALA . 0.0 OUTLIER -100.91 34.56 2.45 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.162 0.506 . . . . 0.0 111.082 -178.384 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -72.28 -22.68 61.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.494 -176.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 4.8 mttp -110.77 32.95 4.85 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.015 0.436 . . . . 0.0 110.613 179.744 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 818' ' ' ALA . . . . . 0.407 ' HB2' HG22 ' A' ' 815' ' ' THR . . . -80.89 126.66 31.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.286 -178.467 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 21.9 t -115.14 102.96 14.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.657 176.825 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -83.19 49.54 1.57 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.163 0.506 . . . . 0.0 110.914 -177.84 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -82.15 73.01 9.21 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.419 0.628 . . . . 0.0 110.672 -178.391 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -138.08 29.89 2.5 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.457 176.27 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -119.67 121.14 38.6 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.977 -1.01 . . . . 0.0 109.274 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 824' ' ' ASP . . . . . 0.449 ' HB3' ' H ' ' A' ' 825' ' ' MET . 4.7 t0 -144.73 -93.23 0.1 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.043 -178.189 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 825' ' ' MET . . . . . 0.449 ' H ' ' HB3' ' A' ' 824' ' ' ASP . 0.0 OUTLIER -93.28 129.92 39.18 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.02 179.508 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 826' ' ' MET . . . . . 0.509 ' HG3' ' O ' ' A' ' 868' ' ' HIS . 0.0 OUTLIER -124.54 139.25 54.06 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.561 0.696 . . . . 0.0 112.14 -174.777 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 827' ' ' ILE . . . . . 0.543 HG23 ' HB ' ' A' ' 871' ' ' ILE . 3.5 mm -121.25 137.43 54.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.051 -0.977 . . . . 0.0 109.534 177.894 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 13.5 tp -98.4 122.47 41.62 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 179.435 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -112.49 113.57 44.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 120.867 0.365 . . . . 0.0 110.424 -179.277 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 830' ' ' VAL . . . . . 0.501 ' HA ' ' O ' ' A' ' 854' ' ' ALA . 2.9 t -118.21 86.37 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.713 -177.247 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 831' ' ' ASP . . . . . 0.802 ' HA ' ' HB2' ' A' ' 875' ' ' ASP . 13.8 t70 -93.39 154.83 17.73 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.143 0.497 . . . . 0.0 111.475 -173.35 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 832' ' ' ASP . . . . . 1.068 ' HB3' ' HB ' ' A' ' 876' ' ' VAL . 0.0 OUTLIER -60.75 -33.67 73.28 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.818 -177.238 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 833' ' ' HIS . . . . . 0.678 ' HB2' HD21 ' A' ' 836' ' ' ASN . 34.8 m170 -136.4 138.61 27.36 Favored Pre-proline 0 N--CA 1.463 0.186 0 CA-C-O 120.517 0.198 . . . . 0.0 110.519 -178.822 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 834' ' ' PRO . . . . . 0.447 ' HA ' ' HB3' ' A' ' 837' ' ' ARG . 52.1 Cg_exo -56.12 -25.6 55.69 Favored 'Trans proline' 0 CA--C 1.532 0.415 0 C-N-CA 123.115 2.543 . . . . 0.0 113.511 -178.947 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -69.68 -48.18 66.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.946 0.403 . . . . 0.0 111.058 -179.092 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 836' ' ' ASN . . . . . 0.678 HD21 ' HB2' ' A' ' 833' ' ' HIS . 0.1 OUTLIER -74.35 -33.3 63.08 Favored 'General case' 0 CA--C 1.515 -0.396 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 178.508 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 837' ' ' ARG . . . . . 0.585 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 6.5 ttp180 -53.45 -43.2 67.89 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.193 175.042 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.75 -30.32 67.89 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.665 178.984 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.98 -49.13 66.36 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.312 178.929 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 840' ' ' LEU . . . . . 0.504 ' H ' ' HG ' ' A' ' 840' ' ' LEU . 0.0 OUTLIER -69.05 -32.94 72.79 Favored 'General case' 0 CA--C 1.521 -0.146 0 C-N-CA 120.704 -0.399 . . . . 0.0 110.139 178.216 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -64.97 -32.05 73.59 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.009 177.117 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.24 -42.62 88.35 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.04 0.447 . . . . 0.0 109.829 176.946 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 843' ' ' GLN . . . . . 0.545 ' HG3' ' CD2' ' A' ' 929' ' ' LEU . 0.0 OUTLIER -65.24 -46.88 78.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.842 178.868 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 844' ' ' LEU . . . . . 0.48 HD21 HD21 ' A' ' 936' ' ' LEU . 0.1 OUTLIER -59.18 -40.95 87.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.331 177.783 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -70.2 -27.39 72.92 Favored Glycine 0 N--CA 1.453 -0.205 0 C-N-CA 121.306 -0.473 . . . . 0.0 112.537 -179.739 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 18.4 m -79.34 -23.69 43.25 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.059 0.457 . . . . 0.0 110.449 177.779 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.04 -22.49 42.32 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.266 177.116 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 84.48 58.31 2.19 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.894 -0.669 . . . . 0.0 112.116 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 849' ' ' TYR . . . . . 0.44 ' HE1' ' HB3' ' A' ' 825' ' ' MET . 2.4 m-85 -132.75 147.26 52.32 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 29.1 mm-40 -72.99 115.39 12.24 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 176.268 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 851' ' ' CYS . . . . . 0.469 ' SG ' ' HB3' ' A' ' 844' ' ' LEU . 0.0 OUTLIER -109.48 136.08 49.45 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.986 0.422 . . . . 0.0 111.029 -176.277 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.3 116.45 31.03 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 173.757 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 853' ' ' THR . . . . . 0.482 ' HB ' ' CZ ' ' A' ' 837' ' ' ARG . 0.2 OUTLIER -91.02 134.11 34.76 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -171.464 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 854' ' ' ALA . . . . . 0.501 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -151.47 164.55 36.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.935 175.128 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 855' ' ' ASN . . . . . 0.54 ' O ' ' HB3' ' A' ' 856' ' ' ASP . 0.2 OUTLIER -153.5 74.02 0.99 Allowed 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.74 0.305 . . . . 0.0 110.978 176.63 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 856' ' ' ASP . . . . . 0.54 ' HB3' ' O ' ' A' ' 855' ' ' ASN . 4.3 p-10 163.82 173.65 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 124.28 1.032 . . . . 0.0 109.712 178.647 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -87.04 -44.2 5.75 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.732 -0.747 . . . . 0.0 113.898 -175.094 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -67.5 -38.21 80.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 112.011 0.374 . . . . 0.0 112.011 -174.324 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -67.89 -37.28 81.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.914 0.388 . . . . 0.0 110.622 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -61.63 -38.83 89.1 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.417 177.577 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 861' ' ' LEU . . . . . 0.496 HD21 ' HA ' ' A' ' 890' ' ' ILE . 0.1 OUTLIER -74.73 -31.31 61.8 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.957 178.036 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -64.68 -49.75 69.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.301 177.901 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 863' ' ' VAL . . . . . 0.489 HG22 HD11 ' A' ' 869' ' ' ILE . 7.9 p -66.99 -31.2 52.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.428 177.638 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 864' ' ' LEU . . . . . 0.669 ' HG ' HD11 ' A' ' 890' ' ' ILE . 0.7 OUTLIER -65.63 -33.86 76.87 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.824 175.683 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 27.2 m -65.9 -37.79 87.04 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.072 0.463 . . . . 0.0 109.861 178.164 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.05 -28.7 68.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.721 174.016 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 7.2 t30 56.12 73.0 0.46 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 114.575 -1.193 . . . . 0.0 111.976 176.613 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 868' ' ' HIS . . . . . 0.509 ' O ' ' HG3' ' A' ' 826' ' ' MET . 64.7 m-70 -135.14 46.24 2.43 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 174.558 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 869' ' ' ILE . . . . . 0.489 HD11 HG22 ' A' ' 863' ' ' VAL . 2.0 mp -142.2 145.79 23.35 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.132 -0.94 . . . . 0.0 109.835 -177.896 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -101.43 -52.42 3.24 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.88 0.372 . . . . 0.0 110.426 177.173 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 871' ' ' ILE . . . . . 0.543 ' HB ' HG23 ' A' ' 827' ' ' ILE . 38.4 mm -115.42 129.49 71.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.139 179.029 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 872' ' ' VAL . . . . . 0.764 HG23 HD11 ' A' ' 897' ' ' LEU . 9.7 t -106.53 124.39 62.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 120.728 0.299 . . . . 0.0 110.697 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 873' ' ' LEU . . . . . 0.843 HD11 HD11 ' A' ' 936' ' ' LEU . 52.1 mt -109.96 132.34 54.25 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.141 -0.481 . . . . 0.0 109.719 174.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -120.8 95.2 4.61 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.065 0.459 . . . . 0.0 110.011 178.01 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 875' ' ' ASP . . . . . 0.802 ' HB2' ' HA ' ' A' ' 831' ' ' ASP . 0.9 OUTLIER -88.66 105.63 17.8 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.978 -179.512 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 876' ' ' VAL . . . . . 1.068 ' HB ' ' HB3' ' A' ' 832' ' ' ASP . 2.9 t 50.92 65.56 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.558 0.694 . . . . 0.0 111.519 -179.372 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 877' ' ' ASN . . . . . 0.434 ' HB3' HD22 ' A' ' 886' ' ' LEU . 1.6 t-20 -90.48 33.17 0.91 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.827 176.392 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 4.7 tpp -100.16 112.5 64.22 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.162 -0.927 . . . . 0.0 109.473 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 879' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo -62.3 -58.82 0.31 Allowed 'Trans proline' 0 N--CA 1.462 -0.332 0 C-N-CA 122.704 2.269 . . . . 0.0 111.412 179.888 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -176.47 -60.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.586 178.734 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 4.2 tmm? -98.4 88.46 4.14 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.37 177.774 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 68.85 147.29 0.06 Allowed 'General case' 0 N--CA 1.468 0.454 0 O-C-N 123.886 0.741 . . . . 0.0 111.361 178.817 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -118.81 24.42 8.4 Favored Glycine 0 CA--C 1.51 -0.273 0 C-N-CA 120.845 -0.693 . . . . 0.0 111.39 177.652 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 6.5 p90 -80.31 -18.84 48.04 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.296 -0.452 . . . . 0.0 110.687 -171.566 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.89 -32.12 73.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.857 0.36 . . . . 0.0 110.344 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 886' ' ' LEU . . . . . 0.434 HD22 ' HB3' ' A' ' 877' ' ' ASN . 0.0 OUTLIER -72.62 -50.73 23.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.15 179.807 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 887' ' ' THR . . . . . 0.631 ' HB ' ' HB3' ' A' ' 916' ' ' GLU . 0.0 OUTLIER -63.28 -40.6 97.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.139 -179.144 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 40.0 tp60 -65.31 -42.77 92.68 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.331 178.234 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 889' ' ' ARG . . . . . 0.404 ' HG2' HD22 ' A' ' 861' ' ' LEU . 0.7 OUTLIER -64.86 -45.75 84.75 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.992 -178.401 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 890' ' ' ILE . . . . . 0.669 HD11 ' HG ' ' A' ' 864' ' ' LEU . 1.1 tt -69.05 -34.15 62.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.62 0.247 . . . . 0.0 111.017 -177.882 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 891' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.17 -23.07 57.68 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.905 0.383 . . . . 0.0 110.475 178.952 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 -77.84 -52.21 9.25 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.456 176.326 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.82 -60.53 3.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.852 -175.116 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 171.3 77.99 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.712 0 C-N-CA 120.394 -0.908 . . . . 0.0 112.02 -176.27 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 895' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -92.27 110.28 21.67 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.023 0.44 . . . . 0.0 110.071 178.843 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -123.25 -26.5 4.29 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.617 178.08 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 897' ' ' LEU . . . . . 0.764 HD11 HG23 ' A' ' 872' ' ' VAL . 2.5 pt? -97.52 151.9 37.89 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.349 -177.35 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -66.91 128.55 18.98 Favored 'Trans proline' 0 C--O 1.239 0.555 0 C-N-CA 122.763 2.309 . . . . 0.0 112.732 -177.887 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 899' ' ' VAL . . . . . 0.655 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 58.7 t -105.9 109.37 27.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.225 176.748 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 900' ' ' ILE . . . . . 0.427 ' O ' ' HA ' ' A' ' 873' ' ' LEU . 3.6 mp -101.01 114.39 39.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 178.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -112.57 116.47 4.05 Favored Glycine 0 N--CA 1.442 -0.916 0 C-N-CA 120.448 -0.882 . . . . 0.0 112.599 -174.79 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 902' ' ' VAL . . . . . 0.675 HG22 ' HA ' ' A' ' 875' ' ' ASP . 0.8 OUTLIER -89.55 138.71 18.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 108.76 -0.829 . . . . 0.0 108.76 176.031 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -138.27 160.5 39.3 Favored 'General case' 0 C--N 1.319 -0.739 0 O-C-N 121.957 -0.464 . . . . 0.0 111.686 -176.597 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -85.4 105.85 16.33 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.327 174.319 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 905' ' ' ASN . . . . . 0.403 ' HB3' ' H ' ' A' ' 906' ' ' ALA . 11.8 t-20 62.29 -96.41 0.06 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.778 -174.929 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 906' ' ' ALA . . . . . 0.494 ' O ' ' HG3' ' A' ' 909' ' ' GLU . . . 53.22 55.61 8.57 Favored 'General case' 0 N--CA 1.462 0.141 0 O-C-N 123.487 0.492 . . . . 0.0 111.05 -179.413 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 907' ' ' LEU . . . . . 0.417 ' O ' ' HB3' ' A' ' 908' ' ' ALA . 2.1 tp -49.31 143.1 6.65 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.394 -179.281 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 908' ' ' ALA . . . . . 0.417 ' HB3' ' O ' ' A' ' 907' ' ' LEU . . . 76.5 39.38 0.26 Allowed 'General case' 0 N--CA 1.465 0.315 0 O-C-N 124.33 1.018 . . . . 0.0 109.685 -173.898 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 909' ' ' GLU . . . . . 0.494 ' HG3' ' O ' ' A' ' 906' ' ' ALA . 1.0 OUTLIER -57.79 -45.41 86.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.951 -178.307 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 910' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.42 -44.17 88.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.586 179.077 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.54 -33.95 76.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.847 -178.469 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.17 -57.9 8.99 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.327 177.396 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.83 -33.46 71.79 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.37 -176.89 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 77.0 m -76.24 -33.53 59.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.116 179.398 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 4.6 tp -70.8 -47.75 57.85 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.868 0.365 . . . . 0.0 110.63 179.372 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 916' ' ' GLU . . . . . 0.631 ' HB3' ' HB ' ' A' ' 887' ' ' THR . 28.5 mt-10 -69.87 -27.51 64.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.155 -178.225 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.59 35.63 15.18 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.294 178.919 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -140.77 24.71 2.59 Favored Glycine 0 C--O 1.226 -0.351 0 C-N-CA 120.517 -0.849 . . . . 0.0 112.488 -179.002 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 919' ' ' MET . . . . . 0.655 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -125.29 -119.29 0.27 Allowed 'General case' 0 C--N 1.323 -0.577 0 O-C-N 122.812 -0.228 . . . . 0.0 110.686 -177.233 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 920' ' ' ASP . . . . . 0.543 ' H ' ' HB3' ' A' ' 919' ' ' MET . 20.1 t70 173.29 -68.28 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 123.683 0.793 . . . . 0.0 109.429 174.252 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 25.5 m -128.67 137.73 51.79 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.065 -177.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 922' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -103.42 129.89 50.63 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.54 -179.666 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 923' ' ' LEU . . . . . . . . . . . . . 14.3 mt -126.11 178.0 6.04 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.126 -179.763 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -108.27 148.04 30.57 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 176.895 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 925' ' ' LYS . . . . . 0.456 ' N ' ' HD2' ' A' ' 926' ' ' PRO . 0.8 OUTLIER -67.16 -48.76 47.69 Favored Pre-proline 0 CA--C 1.533 0.316 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.298 177.881 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 926' ' ' PRO . . . . . 0.456 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 56.2 Cg_endo -71.58 64.88 3.01 Favored 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 121.914 1.743 . . . . 0.0 111.789 172.831 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -105.9 149.17 9.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.603 -178.801 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.91 153.9 40.8 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.89 179.688 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 929' ' ' LEU . . . . . 0.545 ' CD2' ' HG3' ' A' ' 843' ' ' GLN . 1.1 tm? -59.95 -31.78 70.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.005 -176.898 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -71.26 -26.53 62.93 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.971 -178.866 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 21.3 t -78.54 -44.98 26.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.839 -0.164 . . . . 0.0 111.314 -178.253 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 932' ' ' ILE . . . . . 0.465 HG12 HD22 ' A' ' 936' ' ' LEU . 0.0 OUTLIER -60.61 -41.86 89.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 174.775 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -44.72 96.18 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.651 176.402 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 934' ' ' GLN . . . . . 0.549 ' O ' ' HB2' ' A' ' 938' ' ' LEU . 0.7 OUTLIER -58.16 -53.09 62.25 Favored 'General case' 0 C--O 1.222 -0.39 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.05 179.888 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 4.0 m -61.46 -43.23 99.24 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.812 0.339 . . . . 0.0 111.309 -177.676 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 936' ' ' LEU . . . . . 0.843 HD11 HD11 ' A' ' 873' ' ' LEU . 0.0 OUTLIER -64.55 -51.32 63.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.954 -179.178 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 24.0 m -66.61 -39.38 88.34 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.381 -176.816 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 938' ' ' LEU . . . . . 0.549 ' HB2' ' O ' ' A' ' 934' ' ' GLN . 0.3 OUTLIER -61.94 -47.46 84.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.813 -179.277 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 939' ' ' TYR . . . . . 0.429 ' O ' HG22 ' A' ' 943' ' ' VAL . 5.1 m-85 -76.68 -32.78 58.14 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.002 -177.253 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -61.85 -49.38 76.48 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.86 0.362 . . . . 0.0 110.564 177.805 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 941' ' ' GLU . . . . . 0.599 ' O ' ' HB3' ' A' ' 945' ' ' LYS . 7.9 pt-20 -67.08 -30.71 70.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.36 179.29 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 942' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.71 -49.27 54.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.565 -178.443 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 943' ' ' VAL . . . . . 0.429 HG22 ' O ' ' A' ' 939' ' ' TYR . 18.5 m -70.38 -34.13 56.83 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 CA-C-O 121.263 0.554 . . . . 0.0 110.282 -178.653 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.56 -18.62 61.61 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.287 176.457 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 945' ' ' LYS . . . . . 0.599 ' HB3' ' O ' ' A' ' 941' ' ' GLU . 0.0 OUTLIER -85.17 -23.37 28.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.727 179.31 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -74.06 -39.74 63.28 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.971 0.415 . . . . 0.0 110.137 173.683 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 6.8 mtt180 -72.8 -50.01 26.97 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.202 176.006 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -117.03 102.44 9.34 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.977 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 C--O 1.251 1.142 0 CA-C-O 118.85 -0.595 . . . . 0.0 111.144 -174.975 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 0.98 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 178.68 -128.72 1.29 Allowed Glycine 0 N--CA 1.447 -0.633 0 N-CA-C 111.604 -0.599 . . . . 0.0 111.604 179.763 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . 92.37 94.84 1.4 Allowed Glycine 0 N--CA 1.448 -0.539 0 C-N-CA 120.828 -0.701 . . . . 0.0 111.805 179.178 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -83.78 103.03 12.74 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 120.86 0.362 . . . . 0.0 111.415 -177.922 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . -89.24 118.11 5.1 Favored Glycine 0 N--CA 1.449 -0.496 0 N-CA-C 110.391 -1.083 . . . . 0.0 110.391 172.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 18.0 m -132.97 157.07 42.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -172.28 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 76.22 157.05 0.18 Allowed 'General case' 0 C--O 1.234 0.271 0 CA-C-N 114.85 -1.068 . . . . 0.0 112.622 169.479 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . 89.94 -61.93 3.34 Favored Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 115.039 -0.982 . . . . 0.0 113.13 173.877 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.712 ' HA ' ' H ' ' A' ' 802' ' ' GLU . 1.5 mt 65.76 -74.62 0.06 Allowed 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -169.979 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 1.3 m 70.44 116.04 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 167.486 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 94.18 -11.19 70.93 Favored Glycine 0 C--N 1.33 0.238 0 CA-C-N 115.416 -0.811 . . . . 0.0 114.187 166.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 707' ' ' LYS . . . . . 0.413 ' HD2' ' H ' ' A' ' 708' ' ' ARG . 0.1 OUTLIER -81.85 142.16 32.78 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 117.377 0.589 . . . . 0.0 111.196 -176.968 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 708' ' ' ARG . . . . . 0.48 ' HA ' HG23 ' A' ' 732' ' ' VAL . 0.0 OUTLIER -95.18 143.1 26.88 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.164 178.87 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -117.82 119.06 33.73 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 174.78 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 710' ' ' TRP . . . . . 0.419 ' O ' HD23 ' A' ' 747' ' ' LEU . 77.4 m95 -91.56 115.7 28.26 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 711' ' ' LEU . . . . . 0.444 HD22 HG12 ' A' ' 733' ' ' VAL . 0.7 OUTLIER -119.74 129.72 54.64 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.476 0.655 . . . . 0.0 110.945 -178.576 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -126.43 56.88 1.44 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.019 175.684 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 713' ' ' VAL . . . . . 0.821 HG13 ' HB3' ' A' ' 750' ' ' ASP . 24.0 t -107.23 118.3 54.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 115.031 -0.986 . . . . 0.0 109.713 179.158 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.46 -3.17 58.5 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.402 0.62 . . . . 0.0 110.005 -179.425 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 715' ' ' ASN . . . . . 0.617 ' HB3' ' HB2' ' A' ' 718' ' ' LEU . 1.8 m-80 -86.74 103.13 14.89 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.507 -0.769 . . . . 0.0 109.553 175.687 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 716' ' ' ALA . . . . . 0.56 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -54.6 -46.78 73.87 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -172.346 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.2 -39.42 93.95 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.141 0.496 . . . . 0.0 110.714 -179.756 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 718' ' ' LEU . . . . . 0.617 ' HB2' ' HB3' ' A' ' 715' ' ' ASN . 0.2 OUTLIER -69.5 -50.06 48.82 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.089 -178.911 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 719' ' ' CYS . . . . . 0.732 ' HB3' ' HB ' ' A' ' 713' ' ' VAL . 31.9 p -67.61 -39.51 84.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.687 -176.411 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 720' ' ' GLN . . . . . 0.433 ' HA ' ' OE1' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -59.59 -43.98 93.51 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.335 178.277 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -59.33 -49.6 77.19 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.831 0.348 . . . . 0.0 110.998 -178.216 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 722' ' ' LEU . . . . . 0.485 HD23 ' HG3' ' A' ' 792' ' ' PRO . 4.8 mt -65.83 -45.34 82.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.785 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 723' ' ' GLU . . . . . 0.591 ' HG2' ' N ' ' A' ' 724' ' ' THR . 0.0 OUTLIER -57.82 -49.19 77.47 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.822 -177.204 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 724' ' ' THR . . . . . 0.591 ' N ' ' HG2' ' A' ' 723' ' ' GLU . 6.1 m -67.15 -36.77 82.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.304 -174.616 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 27.7 m -69.91 -35.95 74.98 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.02 0.438 . . . . 0.0 111.022 179.544 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 726' ' ' LEU . . . . . 0.58 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 29.4 mt -75.74 -44.16 43.18 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.305 -177.845 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.65 -25.88 65.05 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.888 0.375 . . . . 0.0 110.394 177.649 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 728' ' ' ARG . . . . . 0.582 ' HB2' ' O ' ' A' ' 724' ' ' THR . 0.0 OUTLIER -65.74 -33.57 76.17 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.582 175.57 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 19.0 m -85.4 -56.7 3.39 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.002 -177.881 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 730' ' ' GLY . . . . . . . . . . . . . . . 155.42 28.2 0.03 OUTLIER Glycine 0 N--CA 1.453 -0.172 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.617 -179.685 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 731' ' ' ILE . . . . . 0.58 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 11.1 mm -113.66 129.73 68.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 178.549 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 732' ' ' VAL . . . . . 0.48 HG23 ' HA ' ' A' ' 708' ' ' ARG . 3.9 m -85.62 114.83 26.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.445 0.641 . . . . 0.0 110.707 -179.203 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 733' ' ' VAL . . . . . 0.446 HG11 ' HB2' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -78.19 115.22 19.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.661 -177.637 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -121.92 126.37 48.49 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.434 179.705 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.41 127.84 34.14 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.911 177.923 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -73.59 90.79 1.8 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.303 0.573 . . . . 0.0 110.037 177.641 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -73.53 -73.75 0.2 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.085 176.81 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -168.74 63.56 0.19 Allowed Glycine 0 N--CA 1.449 -0.494 0 N-CA-C 111.078 -0.809 . . . . 0.0 111.078 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -103.67 155.2 18.75 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.62 0.248 . . . . 0.0 110.632 -175.403 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 740' ' ' GLU . . . . . 0.491 ' H ' ' CD ' ' A' ' 740' ' ' GLU . 1.5 pm0 -71.47 129.58 88.59 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 116.112 -0.494 . . . . 0.0 109.708 177.53 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 741' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -57.64 122.81 12.39 Favored 'Trans proline' 0 C--O 1.233 0.244 0 C-N-CA 122.938 2.425 . . . . 0.0 112.912 -175.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 742' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -93.78 129.23 38.77 Favored Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.146 176.717 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 743' ' ' PRO . . . . . 0.595 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 41.2 Cg_endo -67.22 -5.73 14.48 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 123.087 2.525 . . . . 0.0 113.328 -175.324 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -112.57 4.98 17.63 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.662 0.268 . . . . 0.0 110.62 176.286 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -112.6 157.99 20.53 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.167 0.508 . . . . 0.0 110.849 -175.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 746' ' ' VAL . . . . . 0.54 HG21 HD11 ' A' ' 795' ' ' LEU . 10.2 m -120.57 147.76 24.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.601 -178.943 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 747' ' ' LEU . . . . . 0.419 HD23 ' O ' ' A' ' 710' ' ' TRP . 0.1 OUTLIER -119.78 107.82 13.65 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.098 178.91 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 6.7 mt -94.66 108.44 20.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 176.202 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 4.8 t -121.36 165.52 15.41 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.655 -0.248 . . . . 0.0 110.63 -176.154 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 750' ' ' ASP . . . . . 0.821 ' HB3' HG13 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -122.93 148.22 45.71 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.032 0.444 . . . . 0.0 111.306 179.357 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 61.2 -119.64 0.77 Allowed 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.064 -177.032 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 752' ' ' VAL . . . . . . . . . . . . . 29.9 t -125.51 93.8 2.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.041 0.448 . . . . 0.0 111.002 -175.542 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 9.8 p -74.74 -21.96 17.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.868 178.162 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 55.42 53.95 9.19 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.108 -179.025 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.25 134.33 32.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.847 -177.622 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -90.25 85.9 6.36 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 175.558 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 77.1 t-105 -68.97 94.47 0.64 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.901 179.718 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 61.2 mt-30 -82.61 67.59 8.72 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.298 0.57 . . . . 0.0 109.964 176.723 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 759' ' ' GLY . . . . . 0.595 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -128.91 -136.9 4.22 Favored Glycine 0 N--CA 1.44 -1.071 0 CA-C-N 115.64 -0.709 . . . . 0.0 112.188 -178.44 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 7.5 ttm-85 -86.43 -47.84 8.96 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.818 0.342 . . . . 0.0 110.456 178.1 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 761' ' ' ALA . . . . . 0.402 ' O ' ' HA ' ' A' ' 746' ' ' VAL . . . -164.66 138.42 5.08 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.921 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 2.4 p -113.92 130.53 67.92 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 172.44 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 763' ' ' VAL . . . . . 0.641 HG11 HD21 ' A' ' 791' ' ' LEU . 0.7 OUTLIER -115.65 113.13 42.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-O 120.971 0.415 . . . . 0.0 110.5 -178.032 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 764' ' ' THR . . . . . 0.5 ' HB ' HG12 ' A' ' 782' ' ' VAL . 44.5 m -102.66 112.78 25.71 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.983 -175.509 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 765' ' ' PHE . . . . . 0.683 ' HE1' HG23 ' A' ' 785' ' ' VAL . 6.2 m-85 -88.58 105.72 17.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.818 174.706 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.23 134.02 37.13 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.691 0.281 . . . . 0.0 110.949 -173.783 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 767' ' ' ARG . . . . . 0.417 ' HA ' ' HD3' ' A' ' 767' ' ' ARG . 0.1 OUTLIER -112.66 -64.52 1.29 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.114 -178.092 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.15 -31.97 3.52 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.783 0.325 . . . . 0.0 111.395 -176.152 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 9.6 t-80 -115.31 133.5 55.97 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.182 0.515 . . . . 0.0 110.779 -177.591 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 2.0 mt -106.07 158.77 6.28 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.459 176.322 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -175.78 -37.76 0.05 OUTLIER Glycine 0 CA--C 1.507 -0.468 0 N-CA-C 110.806 -0.918 . . . . 0.0 110.806 -178.823 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 772' ' ' ILE . . . . . . . . . . . . . 1.6 mm -83.8 133.92 45.36 Favored Pre-proline 0 C--N 1.324 -0.52 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 172.835 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 773' ' ' PRO . . . . . 0.563 ' O ' ' HB3' ' A' ' 774' ' ' LEU . 23.6 Cg_endo -62.41 -92.86 0.0 OUTLIER 'Trans proline' 0 CA--C 1.535 0.531 0 C-N-CA 122.93 2.42 . . . . 0.0 113.75 -175.633 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 774' ' ' LEU . . . . . 0.665 ' HA ' HG13 ' A' ' 782' ' ' VAL . 1.3 pt? 165.98 -171.8 0.01 OUTLIER 'General case' 0 C--O 1.234 0.268 0 C-N-CA 123.147 0.579 . . . . 0.0 110.218 -174.569 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 775' ' ' GLU . . . . . 0.606 ' HG3' ' HA ' ' A' ' 781' ' ' TRP . 1.5 mp0 -62.07 69.18 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 O-C-N 123.834 0.709 . . . . 0.0 112.036 172.806 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 18.7 pttt -128.79 7.87 5.7 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 172.489 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 777' ' ' ALA . . . . . 0.433 ' HA ' ' HD3' ' A' ' 778' ' ' PRO . . . -145.07 149.37 41.84 Favored Pre-proline 0 N--CA 1.449 -0.515 0 CA-C-N 114.348 -1.296 . . . . 0.0 109.122 -179.157 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 778' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 777' ' ' ALA . 24.7 Cg_exo -64.16 93.92 0.19 Allowed 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.72 2.28 . . . . 0.0 112.407 -179.452 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 112.15 19.62 7.1 Favored Glycine 0 C--O 1.228 -0.255 0 C-N-CA 120.923 -0.656 . . . . 0.0 113.2 176.794 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 780' ' ' GLU . . . . . 0.522 ' O ' ' HA ' ' A' ' 775' ' ' GLU . 0.1 OUTLIER -119.73 124.88 47.29 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 177.593 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 781' ' ' TRP . . . . . 0.606 ' HA ' ' HG3' ' A' ' 775' ' ' GLU . 17.0 m95 -137.24 136.02 37.73 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 -176.556 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 782' ' ' VAL . . . . . 0.665 HG13 ' HA ' ' A' ' 774' ' ' LEU . 32.6 m -129.69 155.67 41.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.981 0.419 . . . . 0.0 110.875 176.927 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 783' ' ' HIS . . . . . 0.537 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.2 OUTLIER -161.18 126.92 3.77 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.931 176.189 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 784' ' ' SER . . . . . 0.404 ' O ' HG13 ' A' ' 785' ' ' VAL . 0.9 OUTLIER -96.67 99.48 11.09 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 120.874 0.369 . . . . 0.0 110.03 177.703 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 785' ' ' VAL . . . . . 0.683 HG23 ' HE1' ' A' ' 765' ' ' PHE . 0.0 OUTLIER -171.24 -170.52 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.225 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -179.747 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -123.67 56.72 1.2 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.733 0.301 . . . . 0.0 110.824 178.111 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 787' ' ' ALA . . . . . 0.463 ' HB2' HD23 ' A' ' 718' ' ' LEU . . . 53.57 63.23 8.31 Favored Pre-proline 0 N--CA 1.467 0.382 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.34 178.717 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 788' ' ' PRO . . . . . 0.615 ' HD2' ' OE1' ' A' ' 790' ' ' GLU . 5.2 Cg_exo -76.01 43.27 1.1 Allowed 'Trans proline' 0 CA--C 1.534 0.498 0 C-N-CA 123.086 2.524 . . . . 0.0 113.292 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 69.71 -0.02 2.82 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 171.0 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 790' ' ' GLU . . . . . 0.615 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -94.55 -46.08 7.13 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 121.882 -0.511 . . . . 0.0 111.305 -177.447 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 791' ' ' LEU . . . . . 0.641 HD21 HG11 ' A' ' 763' ' ' VAL . 0.2 OUTLIER -58.82 -45.05 99.64 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -179.926 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 792' ' ' PRO . . . . . 0.485 ' HG3' HD23 ' A' ' 722' ' ' LEU . 51.7 Cg_exo -54.17 -31.87 67.7 Favored 'Trans proline' 0 C--N 1.356 0.941 0 C-N-CA 121.717 1.611 . . . . 0.0 111.974 175.917 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -70.44 -44.37 67.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.774 179.006 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 794' ' ' LEU . . . . . 0.552 ' HA ' ' HG2' ' A' ' 797' ' ' ARG . 0.3 OUTLIER -71.55 -28.76 64.09 Favored 'General case' 0 C--O 1.219 -0.51 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.732 179.784 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 795' ' ' LEU . . . . . 0.54 HD11 HG21 ' A' ' 746' ' ' VAL . 0.1 OUTLIER -62.99 -39.42 94.69 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.116 0.484 . . . . 0.0 110.072 177.037 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -62.94 -48.85 77.13 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.262 177.522 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 797' ' ' ARG . . . . . 0.748 ' HA ' HD23 ' A' ' 800' ' ' LEU . 8.8 ptp180 -71.45 -32.99 68.95 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.684 -177.541 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 798' ' ' ILE . . . . . 0.432 ' HB ' ' O ' ' A' ' 794' ' ' LEU . 0.1 OUTLIER -60.95 -34.01 57.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.622 0.249 . . . . 0.0 111.061 175.569 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 799' ' ' TYR . . . . . 0.44 ' HD1' ' HA ' ' A' ' 799' ' ' TYR . 0.5 OUTLIER -83.19 -61.48 1.84 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.658 -0.246 . . . . 0.0 110.424 177.631 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 800' ' ' LEU . . . . . 0.748 HD23 ' HA ' ' A' ' 797' ' ' ARG . 0.2 OUTLIER 48.45 74.94 0.15 Allowed 'General case' 0 N--CA 1.468 0.436 0 O-C-N 123.666 0.604 . . . . 0.0 112.122 178.661 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 801' ' ' ILE . . . . . 0.444 HD12 HD23 ' A' ' 704' ' ' LEU . 1.4 mp -104.89 -50.14 8.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 178.62 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 802' ' ' GLU . . . . . 0.712 ' H ' ' HA ' ' A' ' 704' ' ' LEU . 1.0 OUTLIER 49.0 42.75 21.32 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.521 176.909 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 803' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -81.87 138.16 35.11 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.166 -177.942 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 804' ' ' GLU . . . . . 0.475 ' H ' ' HG2' ' A' ' 804' ' ' GLU . 0.3 OUTLIER -74.31 107.41 6.46 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.016 178.663 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.64 170.26 14.86 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.186 0.517 . . . . 0.0 111.552 -177.361 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -139.36 -71.97 0.39 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.386 178.174 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 3.8 t70 52.54 81.13 0.27 Allowed Pre-proline 0 N--CA 1.468 0.454 0 O-C-N 123.597 0.561 . . . . 0.0 111.761 176.107 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 808' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.14 162.49 41.56 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.781 2.321 . . . . 0.0 112.71 -177.883 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -89.8 171.12 9.85 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.987 -179.557 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 33.9 t30 -151.9 142.74 22.96 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.14 179.047 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -125.71 151.29 46.81 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.995 0.426 . . . . 0.0 111.201 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -132.3 127.76 20.95 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.577 177.51 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -83.09 174.58 9.18 Favored 'Trans proline' 0 N--CA 1.462 -0.331 0 C-N-CA 123.016 2.477 . . . . 0.0 113.085 -176.479 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 1.2 m -135.98 145.38 46.09 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.915 176.691 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.87 82.8 1.83 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.391 0.615 . . . . 0.0 111.054 -179.2 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -90.72 154.55 19.46 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.07 -178.385 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.36 165.54 35.49 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 120.777 0.323 . . . . 0.0 110.966 -178.925 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -144.93 140.97 28.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.947 175.564 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -119.17 118.22 56.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.925 0.393 . . . . 0.0 111.253 -177.694 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -93.52 -156.98 0.51 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.475 -178.755 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -114.31 158.83 20.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.563 -179.778 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -104.81 -101.56 0.32 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.943 -176.677 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 5.1 t70 51.46 101.08 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.634 0.774 . . . . 0.0 111.869 -174.069 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 824' ' ' ASP . . . . . 0.4 ' HB3' ' H ' ' A' ' 825' ' ' MET . 19.2 t0 -90.77 -100.77 0.1 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.816 -173.428 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 825' ' ' MET . . . . . 0.563 ' O ' ' HB2' ' A' ' 850' ' ' GLN . 0.0 OUTLIER -115.76 139.0 50.58 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.915 -175.551 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 826' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -105.39 123.13 47.36 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.041 -176.496 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 827' ' ' ILE . . . . . 0.58 HG23 ' HB ' ' A' ' 871' ' ' ILE . 1.2 mm -119.87 124.28 72.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.699 177.786 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 828' ' ' LEU . . . . . 0.678 HD12 ' HB3' ' A' ' 852' ' ' LYS . 3.1 tp -109.01 123.31 48.92 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.648 0.261 . . . . 0.0 110.699 -178.229 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 829' ' ' VAL . . . . . 0.76 HG12 HD12 ' A' ' 873' ' ' LEU . 27.0 m -105.43 128.36 59.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.822 177.867 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 830' ' ' VAL . . . . . 0.502 ' HA ' ' O ' ' A' ' 854' ' ' ALA . 0.2 OUTLIER -126.09 87.48 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 116.771 -0.195 . . . . 0.0 111.047 -177.775 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 831' ' ' ASP . . . . . 0.578 ' HA ' ' O ' ' A' ' 875' ' ' ASP . 9.9 t70 -107.67 137.97 44.73 Favored 'General case' 0 CA--C 1.515 -0.397 0 C-N-CA 120.631 -0.428 . . . . 0.0 110.388 -178.893 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.38 -31.2 72.29 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.125 -178.307 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 833' ' ' HIS . . . . . 0.434 ' HA ' ' HD3' ' A' ' 834' ' ' PRO . 0.2 OUTLIER -108.81 128.77 24.9 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-O 120.781 0.324 . . . . 0.0 111.697 -173.549 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 834' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 833' ' ' HIS . 67.6 Cg_exo -53.81 -45.26 42.3 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 123.51 2.807 . . . . 0.0 113.584 -178.711 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 835' ' ' ILE . . . . . 0.445 ' HA ' ' HD2' ' A' ' 838' ' ' ARG . 1.1 pt -65.35 -37.17 79.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 121.074 0.464 . . . . 0.0 110.778 -179.29 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 836' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -72.06 -45.47 60.61 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.692 179.563 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 837' ' ' ARG . . . . . . . . . . . . . 19.2 ttp180 -53.73 -47.73 70.32 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.377 -0.828 . . . . 0.0 111.07 177.386 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 838' ' ' ARG . . . . . 0.445 ' HD2' ' HA ' ' A' ' 835' ' ' ILE . 0.0 OUTLIER -66.01 -29.6 70.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.806 -179.827 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.92 -51.4 62.06 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.727 179.475 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 840' ' ' LEU . . . . . 0.496 ' H ' ' HG ' ' A' ' 840' ' ' LEU . 0.0 OUTLIER -72.32 -29.6 63.99 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.673 0.273 . . . . 0.0 110.873 -179.859 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -66.65 -31.14 71.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.045 0.45 . . . . 0.0 110.442 176.888 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -68.5 -44.16 75.29 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.806 175.05 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 843' ' ' GLN . . . . . 0.622 ' HG3' HD23 ' A' ' 929' ' ' LEU . 0.0 OUTLIER -60.39 -52.42 65.32 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.861 178.929 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 844' ' ' LEU . . . . . 0.526 ' HG ' HD23 ' A' ' 847' ' ' LEU . 0.2 OUTLIER -61.63 -31.62 71.72 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.91 177.555 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -65.36 -33.63 87.17 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 121.122 -0.561 . . . . 0.0 112.364 177.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.29 -22.85 51.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.963 0.411 . . . . 0.0 110.291 175.721 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 847' ' ' LEU . . . . . 0.526 HD23 ' HG ' ' A' ' 844' ' ' LEU . 1.0 OUTLIER -72.98 -44.33 61.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.06 177.478 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 100.19 25.48 8.88 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.54 -0.838 . . . . 0.0 113.912 172.364 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 6.0 m-30 -103.68 169.12 8.71 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 117.254 0.527 . . . . 0.0 109.865 176.934 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 850' ' ' GLN . . . . . 0.563 ' HB2' ' O ' ' A' ' 825' ' ' MET . 2.2 mt-30 -69.1 111.33 5.0 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 110.368 -0.234 . . . . 0.0 110.368 -178.577 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -98.63 112.94 24.84 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.055 0.455 . . . . 0.0 111.409 -175.092 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 852' ' ' LYS . . . . . 0.678 ' HB3' HD12 ' A' ' 828' ' ' LEU . 0.2 OUTLIER -101.56 110.48 22.48 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 173.851 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.26 117.6 29.78 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.666 -175.868 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 854' ' ' ALA . . . . . 0.502 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -136.83 162.28 33.65 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.626 178.796 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 26.7 p-10 -153.01 75.53 1.09 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.095 0.474 . . . . 0.0 111.689 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 856' ' ' ASP . . . . . . . . . . . . . 27.9 t70 173.1 150.94 0.07 Allowed 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.176 176.159 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -72.33 -47.85 27.28 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 121.183 -0.532 . . . . 0.0 112.656 -179.178 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -73.16 -34.14 43.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.027 0.442 . . . . 0.0 110.232 -177.099 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -61.49 -35.14 76.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.793 176.005 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 860' ' ' ALA . . . . . 0.427 ' O ' HG12 ' A' ' 863' ' ' VAL . . . -66.28 -39.5 89.43 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.681 177.573 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 861' ' ' LEU . . . . . 0.625 HD11 ' HB3' ' A' ' 889' ' ' ARG . 1.9 mt -67.17 -40.92 86.66 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.156 0.503 . . . . 0.0 110.337 177.348 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -63.0 -45.72 91.06 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.522 178.692 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 863' ' ' VAL . . . . . 0.427 HG12 ' O ' ' A' ' 860' ' ' ALA . 0.3 OUTLIER -66.36 -31.99 56.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.918 179.913 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 864' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.6 -35.75 80.55 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.913 0.387 . . . . 0.0 110.084 175.851 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 2.2 m -74.4 -37.97 63.24 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.438 178.291 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -65.03 -54.03 36.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.164 -179.426 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -144.17 143.19 30.98 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.505 -179.416 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -73.5 140.56 46.48 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.962 -179.742 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 869' ' ' ILE . . . . . . . . . . . . . 1.9 mp -120.55 134.05 65.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.023 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -74.88 -55.46 5.78 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.039 0.447 . . . . 0.0 110.617 -177.769 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 871' ' ' ILE . . . . . 0.58 ' HB ' HG23 ' A' ' 827' ' ' ILE . 28.4 mm -117.2 120.83 66.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.157 -177.861 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 872' ' ' VAL . . . . . 0.532 HG21 HD12 ' A' ' 897' ' ' LEU . 0.0 OUTLIER -105.82 125.56 61.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.821 -178.055 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 873' ' ' LEU . . . . . 0.76 HD12 HG12 ' A' ' 829' ' ' VAL . 26.5 mt -110.95 108.77 18.64 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 177.01 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 2.1 m -94.39 96.72 9.71 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 177.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 875' ' ' ASP . . . . . 0.578 ' O ' ' HA ' ' A' ' 831' ' ' ASP . 3.1 m-20 -93.03 104.41 16.63 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.822 0.82 . . . . 0.0 110.78 -173.762 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 876' ' ' VAL . . . . . 0.635 ' HB ' HG23 ' A' ' 903' ' ' THR . 0.2 OUTLIER -104.65 89.07 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.752 -178.244 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -68.54 -43.45 76.67 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 174.683 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 10.6 ptm -154.32 148.94 19.58 Favored Pre-proline 0 N--CA 1.452 -0.346 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.496 173.022 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 879' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -75.0 58.43 4.89 Favored 'Trans proline' 0 N--CA 1.464 -0.244 0 C-N-CA 122.682 2.255 . . . . 0.0 111.796 178.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 44.6 t30 -73.09 -57.09 4.28 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.993 -178.372 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.61 -59.64 2.66 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.699 -179.528 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -166.16 152.25 9.01 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.526 -178.347 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -149.36 22.77 1.22 Allowed Glycine 0 N--CA 1.443 -0.866 0 C-N-CA 121.056 -0.592 . . . . 0.0 111.951 178.889 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -149.17 -36.99 0.17 Allowed 'General case' 0 C--O 1.235 0.312 0 CA-C-O 120.47 0.176 . . . . 0.0 111.462 -179.727 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -68.44 -46.24 70.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.495 -176.585 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -55.89 -49.78 72.48 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.394 177.787 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.1 -45.35 87.36 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.437 -177.884 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -64.67 -49.99 68.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.929 179.577 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 889' ' ' ARG . . . . . 0.625 ' HB3' HD11 ' A' ' 861' ' ' LEU . 0.0 OUTLIER -64.15 -41.16 97.29 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.853 -174.659 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 890' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -68.5 -40.41 82.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 111.511 0.189 . . . . 0.0 111.511 -176.646 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 891' ' ' ARG . . . . . 0.428 ' HB3' ' HA2' ' A' ' 918' ' ' GLY . 0.4 OUTLIER -75.31 -24.38 57.44 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.068 0.461 . . . . 0.0 110.425 178.988 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -73.36 -54.79 7.48 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.795 178.753 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 893' ' ' LEU . . . . . 0.454 ' HA ' HD13 ' A' ' 893' ' ' LEU . 1.8 mm? -67.2 -50.85 59.37 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.306 -174.489 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 166.46 82.96 0.05 OUTLIER Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 119.775 -1.202 . . . . 0.0 112.887 -178.223 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 895' ' ' LEU . . . . . . . . . . . . . 4.6 tp -89.93 109.33 20.36 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 175.462 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.16 6.26 5.9 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.054 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 897' ' ' LEU . . . . . 0.532 HD12 HG21 ' A' ' 872' ' ' VAL . 0.0 OUTLIER -123.81 141.22 36.22 Favored Pre-proline 0 C--N 1.325 -0.461 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 179.89 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -61.8 114.67 2.38 Favored 'Trans proline' 0 C--O 1.236 0.422 0 C-N-CA 122.799 2.333 . . . . 0.0 112.847 -176.58 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 899' ' ' VAL . . . . . 0.665 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 27.1 t -98.64 113.4 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-O 121.361 0.601 . . . . 0.0 110.257 177.923 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 900' ' ' ILE . . . . . 0.422 HG13 ' OG ' ' A' ' 921' ' ' SER . 1.7 mp -85.63 112.5 22.45 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.688 176.648 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -89.87 104.33 3.11 Favored Glycine 0 N--CA 1.443 -0.878 0 C-N-CA 120.595 -0.812 . . . . 0.0 111.464 177.486 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 902' ' ' VAL . . . . . 0.813 HG22 ' HE2' ' A' ' 925' ' ' LYS . 0.2 OUTLIER -110.59 103.34 15.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.632 0.729 . . . . 0.0 109.663 179.537 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 903' ' ' THR . . . . . 0.635 HG23 ' HB ' ' A' ' 876' ' ' VAL . 0.2 OUTLIER -108.64 149.13 29.37 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.356 -174.44 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -94.76 135.87 35.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.668 175.336 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 61.28 -156.77 0.34 Allowed 'General case' 0 C--N 1.33 -0.268 0 O-C-N 123.676 0.61 . . . . 0.0 110.247 -176.328 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . 68.92 -71.84 0.11 Allowed 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.39 0.676 . . . . 0.0 111.959 176.845 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 97.6 mt 68.92 176.33 0.27 Allowed 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 123.203 0.601 . . . . 0.0 111.069 -179.793 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . 65.49 30.36 10.78 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.518 0.675 . . . . 0.0 109.759 -173.189 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -67.65 -18.02 64.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.842 -1.072 . . . . 0.0 111.546 -174.874 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 910' ' ' GLU . . . . . 0.441 ' HA ' ' SG ' ' A' ' 922' ' ' CYS . 0.4 OUTLIER -66.13 -42.02 89.69 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.956 0.408 . . . . 0.0 109.963 176.431 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 911' ' ' LYS . . . . . 0.418 ' HE2' HD12 ' A' ' 915' ' ' LEU . 0.0 OUTLIER -73.3 -34.05 65.53 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.043 178.902 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -66.1 -43.33 87.57 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.859 178.365 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 913' ' ' ARG . . . . . 0.465 ' HA ' ' SD ' ' A' ' 919' ' ' MET . 0.0 OUTLIER -63.12 -35.67 81.05 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.71 179.649 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 82.6 m -71.8 -37.23 70.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.902 0.382 . . . . 0.0 110.349 176.588 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 915' ' ' LEU . . . . . 0.418 HD12 ' HE2' ' A' ' 911' ' ' LYS . 0.2 OUTLIER -62.53 -51.76 66.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.168 -179.252 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -77.5 -33.0 54.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.299 -177.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.21 48.84 22.29 Favored 'General case' 0 N--CA 1.464 0.266 0 O-C-N 123.675 0.61 . . . . 0.0 111.433 -177.402 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 918' ' ' GLY . . . . . 0.428 ' HA2' ' HB3' ' A' ' 891' ' ' ARG . . . -140.15 25.02 2.66 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.295 -178.667 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 919' ' ' MET . . . . . 0.665 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -129.72 -111.66 0.26 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.623 0.249 . . . . 0.0 110.757 -177.473 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 920' ' ' ASP . . . . . . . . . . . . . 10.8 t70 169.33 -60.13 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 123.986 0.914 . . . . 0.0 109.034 177.375 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 921' ' ' SER . . . . . 0.422 ' OG ' HG13 ' A' ' 900' ' ' ILE . 0.0 OUTLIER -123.17 170.08 10.6 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.808 178.363 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 922' ' ' CYS . . . . . 0.441 ' SG ' ' HA ' ' A' ' 910' ' ' GLU . 0.8 OUTLIER -144.64 130.39 19.15 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.7 0.286 . . . . 0.0 110.804 -179.34 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 923' ' ' LEU . . . . . 0.544 ' O ' ' HA ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -139.04 165.62 26.67 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 177.327 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -87.43 147.9 25.22 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.004 177.804 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 925' ' ' LYS . . . . . 0.813 ' HE2' HG22 ' A' ' 902' ' ' VAL . 0.0 OUTLIER -47.56 -38.81 18.1 Favored Pre-proline 0 CA--C 1.539 0.545 0 N-CA-C 114.02 1.118 . . . . 0.0 114.02 -179.008 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -58.66 77.28 0.04 OUTLIER 'Trans proline' 0 C--N 1.358 1.066 0 C-N-CA 122.039 1.826 . . . . 0.0 112.777 170.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 88.9 t -107.76 97.05 5.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.872 178.202 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 928' ' ' THR . . . . . 0.405 ' O ' HG22 ' A' ' 932' ' ' ILE . 0.2 OUTLIER -71.87 170.26 14.07 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.436 -179.674 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 929' ' ' LEU . . . . . 0.622 HD23 ' HG3' ' A' ' 843' ' ' GLN . 0.7 OUTLIER -52.29 -45.84 65.65 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.139 -0.482 . . . . 0.0 112.06 -177.314 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 930' ' ' ASP . . . . . 0.463 ' HA ' ' HE3' ' A' ' 933' ' ' LYS . 0.5 OUTLIER -69.89 -33.6 72.43 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.764 -0.375 . . . . 0.0 110.437 -177.738 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 43.1 t -66.48 -52.12 49.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.768 -179.875 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 932' ' ' ILE . . . . . 0.498 HD11 HD12 ' A' ' 844' ' ' LEU . 3.8 tt -65.15 -36.4 77.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.92 0.391 . . . . 0.0 110.582 -179.023 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 933' ' ' LYS . . . . . 0.463 ' HE3' ' HA ' ' A' ' 930' ' ' ASP . 0.3 OUTLIER -68.2 -47.6 67.46 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.139 -179.398 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 934' ' ' GLN . . . . . 0.53 ' HG3' ' N ' ' A' ' 935' ' ' THR . 0.4 OUTLIER -68.34 -36.52 79.37 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.694 -0.23 . . . . 0.0 111.231 -177.551 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 935' ' ' THR . . . . . 0.53 ' N ' ' HG3' ' A' ' 934' ' ' GLN . 22.9 m -67.34 -43.89 80.45 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.896 0.379 . . . . 0.0 110.531 178.534 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 936' ' ' LEU . . . . . 0.501 HD13 ' HA ' ' A' ' 936' ' ' LEU . 0.2 OUTLIER -63.5 -47.5 81.45 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.639 179.073 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 34.2 m -62.92 -42.12 99.69 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.004 -179.74 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 938' ' ' LEU . . . . . 0.466 ' HB2' ' O ' ' A' ' 934' ' ' GLN . 0.6 OUTLIER -60.39 -45.24 94.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.022 179.505 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -78.63 -27.33 45.38 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.699 -175.295 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -64.3 -43.61 94.18 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.382 0.611 . . . . 0.0 110.089 174.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 941' ' ' GLU . . . . . 0.418 ' HG3' ' N ' ' A' ' 942' ' ' ARG . 0.0 OUTLIER -73.63 -29.67 62.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.109 177.152 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 942' ' ' ARG . . . . . 0.439 HH11 ' HD3' ' A' ' 942' ' ' ARG . 0.2 OUTLIER -65.9 -47.09 75.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.137 179.973 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 27.5 m -68.17 -29.83 45.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.893 0.378 . . . . 0.0 110.439 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.4 -31.39 71.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.583 174.453 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 20.4 mmtm -70.06 -36.37 74.93 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.071 178.657 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.96 -45.12 12.49 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.409 -176.223 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 947' ' ' ARG . . . . . 0.41 ' HE ' ' HB3' ' A' ' 947' ' ' ARG . 0.1 OUTLIER -73.88 -52.59 12.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.28 -177.893 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -102.11 -140.15 0.35 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.71 0.291 . . . . 0.0 110.842 -175.795 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.246 0.894 0 CA-C-O 118.753 -0.641 . . . . 0.0 110.441 -176.758 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 1.7 ttt . . . . . 0 N--CA 1.478 0.942 0 CA-C-O 120.982 0.42 . . . . 0.0 110.07 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 177.27 46.37 0.06 OUTLIER Glycine 0 N--CA 1.446 -0.659 0 N-CA-C 111.054 -0.818 . . . . 0.0 111.054 -179.25 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . 171.82 148.23 6.05 Favored Glycine 0 N--CA 1.445 -0.764 0 C-N-CA 121.224 -0.512 . . . . 0.0 111.824 -176.873 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -110.51 -77.59 0.59 Allowed 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.83 0.348 . . . . 0.0 110.446 -179.509 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . -170.05 -156.76 11.41 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.981 -0.628 . . . . 0.0 111.636 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER 50.46 37.73 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-O 121.318 0.58 . . . . 0.0 111.083 -179.685 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -84.14 -24.78 30.08 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.154 -179.735 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . 147.21 121.78 1.3 Allowed Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.947 -0.644 . . . . 0.0 111.949 178.154 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 1.3 tp -81.29 -29.17 34.37 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 177.077 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 705' ' ' SER . . . . . 0.755 ' HA ' ' O ' ' A' ' 730' ' ' GLY . 0.9 OUTLIER -63.88 89.4 0.05 Allowed 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.619 172.74 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 154.71 -19.77 0.59 Allowed Glycine 0 N--CA 1.448 -0.513 0 N-CA-C 111.033 -0.827 . . . . 0.0 111.033 -175.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 4.1 mmtt -77.48 130.99 37.72 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 174.872 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 708' ' ' ARG . . . . . 0.448 ' HA ' HG13 ' A' ' 732' ' ' VAL . 5.9 mtm-85 -95.64 139.55 31.73 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.235 0.54 . . . . 0.0 111.86 -171.06 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -122.39 116.58 24.26 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.612 174.897 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 710' ' ' TRP . . . . . 0.694 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 93.0 m95 -99.65 118.55 36.43 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.721 0.295 . . . . 0.0 110.298 -177.296 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 711' ' ' LEU . . . . . 0.525 HD23 ' C ' ' A' ' 710' ' ' TRP . 5.2 mt -111.25 118.15 35.13 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.836 0.351 . . . . 0.0 111.424 -176.038 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 712' ' ' ALA . . . . . 0.56 ' HB3' ' HB ' ' A' ' 749' ' ' THR . . . -108.08 44.53 1.1 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.573 0.701 . . . . 0.0 109.382 174.769 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 713' ' ' VAL . . . . . 0.843 HG13 ' HB3' ' A' ' 750' ' ' ASP . 16.3 t -100.29 124.84 54.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.583 -177.655 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 714' ' ' ARG . . . . . 0.409 HH11 ' HD3' ' A' ' 714' ' ' ARG . 2.1 mtp180 -88.73 -21.02 24.07 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 177.645 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 715' ' ' ASN . . . . . 0.414 ' HB3' ' HB2' ' A' ' 718' ' ' LEU . 3.7 m-80 -71.39 102.4 2.62 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.876 174.665 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 716' ' ' ALA . . . . . 0.549 ' O ' ' HB2' ' A' ' 720' ' ' GLN . . . -59.95 -35.93 75.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.333 -177.21 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.44 -46.35 88.92 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.134 0.492 . . . . 0.0 110.549 178.615 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 718' ' ' LEU . . . . . 0.576 ' HB3' HG11 ' A' ' 713' ' ' VAL . 0.3 OUTLIER -69.38 -48.98 59.52 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.84 -179.76 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 719' ' ' CYS . . . . . 0.656 ' HB2' ' HB ' ' A' ' 713' ' ' VAL . 12.2 t -60.92 -51.77 67.85 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.702 -177.354 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 720' ' ' GLN . . . . . 0.783 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 1.2 mt-30 -63.03 -36.28 83.05 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.767 -176.713 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -59.48 -52.89 63.63 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.169 0.509 . . . . 0.0 110.4 179.099 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 48.9 mt -66.9 -48.25 69.3 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.316 -178.034 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 723' ' ' GLU . . . . . 0.783 ' HG2' ' HA ' ' A' ' 720' ' ' GLN . 1.4 pt-20 -60.94 -44.76 96.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.825 -173.684 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 724' ' ' THR . . . . . 0.618 ' N ' ' HG3' ' A' ' 723' ' ' GLU . 16.0 m -64.75 -43.3 93.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.79 0.329 . . . . 0.0 110.775 -179.394 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 18.5 m -63.73 -40.16 96.05 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.342 179.78 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 726' ' ' LEU . . . . . 0.462 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 11.0 mt -71.95 -37.96 69.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.842 0.354 . . . . 0.0 111.211 -179.041 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -66.17 -15.25 62.98 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.862 0.363 . . . . 0.0 111.319 179.365 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.44 -16.12 60.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.096 0.474 . . . . 0.0 110.612 176.906 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -104.39 -1.08 27.34 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.157 0.503 . . . . 0.0 110.783 177.435 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 730' ' ' GLY . . . . . 0.755 ' O ' ' HA ' ' A' ' 705' ' ' SER . . . 98.13 -0.63 58.88 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.52 179.23 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 731' ' ' ILE . . . . . 0.462 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 36.6 mm -66.22 120.05 12.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 120.683 0.278 . . . . 0.0 110.402 -178.539 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 732' ' ' VAL . . . . . 0.448 HG13 ' HA ' ' A' ' 708' ' ' ARG . 1.5 p -78.22 98.14 2.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 122.028 0.918 . . . . 0.0 110.06 -179.384 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 733' ' ' VAL . . . . . 0.55 HG21 ' HA ' ' A' ' 723' ' ' GLU . 82.8 t -81.96 119.95 32.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 114.915 -1.039 . . . . 0.0 110.601 179.746 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.33 125.46 44.39 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.945 177.603 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -59.74 114.42 2.76 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.646 177.334 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 736' ' ' TYR . . . . . 0.694 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 65.1 t80 -72.19 95.31 1.65 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.96 -179.871 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 737' ' ' GLU . . . . . 0.519 ' H ' ' HG3' ' A' ' 737' ' ' GLU . 0.0 OUTLIER -92.86 -52.83 4.42 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.139 0.495 . . . . 0.0 109.912 176.82 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -165.62 68.53 0.2 Allowed Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 111.083 -0.807 . . . . 0.0 111.083 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 15.7 mp0 -117.12 179.71 3.95 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.778 0.323 . . . . 0.0 110.581 -175.907 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -98.91 142.99 25.56 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.479 -179.123 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 741' ' ' PRO . . . . . 0.581 ' HB2' ' O ' ' A' ' 758' ' ' GLN . 71.8 Cg_endo -79.27 147.5 20.55 Favored 'Trans proline' 0 CA--C 1.532 0.414 0 C-N-CA 122.865 2.377 . . . . 0.0 113.446 -177.911 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 742' ' ' THR . . . . . 0.76 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.1 OUTLIER -132.61 144.24 52.11 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.597 179.122 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 743' ' ' PRO . . . . . 0.835 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 28.7 Cg_endo -62.5 -12.6 28.69 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 123.573 2.849 . . . . 0.0 113.777 -175.13 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 31.8 tp10 -98.08 -9.99 25.02 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.061 0.457 . . . . 0.0 110.792 179.39 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 745' ' ' ASP . . . . . 0.405 ' HB3' ' HD1' ' A' ' 710' ' ' TRP . 74.6 m-20 -106.65 158.47 16.93 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.321 -167.845 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 746' ' ' VAL . . . . . 0.511 HG11 HD11 ' A' ' 795' ' ' LEU . 6.4 p -126.64 138.56 54.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.731 -179.053 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 747' ' ' LEU . . . . . 0.49 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 0.0 OUTLIER -103.79 103.35 13.22 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.916 177.167 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 27.5 mt -94.93 107.64 19.75 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 175.377 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 749' ' ' THR . . . . . 0.56 ' HB ' ' HB3' ' A' ' 712' ' ' ALA . 1.9 t -119.92 148.19 43.81 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.611 -174.981 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 750' ' ' ASP . . . . . 0.843 ' HB3' HG13 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -109.54 126.32 53.44 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 176.421 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 751' ' ' GLU . . . . . 0.491 ' HB2' ' O ' ' A' ' 750' ' ' ASP . 3.6 mm-40 74.5 173.93 0.27 Allowed 'General case' 0 C--O 1.235 0.325 0 CA-C-N 114.684 -1.143 . . . . 0.0 110.372 -170.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 752' ' ' VAL . . . . . 0.837 HG13 HG13 ' A' ' 772' ' ' ILE . 27.7 t -81.31 102.82 7.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.243 -176.208 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 753' ' ' VAL . . . . . 0.626 HG13 ' HB2' ' A' ' 755' ' ' LYS . 7.1 p -80.7 -1.21 4.67 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.09 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 40.7 m 58.88 40.3 22.86 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.404 178.618 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 755' ' ' LYS . . . . . 0.626 ' HB2' HG13 ' A' ' 753' ' ' VAL . 0.0 OUTLIER -130.14 153.87 48.08 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.579 178.28 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 756' ' ' LYS . . . . . 0.542 ' O ' ' HD2' ' A' ' 756' ' ' LYS . 0.0 OUTLIER -95.78 -49.26 5.42 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 123.071 0.232 . . . . 0.0 111.136 -178.079 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 757' ' ' TRP . . . . . 0.49 ' CD2' ' HB2' ' A' ' 747' ' ' LEU . 71.4 t-105 76.88 139.47 0.07 Allowed 'General case' 0 N--CA 1.467 0.402 0 O-C-N 123.88 0.737 . . . . 0.0 110.634 179.486 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 758' ' ' GLN . . . . . 0.581 ' O ' ' HB2' ' A' ' 741' ' ' PRO . 0.0 OUTLIER -128.37 105.02 8.05 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.81 178.341 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 759' ' ' GLY . . . . . 0.835 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -178.03 -140.77 3.93 Favored Glycine 0 N--CA 1.44 -1.085 0 C-N-CA 119.733 -1.222 . . . . 0.0 112.824 -178.914 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 760' ' ' ARG . . . . . 0.407 ' HD2' HH11 ' A' ' 760' ' ' ARG . 7.2 ttm105 -67.19 -52.76 37.36 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.927 0.394 . . . . 0.0 110.086 -179.219 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -170.44 165.32 8.63 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.53 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 2.2 p -131.66 120.52 45.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.845 174.76 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 57.9 t -104.92 104.03 16.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 116.165 -0.471 . . . . 0.0 109.929 -178.436 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 764' ' ' THR . . . . . 0.547 HG21 HD12 ' A' ' 772' ' ' ILE . 38.5 m -103.18 117.5 34.67 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.415 -177.816 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 765' ' ' PHE . . . . . 0.633 ' HZ ' ' HG ' ' A' ' 791' ' ' LEU . 75.9 m-85 -81.84 133.3 35.31 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.046 176.477 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -95.93 136.43 36.38 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 -179.032 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 767' ' ' ARG . . . . . 0.466 ' HB3' ' HD2' ' A' ' 768' ' ' ARG . 0.0 OUTLIER -136.92 -73.04 0.43 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.722 0.296 . . . . 0.0 110.953 -178.253 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 768' ' ' ARG . . . . . 0.466 ' HD2' ' HB3' ' A' ' 767' ' ' ARG . 0.0 OUTLIER -112.25 -35.28 5.66 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.028 -176.396 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 74.3 m80 -100.33 136.94 39.45 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.308 -178.298 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 2.6 mt -129.92 127.74 64.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.955 -179.199 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . 148.72 26.1 0.07 OUTLIER Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.317 -0.944 . . . . 0.0 112.972 179.293 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 772' ' ' ILE . . . . . 0.837 HG13 HG13 ' A' ' 752' ' ' VAL . 0.0 OUTLIER -104.56 146.49 32.72 Favored Pre-proline 0 C--N 1.324 -0.5 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 176.912 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 773' ' ' PRO . . . . . 0.499 ' HD2' HG12 ' A' ' 772' ' ' ILE . 26.4 Cg_endo -61.73 125.76 17.42 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.615 2.21 . . . . 0.0 112.82 -178.398 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 774' ' ' LEU . . . . . 0.588 ' HA ' HG13 ' A' ' 782' ' ' VAL . 0.4 OUTLIER -98.13 -162.14 0.93 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.893 176.666 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 775' ' ' GLU . . . . . 0.591 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 2.4 mp0 -67.62 59.6 0.06 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 122.099 0.952 . . . . 0.0 112.691 177.903 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 14.5 ptpt -128.19 10.9 6.39 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 167.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 777' ' ' ALA . . . . . 0.728 ' HB1' ' HD2' ' A' ' 778' ' ' PRO . . . -133.79 164.63 42.61 Favored Pre-proline 0 N--CA 1.446 -0.645 0 CA-C-N 113.741 -1.572 . . . . 0.0 108.692 178.485 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 778' ' ' PRO . . . . . 0.728 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 14.2 Cg_endo -55.44 -24.35 43.22 Favored 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 123.591 2.861 . . . . 0.0 115.64 -169.756 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . -158.49 27.62 0.42 Allowed Glycine 0 CA--C 1.507 -0.407 0 C-N-CA 119.804 -1.189 . . . . 0.0 112.316 -174.715 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 780' ' ' GLU . . . . . 0.591 ' O ' ' HG3' ' A' ' 775' ' ' GLU . 13.8 mp0 -103.67 129.13 50.95 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -175.384 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 14.3 m95 -133.01 140.6 47.83 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 -177.561 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 782' ' ' VAL . . . . . 0.588 HG13 ' HA ' ' A' ' 774' ' ' LEU . 4.4 m -135.7 148.71 28.03 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.319 0 CA-C-O 120.53 0.205 . . . . 0.0 110.637 174.008 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 783' ' ' HIS . . . . . 0.564 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.1 OUTLIER -169.98 148.72 3.5 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.793 0.33 . . . . 0.0 110.978 177.771 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 784' ' ' SER . . . . . 0.414 ' HB3' ' NH1' ' A' ' 767' ' ' ARG . 0.9 OUTLIER -105.48 102.32 11.8 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.078 175.94 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 785' ' ' VAL . . . . . 0.868 HG13 ' H ' ' A' ' 787' ' ' ALA . 1.4 p -171.03 160.02 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 -179.627 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -94.63 25.01 4.22 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.787 0.327 . . . . 0.0 111.289 -178.574 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 787' ' ' ALA . . . . . 0.868 ' H ' HG13 ' A' ' 785' ' ' VAL . . . 52.43 64.47 7.41 Favored Pre-proline 0 CA--C 1.535 0.378 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.972 -179.491 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 788' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -65.43 -50.68 1.78 Allowed 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.55 2.166 . . . . 0.0 111.947 -178.113 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -161.98 -30.84 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.06 -179.685 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 790' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.57 -45.17 95.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.914 -0.584 . . . . 0.0 112.14 -178.183 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 791' ' ' LEU . . . . . 0.633 ' HG ' ' HZ ' ' A' ' 765' ' ' PHE . 0.3 OUTLIER -66.41 -53.66 29.2 Favored Pre-proline 0 CA--C 1.534 0.363 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -177.469 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 792' ' ' PRO . . . . . 0.415 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 9.7 Cg_endo -56.97 -34.58 97.76 Favored 'Trans proline' 0 C--N 1.357 0.98 0 C-N-CA 121.441 1.427 . . . . 0.0 112.17 176.187 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -64.05 -44.79 91.39 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.76 0.314 . . . . 0.0 110.624 176.408 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 794' ' ' LEU . . . . . 0.635 ' HA ' ' HD3' ' A' ' 797' ' ' ARG . 1.3 tm? -58.97 -49.13 79.05 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.16 178.678 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 795' ' ' LEU . . . . . 0.511 HD11 HG11 ' A' ' 746' ' ' VAL . 2.5 mm? -65.42 -41.24 93.76 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.336 -176.655 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -60.12 -50.36 74.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.286 -179.521 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 797' ' ' ARG . . . . . 0.635 ' HD3' ' HA ' ' A' ' 794' ' ' LEU . 0.0 OUTLIER -71.82 -25.4 61.97 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.583 -177.423 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -73.93 -23.73 19.1 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 CA-C-O 120.942 0.401 . . . . 0.0 111.29 178.436 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -80.26 -19.3 47.1 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.787 177.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 5.3 mt 67.8 92.45 0.08 Allowed 'General case' 0 C--O 1.234 0.265 0 O-C-N 124.291 0.995 . . . . 0.0 112.011 177.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 801' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -105.8 106.17 20.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 175.607 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -108.32 63.32 0.61 Allowed 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.762 -175.41 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 803' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -58.8 130.12 45.38 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.418 177.715 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 804' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -109.32 145.59 35.75 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.404 -179.375 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -94.74 155.72 16.71 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.244 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -115.95 112.05 21.29 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 177.788 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -118.24 96.48 49.8 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.866 -174.487 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 808' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -90.22 136.78 2.46 Favored 'Trans proline' 0 N--CA 1.451 -0.982 0 C-N-CA 123.471 2.781 . . . . 0.0 112.544 -179.048 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -169.15 154.99 6.27 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.769 177.642 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -166.34 60.74 0.1 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-O 121.018 0.437 . . . . 0.0 111.139 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -84.6 112.22 20.24 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.852 178.893 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 812' ' ' LEU . . . . . 0.421 HD13 ' HA ' ' A' ' 812' ' ' LEU . 0.0 OUTLIER -128.63 107.65 18.82 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.006 -177.564 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 813' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 812' ' ' LEU . 2.0 Cg_endo -82.32 122.4 3.67 Favored 'Trans proline' 0 N--CA 1.46 -0.441 0 C-N-CA 123.138 2.558 . . . . 0.0 111.786 177.673 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 2.5 m -144.8 115.48 7.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.796 0.332 . . . . 0.0 110.951 178.595 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 1.4 m -143.61 125.46 15.18 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.635 177.135 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -118.64 142.11 47.96 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.79 179.954 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 7.6 ptmm? -172.43 122.68 0.45 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.079 177.563 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -147.19 123.81 11.13 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.742 0.306 . . . . 0.0 111.527 -179.62 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 9.8 p -159.64 142.65 5.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.893 175.889 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 72.7 m -156.92 142.92 17.91 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 110.494 -0.187 . . . . 0.0 110.494 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -166.62 136.4 3.11 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.246 -0.433 . . . . 0.0 109.977 179.537 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 13.4 t30 -153.92 45.45 0.6 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.362 0.601 . . . . 0.0 110.577 178.612 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -130.96 159.62 36.93 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.554 178.484 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 824' ' ' ASP . . . . . 0.467 ' HB3' ' H ' ' A' ' 825' ' ' MET . 13.9 t0 -162.63 -102.42 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -177.057 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 825' ' ' MET . . . . . 0.467 ' H ' ' HB3' ' A' ' 824' ' ' ASP . 35.9 ttm -96.32 137.62 35.13 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.715 -175.863 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 826' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.66 120.23 37.38 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.886 -177.713 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 827' ' ' ILE . . . . . 0.71 HD12 ' HB ' ' A' ' 871' ' ' ILE . 13.0 mm -107.59 125.21 63.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.5 176.213 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 828' ' ' LEU . . . . . 0.407 ' HB3' HG21 ' A' ' 869' ' ' ILE . 6.7 tp -98.66 130.11 45.16 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.883 0.373 . . . . 0.0 110.613 -177.529 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 829' ' ' VAL . . . . . 0.549 HG21 HD12 ' A' ' 840' ' ' LEU . 0.2 OUTLIER -118.92 117.08 53.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.852 179.117 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 830' ' ' VAL . . . . . 0.434 HG13 ' HB3' ' A' ' 854' ' ' ALA . 0.0 OUTLIER -112.54 99.36 8.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 115.617 -0.719 . . . . 0.0 109.521 178.021 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 831' ' ' ASP . . . . . 0.665 ' HA ' ' O ' ' A' ' 875' ' ' ASP . 0.2 OUTLIER -117.29 146.98 42.97 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.834 0.349 . . . . 0.0 110.385 -178.609 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -91.75 -14.29 30.18 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.272 -172.449 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 2.5 m80 -124.98 98.42 36.35 Favored Pre-proline 0 C--N 1.327 -0.408 0 C-N-CA 120.881 -0.328 . . . . 0.0 111.346 -176.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 834' ' ' PRO . . . . . 0.632 ' HA ' ' HD3' ' A' ' 837' ' ' ARG . 15.1 Cg_exo -31.37 -41.98 0.11 Allowed 'Trans proline' 0 C--N 1.352 0.744 1 C-N-CA 125.899 4.399 . . . . 0.0 117.0 -169.29 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -58.94 -35.38 56.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.824 0.345 . . . . 0.0 111.569 -177.469 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 836' ' ' ASN . . . . . 0.595 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 22.4 m120 -72.32 -38.84 68.57 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 -179.002 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 837' ' ' ARG . . . . . 0.651 ' HG3' ' HB3' ' A' ' 831' ' ' ASP . 0.0 OUTLIER -51.72 -45.33 63.56 Favored 'General case' 0 C--O 1.224 -0.263 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.112 177.002 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 838' ' ' ARG . . . . . 0.489 ' HD3' ' N ' ' A' ' 839' ' ' LEU . 0.0 OUTLIER -59.09 -50.39 74.26 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.248 176.843 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 839' ' ' LEU . . . . . 0.489 ' N ' ' HD3' ' A' ' 838' ' ' ARG . 0.1 OUTLIER -62.99 -52.87 61.32 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.706 -0.679 . . . . 0.0 112.551 -170.045 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 840' ' ' LEU . . . . . 0.595 ' HG ' ' O ' ' A' ' 836' ' ' ASN . 0.0 OUTLIER -72.24 -33.11 67.28 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 120.293 -0.563 . . . . 0.0 110.964 -176.703 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -67.54 -39.3 85.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.933 0.397 . . . . 0.0 110.37 179.412 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.97 -41.18 97.63 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.089 177.396 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 843' ' ' GLN . . . . . 0.819 ' HG2' HD23 ' A' ' 929' ' ' LEU . 58.2 mt-30 -58.62 -48.05 82.3 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.214 175.672 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 844' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.81 -34.69 73.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.751 -0.658 . . . . 0.0 111.038 177.495 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -65.2 -40.2 96.6 Favored Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.89 -0.596 . . . . 0.0 112.411 178.738 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.81 -25.02 64.46 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.884 0.373 . . . . 0.0 110.574 178.416 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.18 -27.51 61.68 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.145 0.498 . . . . 0.0 110.196 176.06 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 94.39 25.46 16.1 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.755 -0.736 . . . . 0.0 113.16 175.206 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 849' ' ' TYR . . . . . 0.405 ' CE1' ' HB3' ' A' ' 825' ' ' MET . 0.4 OUTLIER -115.91 161.98 18.01 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.986 0.393 . . . . 0.0 110.654 179.86 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.55 131.0 37.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.321 -177.545 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -116.63 142.99 46.18 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.665 -178.957 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.11 109.84 13.4 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 175.603 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 853' ' ' THR . . . . . 0.441 HG22 ' HG2' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -94.21 133.99 37.15 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.945 0.402 . . . . 0.0 111.395 -175.988 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 854' ' ' ALA . . . . . 0.434 ' HB3' HG13 ' A' ' 830' ' ' VAL . . . -146.79 177.15 9.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.783 178.753 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 855' ' ' ASN . . . . . 0.574 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 42.5 t30 -154.58 80.72 1.1 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.349 177.754 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 856' ' ' ASP . . . . . 0.574 ' HB2' ' O ' ' A' ' 855' ' ' ASN . 2.1 t0 164.85 145.27 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.538 0 O-C-N 123.979 0.799 . . . . 0.0 110.151 177.285 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -73.59 -42.33 40.54 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.179 179.617 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 3.6 m -69.41 -31.34 49.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.778 0.323 . . . . 0.0 111.015 -178.463 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -73.96 -37.19 64.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.847 0.356 . . . . 0.0 110.539 179.418 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 860' ' ' ALA . . . . . 0.402 ' O ' HG12 ' A' ' 863' ' ' VAL . . . -61.1 -36.64 80.24 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.09 175.679 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 861' ' ' LEU . . . . . 0.855 HD21 ' HA ' ' A' ' 890' ' ' ILE . 6.8 mt -68.41 -43.46 77.14 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.574 176.763 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 32.5 t30 -58.69 -50.28 74.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.817 179.344 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 863' ' ' VAL . . . . . 0.529 HG13 HD11 ' A' ' 869' ' ' ILE . 1.6 p -64.4 -30.99 51.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.987 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 864' ' ' LEU . . . . . 0.474 ' HA ' HD12 ' A' ' 869' ' ' ILE . 0.7 OUTLIER -63.24 -38.02 89.53 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.002 0.429 . . . . 0.0 110.973 177.307 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -83.34 -18.89 37.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.909 0.385 . . . . 0.0 111.03 -177.45 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 11.6 tptp -87.54 -46.54 9.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.121 -178.879 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -130.9 165.49 22.96 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.874 -174.529 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 53.5 t60 -87.66 128.77 35.28 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.929 0.395 . . . . 0.0 110.695 -179.01 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 869' ' ' ILE . . . . . 0.529 HD11 HG13 ' A' ' 863' ' ' VAL . 4.4 mt -117.31 136.68 53.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.389 174.738 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 870' ' ' ASP . . . . . 0.412 ' OD2' ' HG3' ' A' ' 825' ' ' MET . 23.0 m-20 -88.53 -48.72 7.38 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.814 0.34 . . . . 0.0 110.856 -177.987 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 871' ' ' ILE . . . . . 0.71 ' HB ' HD12 ' A' ' 827' ' ' ILE . 6.6 mm -128.4 137.26 57.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.316 -179.127 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 872' ' ' VAL . . . . . 0.548 HG22 HD12 ' A' ' 897' ' ' LEU . 0.0 OUTLIER -110.4 117.9 55.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.66 0.267 . . . . 0.0 111.173 -179.36 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 873' ' ' LEU . . . . . 0.403 HD12 ' HB ' ' A' ' 829' ' ' VAL . 0.3 OUTLIER -105.09 113.0 26.33 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 175.192 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -104.71 96.85 6.85 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 177.671 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 875' ' ' ASP . . . . . 0.665 ' O ' ' HA ' ' A' ' 831' ' ' ASP . 52.8 t0 -104.83 106.95 17.66 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.395 0.617 . . . . 0.0 110.395 -174.876 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 876' ' ' VAL . . . . . 0.429 HG23 HG23 ' A' ' 903' ' ' THR . 0.0 OUTLIER -124.56 134.66 66.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.302 -176.273 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -72.1 -50.39 28.5 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 173.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 878' ' ' MET . . . . . 0.405 ' HA ' ' HD3' ' A' ' 879' ' ' PRO . 3.2 ptm -166.86 145.18 4.33 Favored Pre-proline 0 C--N 1.325 -0.479 0 CA-C-N 115.315 -0.857 . . . . 0.0 108.805 174.414 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 879' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 878' ' ' MET . 51.6 Cg_exo -56.07 -37.54 96.16 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.715 2.277 . . . . 0.0 112.739 -177.595 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 5.5 t30 62.73 25.29 15.03 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.131 0.491 . . . . 0.0 110.946 178.03 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 2.8 ttm -178.45 -78.21 0.01 OUTLIER 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.476 -177.387 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -154.24 150.97 28.62 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.046 -0.525 . . . . 0.0 109.923 175.727 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -121.98 42.52 1.64 Allowed Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 111.264 -0.735 . . . . 0.0 111.264 176.889 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 30.7 t80 -122.68 -44.34 2.22 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.082 0.468 . . . . 0.0 110.423 -177.015 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.46 -38.51 80.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.074 -177.793 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.33 -48.89 73.85 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.62 -178.48 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.53 -42.68 98.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.442 -178.704 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.16 -48.52 81.19 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.37 178.562 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 889' ' ' ARG . . . . . 0.405 ' HB3' HD11 ' A' ' 861' ' ' LEU . 0.0 OUTLIER -63.15 -41.87 99.35 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.768 -176.651 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 890' ' ' ILE . . . . . 0.855 ' HA ' HD21 ' A' ' 861' ' ' LEU . 8.1 mm -58.8 -52.81 55.74 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 121.131 0.491 . . . . 0.0 111.023 -178.888 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 891' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -71.48 -22.72 61.77 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.795 -179.1 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.31 -45.85 78.91 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.832 0.349 . . . . 0.0 110.41 177.986 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -67.82 -43.8 78.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.301 178.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 125.41 81.5 0.44 Allowed Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 120.219 -0.991 . . . . 0.0 112.567 178.133 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 895' ' ' LEU . . . . . 0.631 ' O ' ' HG ' ' A' ' 895' ' ' LEU . 0.3 OUTLIER -70.33 120.67 16.34 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.244 0.545 . . . . 0.0 110.211 178.452 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -113.97 8.86 17.29 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.601 0.715 . . . . 0.0 110.895 179.22 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 897' ' ' LEU . . . . . 0.548 HD12 HG22 ' A' ' 872' ' ' VAL . 0.0 OUTLIER -130.43 137.85 31.74 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.541 -176.481 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -58.97 120.38 8.21 Favored 'Trans proline' 0 C--O 1.236 0.406 0 C-N-CA 122.656 2.237 . . . . 0.0 112.104 -178.647 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 899' ' ' VAL . . . . . 0.714 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 7.4 t -95.36 127.71 47.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.096 0.474 . . . . 0.0 110.629 -179.118 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 900' ' ' ILE . . . . . 0.529 HG23 ' HB2' ' A' ' 921' ' ' SER . 4.5 mt -107.95 109.6 28.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.851 176.215 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 901' ' ' GLY . . . . . 0.462 ' HA3' ' SD ' ' A' ' 919' ' ' MET . . . -92.95 97.82 2.31 Favored Glycine 0 N--CA 1.444 -0.812 0 CA-C-N 115.865 -0.607 . . . . 0.0 112.319 -178.124 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 902' ' ' VAL . . . . . 0.946 ' HB ' ' HB3' ' A' ' 923' ' ' LEU . 0.2 OUTLIER -94.07 119.77 42.47 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.218 0.532 . . . . 0.0 109.797 175.981 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 903' ' ' THR . . . . . 0.506 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.3 OUTLIER -125.68 154.68 42.02 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.562 -179.098 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -88.22 102.56 14.93 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.636 -0.426 . . . . 0.0 110.685 178.262 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 14.2 t30 40.65 67.55 0.5 Allowed 'General case' 0 N--CA 1.47 0.574 0 O-C-N 124.135 0.897 . . . . 0.0 112.168 176.64 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -72.83 -53.36 11.68 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.035 -177.088 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 167.52 -53.68 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 -176.937 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -163.87 86.6 0.49 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.379 -1.282 . . . . 0.0 109.164 178.68 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -55.15 -36.46 65.84 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.576 -176.628 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 910' ' ' GLU . . . . . 0.573 ' HG2' ' N ' ' A' ' 911' ' ' LYS . 8.0 pm0 -68.43 -40.48 81.16 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.661 -179.684 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 911' ' ' LYS . . . . . 0.573 ' N ' ' HG2' ' A' ' 910' ' ' GLU . 7.2 tttt -71.07 -35.11 71.76 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.127 -178.884 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 912' ' ' GLN . . . . . 0.585 ' O ' ' HG3' ' A' ' 916' ' ' GLU . 5.0 tp60 -60.03 -48.05 83.32 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.765 175.191 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 913' ' ' ARG . . . . . 0.576 ' HA ' ' OE2' ' A' ' 916' ' ' GLU . 0.0 OUTLIER -59.75 -34.78 73.4 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.123 179.017 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 66.3 m -70.71 -33.91 71.36 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.906 0.384 . . . . 0.0 110.607 177.502 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.71 -52.87 15.57 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.559 -178.968 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 916' ' ' GLU . . . . . 0.585 ' HG3' ' O ' ' A' ' 912' ' ' GLN . 1.2 pp20? -78.17 -46.73 19.77 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.215 -176.135 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 1.4 m 51.16 43.94 28.94 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.727 -175.369 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 918' ' ' GLY . . . . . 0.409 ' H ' ' CD ' ' A' ' 916' ' ' GLU . . . -122.86 -32.55 0.92 Allowed Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.024 179.238 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 919' ' ' MET . . . . . 0.714 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 75.0 mtm -72.58 -91.01 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 176.987 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 920' ' ' ASP . . . . . 0.712 ' HB2' ' O ' ' A' ' 919' ' ' MET . 14.8 t0 149.31 -49.09 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.923 1.289 . . . . 0.0 110.43 172.682 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 921' ' ' SER . . . . . 0.529 ' HB2' HG23 ' A' ' 900' ' ' ILE . 0.8 OUTLIER -113.62 148.8 35.59 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.832 0.349 . . . . 0.0 110.69 179.878 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 922' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -117.26 141.96 47.65 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.056 178.842 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 923' ' ' LEU . . . . . 0.946 ' HB3' ' HB ' ' A' ' 902' ' ' VAL . 0.3 OUTLIER -148.4 167.68 24.62 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.843 0.354 . . . . 0.0 110.553 -179.401 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 924' ' ' SER . . . . . 0.506 ' HA ' ' O ' ' A' ' 903' ' ' THR . 3.9 m -115.88 150.0 37.76 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.997 175.498 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 925' ' ' LYS . . . . . 0.515 ' N ' ' HD2' ' A' ' 926' ' ' PRO . 1.4 tttp -51.62 -43.72 88.23 Favored Pre-proline 0 CA--C 1.54 0.595 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.897 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 926' ' ' PRO . . . . . 0.515 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 42.7 Cg_endo -69.01 63.24 1.36 Allowed 'Trans proline' 0 C--N 1.357 1.003 0 C-N-CA 121.987 1.792 . . . . 0.0 113.073 174.905 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 3.4 p -92.97 147.19 5.56 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.807 175.482 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -103.56 167.54 9.73 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.011 -177.593 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 929' ' ' LEU . . . . . 0.819 HD23 ' HG2' ' A' ' 843' ' ' GLN . 1.6 tm? -63.84 -35.8 81.81 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.152 179.04 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.28 -47.44 79.53 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.256 0.551 . . . . 0.0 110.359 -179.198 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 82.3 t -67.49 -44.94 86.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.924 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 932' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -62.43 -36.18 73.49 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-O 120.569 0.223 . . . . 0.0 110.426 -179.702 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 1.6 ttmt -68.28 -47.87 66.51 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.409 179.227 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.91 -43.02 95.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.907 179.425 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 17.8 m -65.45 -50.08 66.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.214 -178.79 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 936' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.33 -44.38 95.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.943 -178.45 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 36.2 m -62.94 -43.33 99.09 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.814 0.34 . . . . 0.0 111.48 -179.198 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.29 -49.36 64.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.954 -179.662 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -66.21 -34.65 78.5 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.213 -177.192 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -63.13 -45.57 91.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.794 0.33 . . . . 0.0 111.063 178.43 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 941' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.81 -34.11 76.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.121 179.266 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 942' ' ' ARG . . . . . 0.576 ' HG3' ' N ' ' A' ' 943' ' ' VAL . 0.0 OUTLIER -63.96 -47.56 79.94 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.967 -178.668 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 943' ' ' VAL . . . . . 0.576 ' N ' ' HG3' ' A' ' 942' ' ' ARG . 15.9 m -73.08 -29.9 30.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.551 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.49 -40.48 95.75 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.011 178.821 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 945' ' ' LYS . . . . . 0.441 ' HG2' ' O ' ' A' ' 942' ' ' ARG . 0.4 OUTLIER -79.63 -20.76 46.0 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 121.098 -0.241 . . . . 0.0 111.473 -179.161 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 16.1 m -72.93 -30.4 63.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.561 0.696 . . . . 0.0 109.797 171.873 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -82.55 -17.6 44.36 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.08 174.265 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 10.1 t70 71.29 77.26 0.17 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-N 114.858 -1.065 . . . . 0.0 110.771 -178.609 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.248 1.024 0 CA-C-N 115.415 -0.812 . . . . 0.0 109.959 179.367 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.96 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 145.86 167.03 12.3 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.752 -0.737 . . . . 0.0 111.657 -178.566 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . -149.69 91.42 0.14 Allowed Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.781 -0.724 . . . . 0.0 112.139 -178.48 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -76.58 105.61 7.74 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 177.901 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . -113.46 105.7 1.68 Allowed Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.355 -177.08 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -124.17 48.76 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 121.228 0.537 . . . . 0.0 110.091 178.229 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.24 113.73 26.63 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.523 179.299 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . -79.24 72.2 2.53 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 121.195 -0.526 . . . . 0.0 112.691 -179.015 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 43.1 mt -116.71 4.25 13.07 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.293 0.568 . . . . 0.0 110.101 177.222 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 705' ' ' SER . . . . . 0.503 ' HA ' ' O ' ' A' ' 730' ' ' GLY . 0.0 OUTLIER -75.1 163.65 27.35 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.033 -179.388 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 93.42 -19.79 50.42 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.527 179.411 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 707' ' ' LYS . . . . . 0.681 ' NZ ' ' HA ' ' A' ' 745' ' ' ASP . 7.8 tmtm? -84.61 147.98 26.7 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 -179.89 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 708' ' ' ARG . . . . . 0.459 ' HD2' ' CZ2' ' A' ' 710' ' ' TRP . 6.4 mtm-85 -113.22 162.68 15.72 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.612 0.72 . . . . 0.0 111.678 -177.171 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 709' ' ' CYS . . . . . 0.63 ' SG ' HD22 ' A' ' 726' ' ' LEU . 1.2 m -132.88 117.89 18.26 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 114.6 -1.182 . . . . 0.0 108.847 168.11 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 710' ' ' TRP . . . . . 0.459 ' CZ2' ' HD2' ' A' ' 708' ' ' ARG . 91.0 m95 -94.04 107.16 19.1 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 711' ' ' LEU . . . . . 0.964 HD21 HG13 ' A' ' 733' ' ' VAL . 0.1 OUTLIER -110.12 128.46 55.46 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.127 0.489 . . . . 0.0 111.124 -176.845 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -119.45 44.19 2.43 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.21 175.449 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 713' ' ' VAL . . . . . 0.933 ' HA ' ' HB2' ' A' ' 750' ' ' ASP . 43.6 t -99.42 123.52 52.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.431 -178.387 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 714' ' ' ARG . . . . . 0.728 HH12 ' HG3' ' A' ' 751' ' ' GLU . 0.0 OUTLIER -78.46 -35.98 45.94 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 177.836 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 13.7 m-80 -59.92 109.95 1.06 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.382 -0.827 . . . . 0.0 110.715 -176.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -58.91 -43.67 91.09 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.491 -176.343 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.28 -42.81 96.21 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.229 0.538 . . . . 0.0 110.73 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 718' ' ' LEU . . . . . 0.606 ' HB3' HG11 ' A' ' 713' ' ' VAL . 0.2 OUTLIER -72.05 -49.71 34.42 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.121 -177.858 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 719' ' ' CYS . . . . . 0.812 ' SG ' ' HB ' ' A' ' 713' ' ' VAL . 0.1 OUTLIER -62.67 -50.35 71.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.089 -178.251 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -59.09 -44.15 91.89 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.668 -177.626 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -61.39 -52.13 65.88 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.799 0.333 . . . . 0.0 110.993 -178.158 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 14.7 mt -62.73 -45.1 94.27 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.653 -178.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 723' ' ' GLU . . . . . 0.538 ' HA ' HG21 ' A' ' 733' ' ' VAL . 0.8 OUTLIER -59.08 -46.47 88.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.865 -179.045 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 724' ' ' THR . . . . . . . . . . . . . 57.6 m -61.63 -41.73 97.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.892 0.377 . . . . 0.0 111.043 -178.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 14.1 m -67.22 -39.49 86.25 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.067 -0.515 . . . . 0.0 112.167 -175.422 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 726' ' ' LEU . . . . . 0.89 HD23 HD12 ' A' ' 731' ' ' ILE . 0.2 OUTLIER -82.31 -33.68 28.91 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.916 -0.313 . . . . 0.0 111.326 -178.881 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 727' ' ' GLN . . . . . 0.461 HE21 ' HB3' ' A' ' 727' ' ' GLN . 0.8 OUTLIER -72.95 -13.24 61.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.02 0.438 . . . . 0.0 110.413 177.28 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.84 -19.3 63.97 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.618 176.487 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 729' ' ' SER . . . . . 0.432 ' HB2' ' H ' ' A' ' 730' ' ' GLY . 0.0 OUTLIER -98.11 -96.26 0.22 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.339 177.748 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 730' ' ' GLY . . . . . 0.503 ' O ' ' HA ' ' A' ' 705' ' ' SER . . . -159.1 21.64 0.29 Allowed Glycine 0 N--CA 1.45 -0.416 0 N-CA-C 111.016 -0.834 . . . . 0.0 111.016 178.264 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 731' ' ' ILE . . . . . 0.89 HD12 HD23 ' A' ' 726' ' ' LEU . 2.5 mt -89.76 132.25 34.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 -177.283 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 732' ' ' VAL . . . . . 0.422 HG13 ' HG3' ' A' ' 708' ' ' ARG . 1.5 p -87.13 108.59 18.27 Favored 'Isoleucine or valine' 0 C--O 1.238 0.488 0 CA-C-O 121.826 0.822 . . . . 0.0 111.335 -176.784 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 733' ' ' VAL . . . . . 0.964 HG13 HD21 ' A' ' 711' ' ' LEU . 2.2 t -75.41 117.33 19.59 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.0 -1.0 . . . . 0.0 109.85 176.661 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.01 126.28 41.03 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.637 -179.085 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -56.89 130.63 46.69 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.802 177.551 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -72.42 77.86 1.03 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.394 0.616 . . . . 0.0 110.443 178.192 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.41 -13.1 61.74 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.639 177.375 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 109.1 39.5 1.67 Allowed Glycine 0 N--CA 1.447 -0.574 0 N-CA-C 111.06 -0.816 . . . . 0.0 111.06 -174.531 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -85.81 -167.15 1.75 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.47 -0.365 . . . . 0.0 110.784 -177.795 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -67.78 122.0 81.78 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.341 -177.649 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 741' ' ' PRO . . . . . 0.442 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 29.4 Cg_endo -65.22 122.9 10.77 Favored 'Trans proline' 0 N--CA 1.463 -0.315 0 C-N-CA 122.371 2.047 . . . . 0.0 111.183 176.765 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 742' ' ' THR . . . . . 0.719 ' HB ' ' HB2' ' A' ' 745' ' ' ASP . 0.1 OUTLIER -104.99 124.88 35.21 Favored Pre-proline 0 C--N 1.322 -0.606 0 CA-C-O 120.948 0.404 . . . . 0.0 111.363 -174.391 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 743' ' ' PRO . . . . . 0.822 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 34.7 Cg_endo -65.47 -12.93 37.25 Favored 'Trans proline' 0 N--CA 1.473 0.267 0 C-N-CA 123.497 2.798 . . . . 0.0 113.693 -175.681 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -108.18 -0.66 20.85 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.553 0.692 . . . . 0.0 110.583 177.564 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 745' ' ' ASP . . . . . 0.719 ' HB2' ' HB ' ' A' ' 742' ' ' THR . 28.0 m-20 -111.89 165.87 11.7 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.758 -173.927 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 746' ' ' VAL . . . . . 0.654 HG21 HD11 ' A' ' 795' ' ' LEU . 16.6 m -123.46 147.42 27.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.432 -171.517 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 747' ' ' LEU . . . . . 0.424 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 0.2 OUTLIER -107.45 99.9 9.38 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.18 178.231 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 5.7 mt -90.62 106.61 17.59 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 174.403 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 8.9 t -117.89 148.13 42.43 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.361 0.6 . . . . 0.0 111.989 -171.522 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 750' ' ' ASP . . . . . 0.933 ' HB2' ' HA ' ' A' ' 713' ' ' VAL . 54.0 t0 -95.86 109.24 21.61 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.089 -0.959 . . . . 0.0 109.033 177.287 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 751' ' ' GLU . . . . . 0.728 ' HG3' HH12 ' A' ' 714' ' ' ARG . 9.2 mt-10 67.66 -150.76 0.17 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.423 -177.954 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 752' ' ' VAL . . . . . 0.481 ' H ' ' HB3' ' A' ' 751' ' ' GLU . 59.0 t -88.03 116.96 30.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.17 0.509 . . . . 0.0 111.815 -172.691 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 6.1 p -95.97 156.4 3.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.016 171.732 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.7 41.5 0.57 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.952 0.406 . . . . 0.0 111.887 -176.537 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.77 -170.44 2.9 Favored 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 179.044 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 756' ' ' LYS . . . . . 0.617 ' O ' ' HB2' ' A' ' 757' ' ' TRP . 0.0 OUTLIER -117.22 -77.28 0.57 Allowed 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 170.138 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 757' ' ' TRP . . . . . 0.617 ' HB2' ' O ' ' A' ' 756' ' ' LYS . 10.7 t-105 152.93 109.21 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.41 0 O-C-N 124.76 1.288 . . . . 0.0 110.359 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.81 75.89 4.24 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 171.017 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 759' ' ' GLY . . . . . 0.822 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -158.1 -143.52 3.68 Favored Glycine 0 N--CA 1.444 -0.798 0 CA-C-N 115.681 -0.69 . . . . 0.0 112.381 -175.806 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.63 -55.72 5.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.767 0.283 . . . . 0.0 111.105 -178.051 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -166.51 149.12 6.78 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.746 -179.08 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 2.5 p -116.64 131.03 70.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 121.006 0.431 . . . . 0.0 110.572 178.641 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 763' ' ' VAL . . . . . 0.605 HG11 HD21 ' A' ' 791' ' ' LEU . 38.9 t -110.54 111.34 35.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.956 -0.565 . . . . 0.0 109.938 179.315 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 764' ' ' THR . . . . . 0.447 ' HB ' HG12 ' A' ' 782' ' ' VAL . 1.5 m -103.47 122.18 44.37 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.21 -176.518 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 765' ' ' PHE . . . . . . . . . . . . . 36.5 m-85 -92.16 123.98 35.91 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 175.386 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 766' ' ' CYS . . . . . 0.49 ' SG ' ' HB ' ' A' ' 782' ' ' VAL . 1.3 m -96.4 132.89 41.47 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.762 0.315 . . . . 0.0 110.814 -176.158 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.83 -57.01 1.35 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.614 179.481 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 2.7 tpm_? -136.15 -43.36 0.64 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.17 0.509 . . . . 0.0 110.288 177.715 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -89.6 110.51 21.37 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.759 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 5.1 mt -116.87 83.26 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-O 121.109 0.48 . . . . 0.0 110.003 178.593 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -125.71 13.18 7.3 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.302 179.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 772' ' ' ILE . . . . . 0.441 ' HA ' ' HD3' ' A' ' 773' ' ' PRO . 42.6 mm -105.36 132.78 20.58 Favored Pre-proline 0 C--N 1.322 -0.6 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 177.868 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 773' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 772' ' ' ILE . 36.0 Cg_exo -61.7 150.41 85.83 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.771 2.314 . . . . 0.0 112.381 178.016 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 774' ' ' LEU . . . . . 0.626 ' HG ' ' H ' ' A' ' 776' ' ' LYS . 0.5 OUTLIER -97.45 -162.34 0.95 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.602 179.874 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 775' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -62.4 8.31 0.05 Allowed 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 113.307 0.855 . . . . 0.0 113.307 179.552 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 776' ' ' LYS . . . . . 0.626 ' H ' ' HG ' ' A' ' 774' ' ' LEU . 7.6 ptmt -65.07 -18.26 65.15 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 165.692 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 777' ' ' ALA . . . . . 0.725 ' HB3' ' HB2' ' A' ' 780' ' ' GLU . . . -105.83 161.17 23.63 Favored Pre-proline 0 N--CA 1.451 -0.415 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.79 176.099 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 778' ' ' PRO . . . . . 0.566 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 57.2 Cg_endo -69.77 -9.6 26.5 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.781 2.321 . . . . 0.0 114.47 -172.305 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . -156.35 23.54 0.51 Allowed Glycine 0 CA--C 1.505 -0.551 0 C-N-CA 119.838 -1.173 . . . . 0.0 112.603 -175.393 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 780' ' ' GLU . . . . . 0.725 ' HB2' ' HB3' ' A' ' 777' ' ' ALA . 0.4 OUTLIER -114.88 129.2 56.66 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 -178.601 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 18.6 m95 -129.62 139.13 51.51 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 179.83 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 782' ' ' VAL . . . . . 0.49 ' HB ' ' SG ' ' A' ' 766' ' ' CYS . 14.7 m -133.45 143.89 37.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 110.17 -0.308 . . . . 0.0 110.17 173.732 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 783' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -166.62 148.03 6.29 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.536 176.319 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -102.57 102.35 12.58 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.38 178.888 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -154.7 162.8 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.587 -0.279 . . . . 0.0 110.252 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -100.4 32.23 3.12 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.115 -179.735 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 56.5 79.15 0.34 Allowed Pre-proline 0 N--CA 1.465 0.291 0 CA-C-N 116.064 -0.516 . . . . 0.0 112.006 178.081 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 788' ' ' PRO . . . . . 0.642 ' HB2' ' OE2' ' A' ' 790' ' ' GLU . 10.2 Cg_endo -88.35 -128.4 0.01 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 122.948 2.432 . . . . 0.0 111.278 175.544 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 789' ' ' HIS . . . . . 0.465 ' H ' ' HB2' ' A' ' 788' ' ' PRO . 14.2 p-80 -114.06 1.09 14.52 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.875 0.369 . . . . 0.0 111.038 -179.18 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 790' ' ' GLU . . . . . 0.642 ' OE2' ' HB2' ' A' ' 788' ' ' PRO . 1.7 pm0 -92.36 -44.51 8.67 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.334 -176.956 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 791' ' ' LEU . . . . . 0.605 HD21 HG11 ' A' ' 763' ' ' VAL . 0.2 OUTLIER -71.18 -42.48 11.91 Favored Pre-proline 0 CA--C 1.535 0.387 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -177.769 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 792' ' ' PRO . . . . . 0.549 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 10.3 Cg_endo -57.83 -29.37 85.82 Favored 'Trans proline' 0 C--N 1.353 0.8 0 C-N-CA 121.261 1.307 . . . . 0.0 111.607 172.048 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -74.34 -34.29 63.37 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.258 175.824 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -60.31 -43.24 96.5 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.671 174.512 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 795' ' ' LEU . . . . . 0.654 HD11 HG21 ' A' ' 746' ' ' VAL . 0.2 OUTLIER -62.29 -39.77 94.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.566 177.971 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -63.54 -46.31 86.58 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.788 178.653 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 797' ' ' ARG . . . . . 0.945 ' HA ' ' HB ' ' A' ' 801' ' ' ILE . 0.0 OUTLIER -65.51 -34.8 79.12 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.477 -0.328 . . . . 0.0 110.37 179.037 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 798' ' ' ILE . . . . . 0.443 ' N ' ' HG3' ' A' ' 797' ' ' ARG . 0.1 OUTLIER -65.49 -25.92 38.03 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.527 179.878 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.03 -65.36 0.69 Allowed 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.309 -0.405 . . . . 0.0 109.936 175.352 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 800' ' ' LEU . . . . . 0.478 HD23 ' HA ' ' A' ' 800' ' ' LEU . 0.4 OUTLIER -177.27 50.88 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.062 177.444 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 801' ' ' ILE . . . . . 0.945 ' HB ' ' HA ' ' A' ' 797' ' ' ARG . 55.0 mt -112.67 92.45 2.08 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.752 0 CA-C-O 122.105 0.955 . . . . 0.0 108.88 176.404 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 802' ' ' GLU . . . . . 0.461 ' H ' ' HG3' ' A' ' 802' ' ' GLU . 0.0 OUTLIER -114.5 46.5 1.37 Allowed 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 113.963 -1.471 . . . . 0.0 108.651 -175.83 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 803' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -79.84 76.08 6.53 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.905 -172.697 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 804' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -136.59 144.5 44.17 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 171.084 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -61.8 106.06 0.64 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.99 0.424 . . . . 0.0 110.929 -178.159 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -75.62 140.08 42.41 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.922 -177.368 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -148.39 110.52 3.68 Favored Pre-proline 0 C--N 1.326 -0.427 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.337 177.563 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 808' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -83.99 168.79 11.99 Favored 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 122.81 2.34 . . . . 0.0 112.333 179.485 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -90.21 133.94 34.6 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.663 -179.735 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -85.87 145.98 26.94 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.225 177.806 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -140.84 160.22 40.51 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.547 179.548 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -84.23 140.81 39.5 Favored Pre-proline 0 C--N 1.321 -0.661 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.584 179.583 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -63.73 129.7 25.65 Favored 'Trans proline' 0 C--O 1.235 0.329 0 C-N-CA 122.453 2.102 . . . . 0.0 112.148 178.092 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 2.3 m -56.43 117.21 3.62 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.907 -179.378 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -120.13 136.33 54.65 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.172 -176.674 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -123.36 97.82 5.58 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.757 177.422 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 5.4 mmtm -102.0 86.65 2.92 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.756 -178.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -160.05 138.99 10.71 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.166 178.556 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 3.0 p -76.04 92.3 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-O 121.882 0.848 . . . . 0.0 109.944 -179.711 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -89.29 45.53 1.3 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.052 -175.28 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -120.75 93.11 3.93 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.353 0.597 . . . . 0.0 110.781 -178.79 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -144.02 77.28 1.54 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.329 -0.851 . . . . 0.0 108.965 173.104 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 823' ' ' ASP . . . . . 0.458 ' HB3' ' SD ' ' A' ' 826' ' ' MET . 1.0 OUTLIER -123.41 103.04 8.24 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.884 -175.221 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -87.28 -98.2 0.08 Allowed 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 174.448 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 1.4 tpp -79.49 90.77 5.09 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 171.646 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 826' ' ' MET . . . . . 0.519 ' H ' ' HG2' ' A' ' 826' ' ' MET . 0.0 OUTLIER -93.3 105.74 17.78 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.142 -173.938 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 827' ' ' ILE . . . . . . . . . . . . . 6.4 mm -115.12 129.25 71.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.342 178.244 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -94.81 131.9 40.18 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 178.739 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 829' ' ' VAL . . . . . 0.567 HG13 HD12 ' A' ' 873' ' ' LEU . 0.0 OUTLIER -113.84 95.89 4.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 176.959 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 830' ' ' VAL . . . . . . . . . . . . . 10.7 t -97.18 88.18 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.147 -179.601 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 831' ' ' ASP . . . . . 0.675 ' HA ' ' HB2' ' A' ' 875' ' ' ASP . 0.0 OUTLIER -104.65 154.61 19.74 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.087 -176.077 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -87.63 -22.82 24.5 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -175.898 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -130.74 114.17 16.61 Favored Pre-proline 0 N--CA 1.465 0.32 0 O-C-N 121.394 -0.817 . . . . 0.0 111.951 -174.433 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -42.44 -52.93 4.02 Favored 'Trans proline' 0 N--CA 1.479 0.632 0 C-N-CA 124.731 3.621 . . . . 0.0 115.315 -172.134 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 835' ' ' ILE . . . . . 0.419 ' O ' ' HB3' ' A' ' 838' ' ' ARG . 3.6 tp -58.67 -40.02 78.06 Favored 'Isoleucine or valine' 0 C--O 1.24 0.572 0 CA-C-O 121.437 0.637 . . . . 0.0 111.063 -178.149 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 836' ' ' ASN . . . . . 0.547 ' HB3' ' HZ2' ' A' ' 925' ' ' LYS . 3.7 m-20 -70.23 -40.5 74.45 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.608 -179.703 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 837' ' ' ARG . . . . . 0.668 ' HB2' ' OD1' ' A' ' 831' ' ' ASP . 0.0 OUTLIER -54.72 -44.53 73.57 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.55 174.755 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 838' ' ' ARG . . . . . 0.419 ' HB3' ' O ' ' A' ' 835' ' ' ILE . 0.0 OUTLIER -51.54 -46.54 63.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.557 178.766 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.5 -48.06 79.14 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.881 -0.6 . . . . 0.0 112.042 -176.251 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 840' ' ' LEU . . . . . 0.495 ' H ' ' HG ' ' A' ' 840' ' ' LEU . 0.0 OUTLIER -70.87 -37.84 73.08 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 122.037 -0.414 . . . . 0.0 110.928 -178.13 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -66.35 -31.69 72.63 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.241 0.543 . . . . 0.0 110.366 178.343 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 842' ' ' ASP . . . . . 0.41 ' HB2' ' O ' ' A' ' 838' ' ' ARG . 10.9 t0 -65.39 -42.47 92.6 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.83 175.35 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 843' ' ' GLN . . . . . 0.579 ' HG3' HD23 ' A' ' 929' ' ' LEU . 0.0 OUTLIER -64.96 -44.92 87.8 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.33 178.581 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 844' ' ' LEU . . . . . 0.628 ' HA ' HD23 ' A' ' 847' ' ' LEU . 0.0 OUTLIER -60.95 -43.55 98.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.086 178.752 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -64.71 -42.4 97.22 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.913 -0.66 . . . . 0.0 112.282 179.682 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 51.0 m -77.02 -9.58 58.8 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.904 0.383 . . . . 0.0 111.185 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 847' ' ' LEU . . . . . 0.628 HD23 ' HA ' ' A' ' 844' ' ' LEU . 0.0 OUTLIER -87.69 -28.31 21.88 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 175.333 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 106.97 18.32 10.71 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.488 174.783 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 5.5 m-30 -106.38 165.69 11.08 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.94 -0.392 . . . . 0.0 109.94 179.326 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -95.17 117.49 30.32 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.931 0.396 . . . . 0.0 110.343 -178.565 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -100.59 127.17 47.05 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.276 -176.189 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.64 116.66 32.32 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 172.153 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.71 132.93 35.51 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 -171.883 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 854' ' ' ALA . . . . . . . . . . . . . . . -151.02 147.2 26.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.769 176.785 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 855' ' ' ASN . . . . . 0.653 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 9.1 t-20 -128.13 73.19 1.45 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.982 176.144 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 856' ' ' ASP . . . . . 0.653 ' HB2' ' O ' ' A' ' 855' ' ' ASN . 2.1 t70 162.18 159.74 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.213 175.865 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -81.66 -30.98 34.32 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.137 178.835 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 858' ' ' VAL . . . . . 0.455 HG22 ' OD1' ' A' ' 856' ' ' ASP . 3.3 m -73.23 -31.76 35.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.688 0.28 . . . . 0.0 111.074 -178.222 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -67.79 -42.75 81.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.236 0.541 . . . . 0.0 109.973 178.741 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 860' ' ' ALA . . . . . 0.439 ' O ' ' HB2' ' A' ' 864' ' ' LEU . . . -64.77 -44.69 89.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.641 177.43 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 861' ' ' LEU . . . . . 0.484 HD21 ' HA3' ' A' ' 894' ' ' GLY . 0.1 OUTLIER -61.06 -34.25 74.59 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.717 178.348 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -61.17 -54.57 42.66 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.915 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 14.4 p -71.78 -32.45 44.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.731 0.301 . . . . 0.0 110.824 -177.848 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 864' ' ' LEU . . . . . 0.439 ' HB2' ' O ' ' A' ' 860' ' ' ALA . 0.2 OUTLIER -63.5 -45.12 92.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.771 178.311 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 15.2 m -71.71 -21.76 61.73 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.801 -179.192 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.28 -69.18 0.37 Allowed 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 173.811 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 867' ' ' ASN . . . . . 0.599 ' O ' ' HB2' ' A' ' 868' ' ' HIS . 9.0 t30 159.17 127.4 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.609 0 O-C-N 124.274 0.984 . . . . 0.0 110.021 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 868' ' ' HIS . . . . . 0.599 ' HB2' ' O ' ' A' ' 867' ' ' ASN . 14.3 m-70 134.92 171.7 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.005 0 O-C-N 125.202 1.564 . . . . 0.0 110.528 165.667 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 869' ' ' ILE . . . . . 0.591 ' HB ' ' O ' ' A' ' 868' ' ' HIS . 1.5 mp 86.0 129.57 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 O-C-N 124.461 1.1 . . . . 0.0 111.109 174.748 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -112.76 -16.58 12.74 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.435 -178.311 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 871' ' ' ILE . . . . . . . . . . . . . 2.1 mt -145.95 137.69 19.69 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 178.761 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 872' ' ' VAL . . . . . 0.587 ' HB ' HG22 ' A' ' 899' ' ' VAL . 7.2 t -122.39 135.75 61.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.676 0.274 . . . . 0.0 110.962 -177.879 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 873' ' ' LEU . . . . . 0.567 HD12 HG13 ' A' ' 829' ' ' VAL . 10.0 mt -110.88 136.11 50.4 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 173.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -120.66 104.96 10.33 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.26 178.8 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 875' ' ' ASP . . . . . 0.675 ' HB2' ' HA ' ' A' ' 831' ' ' ASP . 0.8 OUTLIER -89.17 105.68 17.94 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.543 -176.825 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -95.95 100.02 10.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.548 -177.145 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 877' ' ' ASN . . . . . 0.424 ' HA ' ' HB3' ' A' ' 904' ' ' ALA . 0.8 OUTLIER -73.11 -43.0 62.33 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.758 176.368 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.98 111.93 60.33 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.256 174.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 879' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -44.09 -56.57 2.4 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 123.884 3.056 . . . . 0.0 114.178 -171.523 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -158.89 140.92 13.75 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.498 0.189 . . . . 0.0 110.575 179.785 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 5.2 tpt -178.85 -74.65 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.385 178.528 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -117.86 -28.23 5.99 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.941 -177.677 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -83.63 35.62 2.85 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.854 -0.689 . . . . 0.0 112.66 -177.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 23.3 p90 -89.28 -22.4 22.71 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 -178.292 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -61.5 -31.35 71.34 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.752 174.882 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.92 -53.89 53.14 Favored 'General case' 0 CA--C 1.528 0.127 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.609 179.613 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.49 -36.19 80.62 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.839 -178.894 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 888' ' ' GLN . . . . . 0.474 ' HA ' ' HD3' ' A' ' 891' ' ' ARG . 60.9 mm-40 -61.08 -50.48 73.11 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.004 179.613 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.59 -44.72 95.93 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.485 -177.534 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 890' ' ' ILE . . . . . . . . . . . . . 18.0 mt -69.15 -46.45 77.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.059 -177.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 891' ' ' ARG . . . . . 0.474 ' HD3' ' HA ' ' A' ' 888' ' ' GLN . 2.3 ptm180 -66.96 -23.97 66.01 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.893 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 892' ' ' GLN . . . . . 0.457 ' HB2' ' O ' ' A' ' 888' ' ' GLN . 1.5 tp60 -71.88 -60.34 2.28 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.71 177.772 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -157.2 48.24 0.43 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.594 -176.349 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 894' ' ' GLY . . . . . 0.484 ' HA3' HD21 ' A' ' 861' ' ' LEU . . . -141.86 0.06 1.57 Allowed Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.35 176.508 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 895' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -108.4 110.74 22.36 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.973 0.416 . . . . 0.0 110.763 -178.312 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -134.54 22.57 3.67 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.563 0.697 . . . . 0.0 109.717 175.904 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 897' ' ' LEU . . . . . 0.406 ' HB2' ' HD2' ' A' ' 898' ' ' PRO . 0.4 OUTLIER -159.51 164.46 20.44 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.748 -173.666 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 898' ' ' PRO . . . . . 0.406 ' HD2' ' HB2' ' A' ' 897' ' ' LEU . 38.0 Cg_endo -67.07 128.76 19.2 Favored 'Trans proline' 0 C--O 1.241 0.629 0 C-N-CA 122.316 2.011 . . . . 0.0 111.941 176.129 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 899' ' ' VAL . . . . . 0.79 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 69.0 t -115.61 128.31 72.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.143 178.897 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 900' ' ' ILE . . . . . 0.455 ' HA ' ' O ' ' A' ' 921' ' ' SER . 3.0 mt -108.52 121.91 62.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.008 179.263 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -96.32 126.95 9.0 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 120.686 -0.768 . . . . 0.0 111.907 -178.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 902' ' ' VAL . . . . . 0.765 HG12 ' HA ' ' A' ' 925' ' ' LYS . 1.1 t -104.59 97.56 5.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 177.94 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.27 135.95 33.35 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.959 -172.895 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 904' ' ' ALA . . . . . 0.46 ' HA ' ' HB2' ' A' ' 925' ' ' LYS . . . -96.31 115.06 26.83 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.705 178.565 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 60.8 45.62 9.72 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 121.207 0.527 . . . . 0.0 111.238 177.267 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -98.27 98.86 10.07 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.046 177.41 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 11.1 tp -45.26 -45.15 11.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.521 176.476 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 908' ' ' ALA . . . . . 0.411 ' HB1' ' HB2' ' A' ' 911' ' ' LYS . . . -126.39 78.96 1.82 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.019 0.438 . . . . 0.0 110.582 177.605 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 909' ' ' GLU . . . . . 0.435 ' H ' ' HG2' ' A' ' 909' ' ' GLU . 0.0 OUTLIER -62.31 -41.37 98.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.527 -178.868 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 910' ' ' GLU . . . . . 0.526 ' H ' ' HG2' ' A' ' 910' ' ' GLU . 0.1 OUTLIER -64.02 -31.02 72.05 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.091 -179.753 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 911' ' ' LYS . . . . . 0.411 ' HB2' ' HB1' ' A' ' 908' ' ' ALA . 12.6 tttt -68.87 -41.64 78.08 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.259 179.781 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 69.9 tp60 -63.13 -36.24 82.96 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.134 177.017 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 913' ' ' ARG . . . . . 0.578 ' HB2' ' SG ' ' A' ' 922' ' ' CYS . 3.7 ttp180 -58.66 -46.96 86.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.944 177.814 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 7.4 m -74.94 -26.1 59.36 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.549 -176.171 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 1.2 tp -70.02 -51.74 29.81 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.954 0.407 . . . . 0.0 111.099 179.406 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -78.52 -42.53 29.24 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.506 -178.219 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 2.3 m 51.15 47.8 24.2 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.088 0.47 . . . . 0.0 111.573 -176.777 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -133.06 24.43 3.79 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.013 179.716 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 919' ' ' MET . . . . . 0.79 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -130.14 -101.45 0.31 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.576 0.226 . . . . 0.0 110.755 -177.198 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 920' ' ' ASP . . . . . 0.422 ' HB2' ' O ' ' A' ' 919' ' ' MET . 10.4 t70 168.2 -64.83 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.993 0.917 . . . . 0.0 108.801 179.83 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 921' ' ' SER . . . . . 0.455 ' O ' ' HA ' ' A' ' 900' ' ' ILE . 70.9 m -139.23 163.11 33.32 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.653 179.018 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 922' ' ' CYS . . . . . 0.578 ' SG ' ' HB2' ' A' ' 913' ' ' ARG . 0.0 OUTLIER -137.6 158.24 44.8 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.03 0.443 . . . . 0.0 111.496 -177.506 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 923' ' ' LEU . . . . . 0.465 HD21 HG21 ' A' ' 935' ' ' THR . 0.0 OUTLIER -146.8 168.35 21.62 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.232 175.218 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 1.4 m -78.37 142.71 37.46 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.064 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 925' ' ' LYS . . . . . 0.765 ' HA ' HG12 ' A' ' 902' ' ' VAL . 0.0 OUTLIER -54.35 -39.95 78.8 Favored Pre-proline 0 CA--C 1.538 0.502 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 179.433 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -62.11 74.03 0.1 OUTLIER 'Trans proline' 0 C--N 1.36 1.162 0 C-N-CA 122.077 1.852 . . . . 0.0 112.194 171.184 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -98.47 140.17 18.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.968 -176.638 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.07 163.41 12.44 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.554 177.357 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 929' ' ' LEU . . . . . 0.579 HD23 ' HG3' ' A' ' 843' ' ' GLN . 0.0 OUTLIER -56.43 -46.41 80.29 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.355 -177.271 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -67.57 -34.38 76.93 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.028 0.442 . . . . 0.0 110.799 -177.459 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 62.4 t -69.61 -48.77 63.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.448 -178.728 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 932' ' ' ILE . . . . . 0.414 HG21 ' HB3' ' A' ' 843' ' ' GLN . 2.0 tp -67.28 -37.36 78.93 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 CA-C-O 120.64 0.257 . . . . 0.0 110.589 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 933' ' ' LYS . . . . . 0.492 ' HA ' HD13 ' A' ' 847' ' ' LEU . 0.8 OUTLIER -61.77 -47.64 84.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.169 176.87 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 934' ' ' GLN . . . . . 0.588 ' O ' ' HB2' ' A' ' 938' ' ' LEU . 1.9 tp60 -60.52 -51.08 70.95 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.743 -179.175 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 935' ' ' THR . . . . . 0.465 HG21 HD21 ' A' ' 923' ' ' LEU . 8.6 m -61.87 -47.63 84.16 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.529 -177.874 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 936' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.73 -47.84 68.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.385 -176.014 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 67.9 m -67.87 -39.46 83.71 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 111.708 0.262 . . . . 0.0 111.708 -178.181 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 938' ' ' LEU . . . . . 0.588 ' HB2' ' O ' ' A' ' 934' ' ' GLN . 0.2 OUTLIER -62.35 -44.31 96.78 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.987 0.422 . . . . 0.0 110.45 179.101 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -72.79 -30.65 64.26 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.929 -179.761 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -64.2 -35.82 82.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.857 0.361 . . . . 0.0 110.612 176.2 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 941' ' ' GLU . . . . . 0.419 ' HG3' ' N ' ' A' ' 942' ' ' ARG . 0.0 OUTLIER -78.9 -31.85 45.5 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.474 178.256 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 942' ' ' ARG . . . . . 0.625 ' HG3' ' N ' ' A' ' 943' ' ' VAL . 0.0 OUTLIER -65.59 -46.88 77.69 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 178.133 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 943' ' ' VAL . . . . . 0.625 ' N ' ' HG3' ' A' ' 942' ' ' ARG . 30.7 m -69.65 -28.25 36.76 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.265 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.08 179.503 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.7 -44.23 85.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.252 174.902 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 5.1 mttt -64.44 -45.06 89.12 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.315 -179.291 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.75 -35.64 77.35 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.832 0.349 . . . . 0.0 111.456 -178.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 27.4 mtt-85 -71.76 -50.38 30.52 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.861 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -150.39 121.61 7.8 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.404 -176.035 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 24.4 m . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.202 -0.904 . . . . 0.0 109.333 173.941 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.028 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 86.06 -96.79 2.14 Favored Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.014 -178.106 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . 151.13 100.85 0.21 Allowed Glycine 0 N--CA 1.443 -0.844 0 C-N-CA 120.734 -0.746 . . . . 0.0 111.972 179.599 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -61.94 141.85 57.78 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 176.357 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . -122.55 -117.02 2.38 Favored Glycine 0 N--CA 1.446 -0.683 0 C-N-CA 120.497 -0.858 . . . . 0.0 112.59 -173.925 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -112.49 163.11 9.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 120.834 0.35 . . . . 0.0 110.779 -175.392 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -95.96 58.02 1.86 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.764 -175.831 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . -72.28 -70.81 1.15 Allowed Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 110.929 -0.868 . . . . 0.0 110.929 175.188 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.643 ' HA ' HD13 ' A' ' 801' ' ' ILE . 2.1 mp 71.98 -25.29 0.18 Allowed 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 172.606 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 705' ' ' SER . . . . . 0.455 ' HA ' ' O ' ' A' ' 730' ' ' GLY . 0.7 OUTLIER -73.67 68.59 1.23 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.148 0.499 . . . . 0.0 111.825 -178.829 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . -170.66 25.63 0.1 OUTLIER Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 121.042 -0.599 . . . . 0.0 112.038 176.626 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 707' ' ' LYS . . . . . 0.539 ' HE3' ' HB3' ' A' ' 744' ' ' GLU . 26.1 mmtm -133.7 137.56 45.35 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 178.014 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 708' ' ' ARG . . . . . 0.755 ' HA ' HG23 ' A' ' 732' ' ' VAL . 6.5 mtp85 -92.11 136.24 33.34 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 121.369 0.604 . . . . 0.0 111.218 -173.892 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 1.7 t -104.31 109.97 22.02 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 171.906 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 710' ' ' TRP . . . . . 0.417 ' CZ2' ' HD3' ' A' ' 708' ' ' ARG . 89.2 m95 -90.13 96.23 10.57 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.815 0.817 . . . . 0.0 109.156 -178.526 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 711' ' ' LEU . . . . . 0.458 HD21 ' HB2' ' A' ' 719' ' ' CYS . 1.3 tp -95.64 104.65 16.58 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 114.611 -1.177 . . . . 0.0 111.305 -169.434 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 712' ' ' ALA . . . . . 0.404 ' HB2' ' HB3' ' A' ' 736' ' ' TYR . . . -103.51 30.92 4.66 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.786 0.803 . . . . 0.0 109.345 174.961 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 713' ' ' VAL . . . . . 0.722 HG13 ' HB3' ' A' ' 750' ' ' ASP . 49.1 t -92.98 115.43 31.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 114.954 -1.021 . . . . 0.0 109.833 178.244 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 32.2 mtp85 -110.1 17.92 20.53 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.678 0.752 . . . . 0.0 110.069 -179.816 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -92.05 109.78 21.14 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.026 -0.988 . . . . 0.0 108.845 173.054 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -45.41 -53.49 8.63 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 -172.772 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.42 -48.59 81.1 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.1 0.476 . . . . 0.0 110.747 -178.56 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 718' ' ' LEU . . . . . 0.579 HD21 ' CD2' ' A' ' 765' ' ' PHE . 0.2 OUTLIER -68.76 -48.35 63.94 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.684 -176.292 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 719' ' ' CYS . . . . . 0.458 ' HB2' HD21 ' A' ' 711' ' ' LEU . 16.3 p -67.29 -46.66 72.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.06 -174.825 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -62.48 -34.56 77.09 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.647 -0.252 . . . . 0.0 110.967 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 721' ' ' PHE . . . . . 0.429 ' HE2' ' HG3' ' A' ' 792' ' ' PRO . 93.7 t80 -65.64 -56.34 12.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.871 0.367 . . . . 0.0 110.366 178.984 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 91.9 mt -61.53 -45.73 92.92 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.237 -177.35 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 723' ' ' GLU . . . . . 0.582 ' HG3' ' N ' ' A' ' 724' ' ' THR . 0.0 OUTLIER -59.78 -42.2 92.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.115 -175.891 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 724' ' ' THR . . . . . 0.582 ' N ' ' HG3' ' A' ' 723' ' ' GLU . 8.6 m -77.43 -41.41 39.95 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.657 0.265 . . . . 0.0 111.499 -177.877 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 25.9 m -65.0 -36.62 85.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.835 0.35 . . . . 0.0 111.297 -178.828 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 726' ' ' LEU . . . . . 0.513 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 50.9 mt -79.31 -42.72 25.1 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.562 -176.654 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 727' ' ' GLN . . . . . 0.438 ' HG3' ' O ' ' A' ' 724' ' ' THR . 3.5 pp0? -62.69 -19.61 64.05 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 120.676 0.274 . . . . 0.0 111.318 -177.897 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 8.5 mtp-105 -57.42 -39.87 77.11 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.082 178.401 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -96.31 6.26 49.17 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.056 -177.268 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 730' ' ' GLY . . . . . 0.455 ' O ' ' HA ' ' A' ' 705' ' ' SER . . . 94.26 7.65 60.6 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.556 -0.83 . . . . 0.0 113.09 176.422 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 731' ' ' ILE . . . . . 0.513 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 36.4 mm -67.23 116.4 6.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 176.096 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 732' ' ' VAL . . . . . 0.755 HG23 ' HA ' ' A' ' 708' ' ' ARG . 3.0 m -79.56 90.97 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 121.587 0.708 . . . . 0.0 111.097 -173.488 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 733' ' ' VAL . . . . . 0.511 HG21 ' HA ' ' A' ' 723' ' ' GLU . 21.8 t -72.4 135.71 27.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.097 178.393 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -143.89 127.4 16.94 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.15 -177.42 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.3 114.07 2.25 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.127 178.576 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 736' ' ' TYR . . . . . 0.404 ' HB3' ' HB2' ' A' ' 712' ' ' ALA . 43.0 t80 -87.25 100.63 12.83 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.107 0.479 . . . . 0.0 110.601 -178.973 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -104.62 -11.42 16.94 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.205 177.168 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 139.92 68.56 0.04 OUTLIER Glycine 0 N--CA 1.448 -0.519 0 N-CA-C 111.211 -0.756 . . . . 0.0 111.211 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 739' ' ' GLN . . . . . 0.458 ' HB3' ' H ' ' A' ' 740' ' ' GLU . 14.7 mp0 -110.0 -138.46 0.37 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.885 0.374 . . . . 0.0 111.376 -174.672 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 740' ' ' GLU . . . . . 0.458 ' H ' ' HB3' ' A' ' 739' ' ' GLN . 2.2 tp10 -108.21 133.84 20.39 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.969 -175.032 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 741' ' ' PRO . . . . . 0.623 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 1.1 Cg_endo -83.39 123.54 3.44 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 123.241 2.627 . . . . 0.0 112.324 177.979 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 742' ' ' THR . . . . . 0.434 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.2 OUTLIER -108.28 132.47 21.07 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.437 176.272 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 743' ' ' PRO . . . . . 0.434 ' HD2' HG22 ' A' ' 742' ' ' THR . 37.5 Cg_endo -66.2 -5.33 12.21 Favored 'Trans proline' 0 N--CA 1.475 0.411 0 C-N-CA 123.151 2.567 . . . . 0.0 113.53 -175.286 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 744' ' ' GLU . . . . . 0.539 ' HB3' ' HE3' ' A' ' 707' ' ' LYS . 5.4 mm-40 -116.38 0.52 12.81 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.837 0.351 . . . . 0.0 110.894 177.622 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 745' ' ' ASP . . . . . 0.447 ' CG ' ' HB2' ' A' ' 708' ' ' ARG . 30.8 m-20 -103.93 165.61 10.93 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.44 -176.328 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 746' ' ' VAL . . . . . 0.672 HG21 HD11 ' A' ' 795' ' ' LEU . 2.6 p -128.35 136.04 61.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.252 0.548 . . . . 0.0 111.603 -174.54 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 747' ' ' LEU . . . . . 0.416 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 0.6 OUTLIER -99.72 104.91 16.67 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.866 176.895 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 24.9 mt -98.96 109.54 24.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 109.157 -0.682 . . . . 0.0 109.157 174.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 14.7 t -117.43 158.51 24.36 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.205 -174.683 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 750' ' ' ASP . . . . . 0.722 ' HB3' HG13 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -105.33 136.54 44.69 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.69 174.786 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 60.87 -167.45 0.19 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.882 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 752' ' ' VAL . . . . . . . . . . . . . 3.6 t -82.2 91.0 2.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.301 -175.779 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 753' ' ' VAL . . . . . 0.426 HG13 ' HB2' ' A' ' 755' ' ' LYS . 4.8 p -78.7 -18.06 13.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.405 175.712 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 1.4 m 56.25 56.8 5.47 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.358 -179.102 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 755' ' ' LYS . . . . . 0.426 ' HB2' HG13 ' A' ' 753' ' ' VAL . 0.0 OUTLIER -131.6 152.43 50.82 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 176.031 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 756' ' ' LYS . . . . . 0.428 ' HD3' ' HA ' ' A' ' 756' ' ' LYS . 42.4 mmtt -93.93 -43.36 8.59 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.262 -177.912 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 757' ' ' TRP . . . . . 0.623 ' CH2' ' HA ' ' A' ' 741' ' ' PRO . 71.3 t-105 68.75 96.66 0.06 Allowed 'General case' 0 N--CA 1.464 0.265 0 O-C-N 124.019 0.825 . . . . 0.0 111.709 178.506 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 4.4 tp60 -81.04 63.87 5.57 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.293 0.568 . . . . 0.0 110.501 175.622 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 759' ' ' GLY . . . . . 0.422 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -128.89 -149.77 6.99 Favored Glycine 0 N--CA 1.446 -0.698 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.966 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 2.0 ttt-85 -70.43 -49.36 49.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.782 0.325 . . . . 0.0 110.157 177.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -166.2 153.07 9.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.526 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 762' ' ' VAL . . . . . 0.441 ' HB ' ' HB3' ' A' ' 757' ' ' TRP . 7.7 p -119.03 132.1 69.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 176.626 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 763' ' ' VAL . . . . . 0.565 HG21 HD21 ' A' ' 795' ' ' LEU . 1.4 t -123.02 125.15 71.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 120.832 0.349 . . . . 0.0 110.649 -177.925 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 764' ' ' THR . . . . . 0.947 ' HB ' HG12 ' A' ' 782' ' ' VAL . 86.3 m -111.68 124.33 52.1 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.346 -179.282 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 765' ' ' PHE . . . . . 0.89 ' HE1' HG23 ' A' ' 785' ' ' VAL . 0.7 OUTLIER -95.41 110.32 22.37 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 172.672 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.25 133.1 38.13 Favored 'General case' 0 C--N 1.317 -0.837 0 C-N-CA 120.527 -0.469 . . . . 0.0 109.946 -178.266 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.7 -38.5 3.7 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.296 -179.407 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.67 -35.94 1.44 Allowed 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.288 -179.324 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 58.3 m80 -120.88 140.74 51.38 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.153 0.501 . . . . 0.0 111.212 -175.11 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 3.3 mt -123.97 103.25 12.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.484 179.12 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -121.41 -19.65 3.44 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.18 178.099 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 772' ' ' ILE . . . . . 0.422 ' HA ' ' HD3' ' A' ' 773' ' ' PRO . 18.8 mm -94.56 132.69 28.24 Favored Pre-proline 0 C--N 1.326 -0.416 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 773' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 772' ' ' ILE . 3.9 Cg_exo -80.31 164.86 21.5 Favored 'Trans proline' 0 N--CA 1.459 -0.552 0 C-N-CA 122.967 2.445 . . . . 0.0 112.45 179.848 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 774' ' ' LEU . . . . . 0.487 HD23 ' H ' ' A' ' 774' ' ' LEU . 0.7 OUTLIER -91.95 -157.47 0.52 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.337 179.074 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 775' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -64.76 61.13 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 178.609 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.71 -12.4 17.69 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 169.026 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -136.32 150.1 69.77 Favored Pre-proline 0 N--CA 1.447 -0.585 0 CA-C-N 114.139 -1.391 . . . . 0.0 108.617 176.507 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -61.94 102.65 0.26 Allowed 'Trans proline' 0 C--O 1.233 0.254 0 C-N-CA 122.706 2.271 . . . . 0.0 113.174 -177.034 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 115.34 -4.58 21.74 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.481 -0.866 . . . . 0.0 113.548 174.865 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 780' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.33 122.74 39.53 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 117.217 0.508 . . . . 0.0 109.999 -179.197 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 781' ' ' TRP . . . . . 0.706 ' HZ3' HD13 ' A' ' 794' ' ' LEU . 13.0 m95 -133.78 134.9 43.47 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 -179.178 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 782' ' ' VAL . . . . . 0.947 HG12 ' HB ' ' A' ' 764' ' ' THR . 26.6 m -140.77 152.11 20.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 121.129 0.49 . . . . 0.0 110.735 174.557 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 783' ' ' HIS . . . . . . . . . . . . . 3.1 t-160 -155.67 119.84 4.57 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.276 174.623 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -89.49 100.14 13.0 Favored 'General case' 0 C--N 1.317 -0.833 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.689 -179.701 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 785' ' ' VAL . . . . . 0.89 HG23 ' HE1' ' A' ' 765' ' ' PHE . 0.0 OUTLIER -167.58 -172.46 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.527 179.365 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -114.53 55.24 0.75 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.484 0.183 . . . . 0.0 111.468 -178.042 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 787' ' ' ALA . . . . . 0.542 ' HB2' ' HG ' ' A' ' 718' ' ' LEU . . . 51.52 61.99 11.81 Favored Pre-proline 0 N--CA 1.469 0.491 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.442 177.384 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 788' ' ' PRO . . . . . 0.417 ' HD3' ' N ' ' A' ' 787' ' ' ALA . 1.1 Cg_endo -84.0 46.24 1.96 Allowed 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 123.088 2.525 . . . . 0.0 112.837 -176.745 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 70.07 -15.73 0.32 Allowed 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 113.305 0.854 . . . . 0.0 113.305 174.167 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 790' ' ' GLU . . . . . 0.434 ' H ' ' HG3' ' A' ' 790' ' ' GLU . 0.0 OUTLIER -73.72 -51.76 15.49 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -175.39 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 791' ' ' LEU . . . . . 0.514 ' N ' ' HD2' ' A' ' 792' ' ' PRO . 0.3 OUTLIER -58.91 -50.54 87.46 Favored Pre-proline 0 CA--C 1.534 0.354 0 N-CA-C 112.427 0.528 . . . . 0.0 112.427 -176.959 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 792' ' ' PRO . . . . . 0.514 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 10.8 Cg_endo -55.8 -33.45 88.19 Favored 'Trans proline' 0 C--N 1.357 0.987 0 C-N-CA 121.971 1.781 . . . . 0.0 112.258 177.283 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -66.4 -50.39 63.6 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 120.938 0.399 . . . . 0.0 110.723 178.677 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 794' ' ' LEU . . . . . 0.706 HD13 ' HZ3' ' A' ' 781' ' ' TRP . 1.0 OUTLIER -64.41 -33.8 76.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.926 179.683 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 795' ' ' LEU . . . . . 0.672 HD11 HG21 ' A' ' 746' ' ' VAL . 0.7 OUTLIER -67.25 -43.8 81.01 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.995 -179.092 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -60.25 -37.14 79.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.074 0.464 . . . . 0.0 110.621 178.25 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 797' ' ' ARG . . . . . 0.462 ' HD2' HD23 ' A' ' 794' ' ' LEU . 0.0 OUTLIER -71.91 -48.78 43.12 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.225 179.124 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 798' ' ' ILE . . . . . 0.421 HG22 ' O ' ' A' ' 795' ' ' LEU . 0.6 OUTLIER -62.86 -18.02 20.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -176.979 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -63.22 -39.37 94.43 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 175.872 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 800' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 797' ' ' ARG . 6.1 mt 43.75 63.83 1.46 Allowed 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.232 177.739 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 801' ' ' ILE . . . . . 0.643 HD13 ' HA ' ' A' ' 704' ' ' LEU . 2.4 mt -96.11 -63.37 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.697 -179.784 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 64.51 11.91 6.99 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.884 178.464 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 803' ' ' MET . . . . . 0.465 ' HB2' HG22 ' A' ' 801' ' ' ILE . 12.5 mtt -98.24 160.18 14.46 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.134 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 804' ' ' GLU . . . . . 0.42 ' HG3' ' H ' ' A' ' 804' ' ' GLU . 0.0 OUTLIER -84.2 164.36 19.16 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.884 0.373 . . . . 0.0 110.025 177.362 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 4.0 m -144.23 129.58 18.85 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.309 178.493 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -130.18 161.61 30.73 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.782 179.645 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -156.86 103.7 1.94 Allowed Pre-proline 0 C--N 1.325 -0.489 0 CA-C-O 120.818 0.342 . . . . 0.0 110.723 -179.252 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 808' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -75.98 149.04 32.32 Favored 'Trans proline' 0 N--CA 1.462 -0.336 0 C-N-CA 123.017 2.478 . . . . 0.0 112.092 178.539 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -160.68 122.13 3.03 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.339 179.102 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 46.9 t30 -150.43 144.35 25.37 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.843 0.354 . . . . 0.0 111.076 179.843 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -137.4 146.96 45.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.38 178.344 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -148.27 93.58 4.37 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-O 120.913 0.387 . . . . 0.0 110.96 -179.323 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_endo -87.75 145.93 6.8 Favored 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 123.58 2.853 . . . . 0.0 112.237 178.749 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 14.9 m -153.63 134.61 13.91 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.731 178.434 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -152.17 125.01 8.48 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.203 176.895 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -137.78 150.19 47.02 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.755 0.312 . . . . 0.0 111.242 -177.935 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.77 144.14 0.62 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.758 176.127 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -160.66 120.29 2.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.608 0.242 . . . . 0.0 110.803 179.271 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 4.1 t -126.79 122.22 60.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.448 -179.475 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -144.18 82.43 1.7 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.0 0.429 . . . . 0.0 110.801 -178.298 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -130.22 149.41 51.93 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.491 -177.549 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 822' ' ' ASN . . . . . 0.472 ' HB3' ' H ' ' A' ' 823' ' ' ASP . 37.0 t30 -156.66 -110.5 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.686 176.839 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 823' ' ' ASP . . . . . 0.472 ' H ' ' HB3' ' A' ' 822' ' ' ASN . 25.9 t0 55.36 98.7 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.415 0.686 . . . . 0.0 112.232 -177.598 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -78.74 -91.88 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.491 -177.608 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 4.0 ttm -137.7 135.4 36.41 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 -178.176 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 826' ' ' MET . . . . . 0.559 ' HA ' ' HB2' ' A' ' 850' ' ' GLN . 21.2 ptp -108.43 129.09 55.27 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.663 0.744 . . . . 0.0 111.613 -177.122 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 827' ' ' ILE . . . . . . . . . . . . . 10.0 mm -109.82 144.17 18.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-N 114.864 -1.062 . . . . 0.0 108.836 175.405 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 828' ' ' LEU . . . . . 0.614 ' HB2' HG12 ' A' ' 869' ' ' ILE . 16.1 tp -103.23 122.24 44.35 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.664 0.268 . . . . 0.0 110.282 -177.861 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 829' ' ' VAL . . . . . 0.503 ' HA ' ' HG ' ' A' ' 873' ' ' LEU . 1.2 p -114.73 104.33 16.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.372 0.606 . . . . 0.0 110.1 -179.222 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 830' ' ' VAL . . . . . 0.796 HG22 ' HB3' ' A' ' 854' ' ' ALA . 60.6 t -119.09 119.87 62.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.172 -179.703 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 831' ' ' ASP . . . . . 1.014 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 0.9 OUTLIER -130.06 153.8 48.09 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 176.86 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.75 -13.96 59.07 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -172.365 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 7.8 m80 -131.68 95.83 22.24 Favored Pre-proline 0 C--N 1.327 -0.371 0 O-C-N 121.798 -0.564 . . . . 0.0 111.451 -178.53 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_exo -27.03 -46.52 0.08 OUTLIER 'Trans proline' 0 C--N 1.353 0.811 1 C-N-CA 125.835 4.357 . . . . 0.0 116.618 -171.756 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 1.2 pp -57.18 -44.0 82.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -176.677 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 836' ' ' ASN . . . . . 0.504 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 1.5 t30 -73.09 -46.75 49.57 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -178.322 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 837' ' ' ARG . . . . . 1.014 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 0.4 OUTLIER -51.9 -39.85 59.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.862 178.451 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 838' ' ' ARG . . . . . 0.403 ' HD3' ' O ' ' A' ' 838' ' ' ARG . 0.0 OUTLIER -64.51 -47.08 80.22 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.489 177.751 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.62 -42.48 95.47 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.106 -0.497 . . . . 0.0 112.011 -173.831 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 840' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 836' ' ' ASN . 0.0 OUTLIER -70.88 -26.79 63.39 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.211 177.14 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -66.81 -33.57 75.91 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.156 0.503 . . . . 0.0 109.818 175.257 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -64.49 -41.72 96.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.974 174.415 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 843' ' ' GLN . . . . . 0.645 ' HG2' HG21 ' A' ' 932' ' ' ILE . 0.3 OUTLIER -62.01 -41.61 98.26 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.491 176.069 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 844' ' ' LEU . . . . . 0.74 HD13 ' HB3' ' A' ' 851' ' ' CYS . 0.5 OUTLIER -61.66 -33.19 73.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.595 176.067 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -65.39 -34.19 88.64 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.94 -0.648 . . . . 0.0 111.707 175.789 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 9.3 m -68.91 -28.23 66.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.91 0.386 . . . . 0.0 110.606 176.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.65 -22.45 63.45 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.27 176.013 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 84.84 24.06 47.03 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 121.088 -0.577 . . . . 0.0 113.446 173.685 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -114.77 -177.93 3.25 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.718 0.294 . . . . 0.0 110.454 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 850' ' ' GLN . . . . . 0.559 ' HB2' ' HA ' ' A' ' 826' ' ' MET . 4.2 mm100 -85.76 141.38 29.74 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 177.011 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 851' ' ' CYS . . . . . 0.74 ' HB3' HD13 ' A' ' 844' ' ' LEU . 0.0 OUTLIER -132.09 116.59 17.23 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 120.797 0.332 . . . . 0.0 110.892 -177.682 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -93.74 109.6 21.26 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 176.956 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 853' ' ' THR . . . . . 0.443 ' HA ' HG13 ' A' ' 829' ' ' VAL . 0.0 OUTLIER -91.8 116.6 29.03 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.689 -174.065 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 854' ' ' ALA . . . . . 0.796 ' HB3' HG22 ' A' ' 830' ' ' VAL . . . -136.18 161.09 36.71 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.752 178.691 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -142.04 73.95 1.43 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.975 177.926 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 856' ' ' ASP . . . . . 0.769 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 31.7 t70 176.55 150.17 0.14 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.784 -178.474 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -77.4 -42.69 17.72 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.514 -178.103 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -71.71 -34.67 52.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.739 0.304 . . . . 0.0 110.348 -178.698 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 859' ' ' ASP . . . . . 0.769 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 0.1 OUTLIER -57.03 -38.85 73.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.642 177.306 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 860' ' ' ALA . . . . . 0.474 ' O ' HG12 ' A' ' 863' ' ' VAL . . . -66.57 -40.79 89.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.833 179.228 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 861' ' ' LEU . . . . . 0.467 HD22 ' HA ' ' A' ' 861' ' ' LEU . 0.2 OUTLIER -66.33 -33.25 75.3 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.095 0.474 . . . . 0.0 110.439 178.358 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -67.42 -42.55 83.03 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.884 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 863' ' ' VAL . . . . . 0.479 HG11 HD13 ' A' ' 828' ' ' LEU . 1.6 p -70.72 -32.02 47.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.715 0.293 . . . . 0.0 110.462 178.334 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 864' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -61.53 -39.68 91.93 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 121.15 0.5 . . . . 0.0 109.954 174.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 6.0 m -78.0 -16.97 57.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.935 178.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 2.8 tttp -76.26 -60.63 2.25 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.423 178.178 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -121.69 -90.17 0.58 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.147 177.876 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 23.7 p80 -179.1 -39.56 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 122.168 0.187 . . . . 0.0 110.869 176.291 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 869' ' ' ILE . . . . . 0.614 HG12 ' HB2' ' A' ' 828' ' ' LEU . 0.3 OUTLIER 69.38 149.58 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 O-C-N 123.392 0.432 . . . . 0.0 110.273 -175.6 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -92.41 -39.89 11.18 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.518 -0.473 . . . . 0.0 111.414 -177.073 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 871' ' ' ILE . . . . . . . . . . . . . 1.4 mt -138.64 133.9 42.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 177.901 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 872' ' ' VAL . . . . . 0.575 HG13 HD23 ' A' ' 828' ' ' LEU . 72.4 t -107.89 112.29 39.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.661 -179.363 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 873' ' ' LEU . . . . . 0.503 ' HG ' ' HA ' ' A' ' 829' ' ' VAL . 1.4 pp -108.72 127.92 54.41 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.115 0.484 . . . . 0.0 110.028 176.315 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -123.26 114.69 20.58 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.668 -177.707 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 875' ' ' ASP . . . . . 0.812 ' HB3' ' HB2' ' A' ' 831' ' ' ASP . 34.0 t0 -102.5 136.32 42.54 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 178.468 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 876' ' ' VAL . . . . . 0.452 HG23 HG23 ' A' ' 903' ' ' THR . 0.0 OUTLIER -141.09 129.19 22.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-O 121.296 0.569 . . . . 0.0 111.402 -177.053 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -80.21 -39.06 29.88 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 171.09 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -157.77 140.98 11.0 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 114.519 -1.219 . . . . 0.0 109.001 175.21 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 879' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_exo -68.59 78.4 0.68 Allowed 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 122.644 2.229 . . . . 0.0 111.52 177.655 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 880' ' ' ASN . . . . . 0.413 ' O ' ' HB3' ' A' ' 881' ' ' MET . 0.9 OUTLIER -80.48 120.46 24.51 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.364 -175.321 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 881' ' ' MET . . . . . 0.413 ' HB3' ' O ' ' A' ' 880' ' ' ASN . 31.7 ttp 74.59 -58.02 0.59 Allowed 'General case' 0 N--CA 1.468 0.464 0 O-C-N 124.005 0.816 . . . . 0.0 111.802 175.879 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 882' ' ' ASP . . . . . 0.409 ' OD1' ' HB3' ' A' ' 885' ' ' ARG . 0.2 OUTLIER -133.95 149.5 51.26 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.553 -176.046 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -172.63 -1.13 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.598 -0.811 . . . . 0.0 113.094 178.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -123.25 -43.25 2.21 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.101 0.477 . . . . 0.0 110.346 -178.03 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 885' ' ' ARG . . . . . 0.409 ' HB3' ' OD1' ' A' ' 882' ' ' ASP . 0.6 OUTLIER -60.92 -36.4 79.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.809 -177.788 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.26 -42.96 99.23 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.462 -179.552 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.2 -44.34 76.03 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.047 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 888' ' ' GLN . . . . . 0.445 ' OE1' ' HD3' ' A' ' 891' ' ' ARG . 3.3 tp-100 -60.49 -43.04 97.41 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.6 178.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -70.62 -33.08 70.63 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.148 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 890' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -60.81 -48.35 89.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.707 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 891' ' ' ARG . . . . . 0.468 HH21 ' HG3' ' A' ' 892' ' ' GLN . 0.0 OUTLIER -74.49 -23.17 58.82 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.814 0.34 . . . . 0.0 110.6 179.606 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 892' ' ' GLN . . . . . 0.468 ' HG3' HH21 ' A' ' 891' ' ' ARG . 5.3 mt-30 -70.92 -43.36 68.41 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.896 178.454 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.06 -55.04 18.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.87 -178.421 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 163.06 60.96 0.02 OUTLIER Glycine 0 N--CA 1.453 -0.208 0 C-N-CA 120.34 -0.933 . . . . 0.0 112.432 -179.716 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 895' ' ' LEU . . . . . 0.439 ' HB3' ' HA ' ' A' ' 891' ' ' ARG . 0.4 OUTLIER -68.15 111.15 4.33 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.971 0.415 . . . . 0.0 110.894 -179.509 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -128.42 7.84 5.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.442 174.143 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 897' ' ' LEU . . . . . 0.553 HD12 HG23 ' A' ' 872' ' ' VAL . 0.1 OUTLIER -125.31 138.98 32.74 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.032 -177.163 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.32 144.88 46.98 Favored 'Trans proline' 0 C--O 1.238 0.486 0 C-N-CA 122.571 2.181 . . . . 0.0 112.572 -178.107 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 899' ' ' VAL . . . . . 0.792 HG13 ' HA ' ' A' ' 919' ' ' MET . 0.2 OUTLIER -121.07 137.75 53.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 121.534 0.683 . . . . 0.0 110.331 179.443 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 900' ' ' ILE . . . . . 0.743 HG23 ' HB2' ' A' ' 921' ' ' SER . 6.3 mt -108.47 112.11 38.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.03 -179.85 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 901' ' ' GLY . . . . . 0.459 ' O ' ' HA ' ' A' ' 922' ' ' CYS . . . -97.93 110.04 3.94 Favored Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 121.053 -0.594 . . . . 0.0 112.009 -179.027 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 902' ' ' VAL . . . . . 0.579 ' HB ' ' HB2' ' A' ' 923' ' ' LEU . 0.2 OUTLIER -105.06 126.19 60.04 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 178.83 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 903' ' ' THR . . . . . 0.452 HG23 HG23 ' A' ' 876' ' ' VAL . 0.2 OUTLIER -135.2 153.77 51.83 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.056 0.455 . . . . 0.0 111.611 -174.665 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 904' ' ' ALA . . . . . 0.42 ' HB2' ' HD3' ' A' ' 925' ' ' LYS . . . -90.78 104.02 16.65 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.722 174.89 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 16.4 t30 43.73 61.46 2.27 Favored 'General case' 0 N--CA 1.468 0.427 0 O-C-N 124.034 0.834 . . . . 0.0 111.553 -178.326 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 906' ' ' ALA . . . . . 0.579 ' HB1' ' HB2' ' A' ' 909' ' ' GLU . . . -55.29 -64.82 0.72 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.843 -178.279 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 3.6 mp 56.24 35.19 25.34 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.848 178.475 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -175.7 -45.36 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.096 -175.822 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 909' ' ' GLU . . . . . 0.579 ' HB2' ' HB1' ' A' ' 906' ' ' ALA . 0.0 OUTLIER -69.99 -20.23 63.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.327 -175.618 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 910' ' ' GLU . . . . . 0.428 ' HG2' ' H ' ' A' ' 911' ' ' LYS . 3.5 pm0 -62.29 -40.82 97.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.245 0.545 . . . . 0.0 109.682 172.911 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 911' ' ' LYS . . . . . 0.428 ' H ' ' HG2' ' A' ' 910' ' ' GLU . 0.7 OUTLIER -67.84 -35.94 79.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.99 178.286 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 912' ' ' GLN . . . . . 0.463 ' O ' ' HG3' ' A' ' 916' ' ' GLU . 0.0 OUTLIER -63.32 -44.19 95.64 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.225 176.125 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 913' ' ' ARG . . . . . 0.58 ' HD3' ' HB3' ' A' ' 919' ' ' MET . 0.0 OUTLIER -63.7 -28.07 69.64 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.912 179.562 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 63.8 m -74.42 -28.11 60.92 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.96 0.41 . . . . 0.0 110.064 176.451 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.43 -49.98 50.02 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.049 179.217 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 916' ' ' GLU . . . . . 0.514 ' HG3' ' H ' ' A' ' 916' ' ' GLU . 0.0 OUTLIER -77.26 -38.42 51.02 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.984 -178.574 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.74 36.72 18.45 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 121.286 0.565 . . . . 0.0 111.18 -175.939 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -125.09 -14.06 3.44 Favored Glycine 0 N--CA 1.446 -0.646 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.691 179.789 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 919' ' ' MET . . . . . 0.792 ' HA ' HG13 ' A' ' 899' ' ' VAL . 2.7 ttm -63.79 -108.24 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.542 0.337 . . . . 0.0 110.575 175.617 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 920' ' ' ASP . . . . . 0.718 ' HB2' ' O ' ' A' ' 919' ' ' MET . 0.6 OUTLIER 153.0 -81.12 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.563 1.145 . . . . 0.0 110.097 174.355 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 921' ' ' SER . . . . . 0.743 ' HB2' HG23 ' A' ' 900' ' ' ILE . 0.0 OUTLIER -98.61 149.38 22.83 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.133 -174.188 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 922' ' ' CYS . . . . . 0.459 ' HA ' ' O ' ' A' ' 901' ' ' GLY . 10.2 m -130.82 119.46 22.28 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.045 0.45 . . . . 0.0 109.838 176.67 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 923' ' ' LEU . . . . . 0.579 ' HB2' ' HB ' ' A' ' 902' ' ' VAL . 68.3 mt -120.17 167.11 12.57 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.939 -174.759 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -89.29 147.06 24.32 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.143 175.875 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 925' ' ' LYS . . . . . 0.528 ' HB3' ' HD3' ' A' ' 926' ' ' PRO . 10.0 tttp -57.56 -49.05 95.99 Favored Pre-proline 0 CA--C 1.539 0.55 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 179.73 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 926' ' ' PRO . . . . . 0.528 ' HD3' ' HB3' ' A' ' 925' ' ' LYS . 11.5 Cg_exo -72.24 66.16 3.51 Favored 'Trans proline' 0 C--N 1.357 0.985 0 C-N-CA 122.245 1.963 . . . . 0.0 112.708 177.756 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 1.1 t -99.28 136.47 30.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.262 178.314 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -94.57 171.84 8.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.307 -178.179 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 929' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.43 -45.93 73.12 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 -177.105 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.8 -48.48 81.61 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.914 0.387 . . . . 0.0 110.287 -175.652 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 43.7 t -62.08 -52.39 60.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.42 179.009 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 932' ' ' ILE . . . . . 0.645 HG21 ' HG2' ' A' ' 843' ' ' GLN . 0.0 OUTLIER -63.13 -39.09 83.89 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 CA-C-O 120.647 0.261 . . . . 0.0 111.284 -175.412 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 933' ' ' LYS . . . . . 0.447 ' HE2' ' HB3' ' A' ' 933' ' ' LYS . 0.0 OUTLIER -67.26 -47.68 70.0 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-O 120.875 0.369 . . . . 0.0 110.305 -179.327 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 934' ' ' GLN . . . . . 0.604 ' O ' ' HB2' ' A' ' 938' ' ' LEU . 0.0 OUTLIER -65.62 -35.82 81.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.107 -178.455 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 935' ' ' THR . . . . . 0.502 ' N ' ' HG2' ' A' ' 934' ' ' GLN . 19.2 m -72.97 -43.86 61.75 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.621 0.248 . . . . 0.0 111.187 -179.486 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 936' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.19 -45.02 90.2 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.572 -0.285 . . . . 0.0 110.343 178.862 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 26.6 m -64.37 -40.75 96.45 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.829 178.049 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 938' ' ' LEU . . . . . 0.645 ' O ' ' HG2' ' A' ' 941' ' ' GLU . 1.4 tp -62.68 -42.38 99.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.063 179.155 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 939' ' ' TYR . . . . . 0.448 ' O ' HG13 ' A' ' 943' ' ' VAL . 2.3 m-85 -75.86 -27.09 57.66 Favored 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.974 -179.321 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -65.53 -32.65 74.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.172 0.511 . . . . 0.0 109.953 172.605 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 941' ' ' GLU . . . . . 0.645 ' HG2' ' O ' ' A' ' 938' ' ' LEU . 2.1 pt-20 -74.6 -31.46 62.03 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.161 175.621 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 942' ' ' ARG . . . . . 0.608 ' HG2' ' O ' ' A' ' 938' ' ' LEU . 4.6 mmt85 -65.34 -47.42 76.54 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-O 120.94 0.4 . . . . 0.0 110.278 177.966 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 943' ' ' VAL . . . . . 0.448 HG13 ' O ' ' A' ' 939' ' ' TYR . 5.1 m -69.01 -30.58 47.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.649 179.186 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.63 -41.76 83.38 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.422 177.042 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 2.0 pttt -74.36 -25.85 59.77 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.575 0.226 . . . . 0.0 110.906 -179.741 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 15.2 m -76.21 -34.93 59.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.225 0.536 . . . . 0.0 109.741 175.178 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -72.9 -22.92 60.67 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.315 176.93 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.98 -5.53 49.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.267 177.751 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 5.9 m . . . . . 0 C--O 1.25 1.116 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.225 178.835 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.259 0 CA-C-O 120.989 0.423 . . . . 0.0 110.403 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 127.97 -6.72 6.87 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.971 -0.633 . . . . 0.0 111.751 -176.018 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 707' ' ' LYS . . . . . 0.412 ' HA ' ' HD2' ' A' ' 707' ' ' LYS . 2.9 mmmt -66.7 134.78 52.94 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 175.483 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 708' ' ' ARG . . . . . . . . . . . . . 10.5 mtt180 -102.7 146.25 28.49 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 121.473 0.654 . . . . 0.0 111.953 -171.291 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 709' ' ' CYS . . . . . 0.428 ' O ' ' HA ' ' A' ' 733' ' ' VAL . 61.8 m -134.86 119.73 18.46 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.986 -1.007 . . . . 0.0 109.019 174.146 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 710' ' ' TRP . . . . . 0.498 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 81.5 m95 -92.14 134.94 34.39 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 -177.288 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 711' ' ' LEU . . . . . 0.543 HD22 HG12 ' A' ' 733' ' ' VAL . 0.1 OUTLIER -126.16 125.55 42.67 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.611 0.72 . . . . 0.0 111.11 -177.958 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -120.9 65.59 0.86 Allowed 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.181 -0.918 . . . . 0.0 108.86 176.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 713' ' ' VAL . . . . . 0.829 HG13 ' HB3' ' A' ' 750' ' ' ASP . 21.1 t -114.76 113.54 43.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.348 -177.514 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 41.8 mtm180 -77.13 -23.61 51.71 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.186 0.517 . . . . 0.0 109.622 179.146 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -72.83 97.42 2.24 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.481 175.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -61.94 -31.52 71.85 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.897 -174.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.32 -48.25 78.83 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.136 0.493 . . . . 0.0 110.275 179.153 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 718' ' ' LEU . . . . . 0.502 HD12 ' HA ' ' A' ' 786' ' ' ALA . 1.4 tt -72.49 -42.53 64.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.496 178.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 719' ' ' CYS . . . . . 0.725 ' HB2' ' HB ' ' A' ' 713' ' ' VAL . 0.0 OUTLIER -58.93 -52.18 66.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.804 -177.852 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 720' ' ' GLN . . . . . 0.651 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 22.5 tt0 -62.23 -42.36 99.24 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.979 -179.124 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -59.39 -53.06 62.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.038 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 722' ' ' LEU . . . . . 0.432 ' HA ' HD22 ' A' ' 722' ' ' LEU . 0.3 OUTLIER -64.98 -44.76 88.23 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.253 -177.936 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 723' ' ' GLU . . . . . 0.651 ' HG2' ' HA ' ' A' ' 720' ' ' GLN . 2.0 pt-20 -64.55 -40.12 94.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.644 -174.535 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 724' ' ' THR . . . . . 0.526 ' N ' ' HG3' ' A' ' 723' ' ' GLU . 9.2 m -70.04 -38.61 75.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.853 0.358 . . . . 0.0 110.96 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 20.3 m -64.39 -38.28 90.47 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.507 -178.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 726' ' ' LEU . . . . . . . . . . . . . 5.4 mt -74.58 -36.34 63.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.055 0.455 . . . . 0.0 110.97 -178.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 727' ' ' GLN . . . . . 0.578 ' HG3' HG23 ' A' ' 733' ' ' VAL . 34.0 mt-30 -75.66 6.91 4.24 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.65 -178.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 8.3 mtm-85 -76.7 -16.51 59.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.881 0.372 . . . . 0.0 111.077 179.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 14.5 m -107.72 -99.68 0.36 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.759 177.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 730' ' ' GLY . . . . . . . . . . . . . . . -144.88 31.88 1.73 Allowed Glycine 0 N--CA 1.448 -0.514 0 N-CA-C 110.933 -0.867 . . . . 0.0 110.933 179.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 731' ' ' ILE . . . . . . . . . . . . . 26.6 mm -100.24 132.64 45.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.303 -0.448 . . . . 0.0 110.045 -176.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 732' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -100.72 105.4 17.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.094 0.473 . . . . 0.0 110.536 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 733' ' ' VAL . . . . . 0.578 HG23 ' HG3' ' A' ' 727' ' ' GLN . 4.5 t -84.08 126.9 40.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.624 177.121 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 734' ' ' THR . . . . . 0.434 ' HB ' ' CE3' ' A' ' 710' ' ' TRP . 0.2 OUTLIER -124.36 140.14 53.23 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.921 0.391 . . . . 0.0 111.131 -175.77 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 1.4 m -65.79 115.52 6.01 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.977 178.587 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 736' ' ' TYR . . . . . 0.498 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 70.3 t80 -89.57 114.08 25.59 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.474 -179.157 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -117.98 -49.77 2.5 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.475 178.169 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -157.32 38.86 0.55 Allowed Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.965 -0.636 . . . . 0.0 111.563 -179.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 15.5 mp0 -86.2 175.68 8.37 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.475 -0.362 . . . . 0.0 110.775 -177.022 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 740' ' ' GLU . . . . . 0.441 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 11.5 mt-10 -95.12 147.78 33.59 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.683 -178.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 741' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 740' ' ' GLU . 3.1 Cg_endo -84.77 122.45 2.66 Favored 'Trans proline' 0 N--CA 1.455 -0.774 0 C-N-CA 122.803 2.335 . . . . 0.0 112.471 -179.076 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 742' ' ' THR . . . . . 0.553 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.3 OUTLIER -103.32 138.11 19.45 Favored Pre-proline 0 C--N 1.322 -0.615 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.269 177.344 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 743' ' ' PRO . . . . . 0.553 ' HD2' HG22 ' A' ' 742' ' ' THR . 36.4 Cg_endo -66.02 -0.98 4.55 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.954 2.436 . . . . 0.0 113.131 -178.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -108.31 -6.51 16.26 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.088 0.47 . . . . 0.0 110.261 178.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 87.6 m-20 -108.49 157.66 18.25 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.596 -170.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 746' ' ' VAL . . . . . 0.512 HG11 HD11 ' A' ' 795' ' ' LEU . 1.3 p -123.71 137.35 57.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.484 -179.254 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 747' ' ' LEU . . . . . 0.484 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 0.6 OUTLIER -106.72 111.55 24.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.513 -179.43 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 2.9 mt -100.78 110.72 28.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 176.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 749' ' ' THR . . . . . 0.512 HG21 ' HB ' ' A' ' 753' ' ' VAL . 4.9 t -118.76 166.61 12.57 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.709 0.29 . . . . 0.0 111.012 -176.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 750' ' ' ASP . . . . . 0.829 ' HB3' HG13 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -111.74 136.89 50.39 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.589 177.663 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 751' ' ' GLU . . . . . 0.668 ' HG3' ' H ' ' A' ' 752' ' ' VAL . 3.0 tp10 66.51 174.74 0.24 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.917 -1.038 . . . . 0.0 111.433 -178.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 752' ' ' VAL . . . . . 0.668 ' H ' ' HG3' ' A' ' 751' ' ' GLU . 2.9 p -56.96 120.89 3.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 121.477 0.656 . . . . 0.0 111.233 -179.63 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 753' ' ' VAL . . . . . 0.512 ' HB ' HG21 ' A' ' 749' ' ' THR . 2.7 p -99.34 158.74 3.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.336 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -113.17 25.96 10.89 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.141 0.496 . . . . 0.0 110.5 -178.516 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 755' ' ' LYS . . . . . 0.403 ' H ' HG13 ' A' ' 753' ' ' VAL . 0.0 OUTLIER -120.67 169.29 10.52 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.1 -179.448 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -108.84 -39.69 5.26 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.723 -178.278 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 757' ' ' TRP . . . . . 0.484 ' CD2' ' HB2' ' A' ' 747' ' ' LEU . 76.6 t-105 61.9 85.09 0.13 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.51 0.672 . . . . 0.0 111.233 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 25.7 mm100 -78.01 67.4 3.85 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.1 176.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 759' ' ' GLY . . . . . 0.478 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -129.46 -147.12 6.23 Favored Glycine 0 N--CA 1.444 -0.801 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.291 -177.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.38 -47.22 20.4 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.717 0.294 . . . . 0.0 110.802 -179.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 761' ' ' ALA . . . . . 0.45 ' O ' ' HA ' ' A' ' 746' ' ' VAL . . . -166.75 158.56 13.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.689 -179.064 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 762' ' ' VAL . . . . . 0.817 HG13 ' HG2' ' A' ' 780' ' ' GLU . 1.5 p -131.69 137.37 55.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.53 175.258 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 77.7 t -115.96 121.82 68.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.04 -179.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 764' ' ' THR . . . . . 0.664 ' HB ' HG12 ' A' ' 782' ' ' VAL . 5.7 m -110.92 98.78 7.81 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.242 0.544 . . . . 0.0 111.468 -178.175 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 765' ' ' PHE . . . . . 0.417 ' CD1' HD11 ' A' ' 718' ' ' LEU . 20.6 m-85 -76.83 119.73 21.0 Favored 'General case' 0 C--O 1.221 -0.398 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 174.004 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -94.13 133.82 37.21 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 120.355 -0.538 . . . . 0.0 110.879 -174.103 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 767' ' ' ARG . . . . . 0.577 ' NE ' ' HA ' ' A' ' 767' ' ' ARG . 0.1 OUTLIER -110.08 -36.43 5.85 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.711 -179.374 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.37 -58.13 0.26 Allowed 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.76 0.281 . . . . 0.0 111.76 177.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 34.1 m170 -114.1 146.32 40.43 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 121.752 0.787 . . . . 0.0 112.514 -172.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 770' ' ' ILE . . . . . 0.69 HG22 ' H ' ' A' ' 771' ' ' GLY . 0.6 OUTLIER -110.37 -179.47 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.688 0 CA-C-N 114.448 -1.251 . . . . 0.0 109.644 -179.123 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 771' ' ' GLY . . . . . 0.69 ' H ' HG22 ' A' ' 770' ' ' ILE . . . 170.29 -33.56 0.16 Allowed Glycine 0 N--CA 1.451 -0.346 0 N-CA-C 110.668 -0.973 . . . . 0.0 110.668 -178.252 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 772' ' ' ILE . . . . . 1.051 HG13 ' HD2' ' A' ' 773' ' ' PRO . 1.2 tp -80.64 148.4 65.56 Favored Pre-proline 0 C--N 1.32 -0.685 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 171.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 773' ' ' PRO . . . . . 1.051 ' HD2' HG13 ' A' ' 772' ' ' ILE . 33.4 Cg_endo -65.45 -108.33 0.0 OUTLIER 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 122.652 2.235 . . . . 0.0 113.829 -179.433 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . 0.537 ' HG ' ' H ' ' A' ' 776' ' ' LYS . 1.0 OUTLIER 174.36 -154.75 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 -177.365 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 775' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -60.3 -0.01 0.21 Allowed 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 776' ' ' LYS . . . . . 0.537 ' H ' ' HG ' ' A' ' 774' ' ' LEU . 0.0 OUTLIER -75.01 -11.51 60.12 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 121.334 0.588 . . . . 0.0 109.829 171.487 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 777' ' ' ALA . . . . . 0.452 ' HB1' ' HD2' ' A' ' 778' ' ' PRO . . . -102.91 158.76 31.13 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.597 176.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 778' ' ' PRO . . . . . 0.452 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 54.7 Cg_endo -70.35 63.09 2.13 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.974 2.449 . . . . 0.0 113.445 -177.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 116.09 49.24 0.46 Allowed Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.807 176.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 780' ' ' GLU . . . . . 0.817 ' HG2' HG13 ' A' ' 762' ' ' VAL . 0.7 OUTLIER -130.78 140.06 50.26 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 177.165 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 45.5 m95 -141.47 112.64 7.41 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 110.487 -0.19 . . . . 0.0 110.487 -178.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . 0.664 HG12 ' HB ' ' A' ' 764' ' ' THR . 31.2 m -106.67 143.84 16.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-O 121.151 0.501 . . . . 0.0 111.063 179.138 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 783' ' ' HIS . . . . . . . . . . . . . 7.5 t-160 -165.47 121.38 1.36 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.189 174.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.45 100.74 9.46 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.106 176.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 785' ' ' VAL . . . . . 0.424 ' HB ' ' HD3' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -154.94 176.54 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.0 -0.545 . . . . 0.0 109.69 179.941 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 786' ' ' ALA . . . . . 0.502 ' HA ' HD12 ' A' ' 718' ' ' LEU . . . -115.87 39.92 2.92 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.515 178.518 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 787' ' ' ALA . . . . . 0.414 ' HB2' ' HG ' ' A' ' 718' ' ' LEU . . . 62.91 69.99 0.8 Allowed Pre-proline 0 CA--C 1.529 0.156 0 CA-C-N 115.795 -0.638 . . . . 0.0 111.595 178.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 788' ' ' PRO . . . . . 0.678 ' HD2' ' OE1' ' A' ' 790' ' ' GLU . 12.1 Cg_exo -70.18 -66.54 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.772 2.315 . . . . 0.0 111.529 175.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 789' ' ' HIS . . . . . 0.425 ' HB3' ' O ' ' A' ' 788' ' ' PRO . 1.8 p80 177.08 -3.96 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.214 178.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 790' ' ' GLU . . . . . 0.678 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -84.38 -48.68 9.42 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.803 0.297 . . . . 0.0 111.803 -172.065 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 791' ' ' LEU . . . . . 0.568 ' N ' ' HD2' ' A' ' 792' ' ' PRO . 1.1 mt -70.43 -42.84 16.02 Favored Pre-proline 0 C--N 1.326 -0.438 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -177.187 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 792' ' ' PRO . . . . . 0.568 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 8.8 Cg_endo -54.23 -36.85 87.38 Favored 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 121.653 1.569 . . . . 0.0 111.713 170.83 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -69.84 -37.21 76.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.612 177.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -61.59 -39.02 89.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.104 176.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 795' ' ' LEU . . . . . 0.512 HD11 HG11 ' A' ' 746' ' ' VAL . 0.2 OUTLIER -63.23 -43.76 97.15 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.995 0.426 . . . . 0.0 110.658 178.531 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -66.63 -30.96 71.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.628 178.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.3 -44.24 65.55 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.753 178.384 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -65.55 -31.11 52.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.968 -179.078 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 799' ' ' TYR . . . . . 0.414 ' HD1' ' HA ' ' A' ' 799' ' ' TYR . 0.2 OUTLIER -83.7 -27.6 28.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.418 177.189 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.462 0.157 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.169 179.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 31.7 t0 . . . . . 0 C--O 1.234 0.282 0 CA-C-O 121.263 0.554 . . . . 0.0 110.721 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 825' ' ' MET . . . . . 0.411 ' HG2' HD11 ' A' ' 827' ' ' ILE . 3.2 ttm -96.23 108.14 20.57 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.594 175.504 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 826' ' ' MET . . . . . 0.598 ' HG2' HG13 ' A' ' 869' ' ' ILE . 2.3 tpp -100.16 118.27 36.15 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.794 -178.509 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 827' ' ' ILE . . . . . 0.579 HG23 ' HB ' ' A' ' 871' ' ' ILE . 4.8 mm -108.58 128.79 63.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.657 178.129 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 828' ' ' LEU . . . . . 0.572 ' HB2' HG12 ' A' ' 869' ' ' ILE . 0.5 OUTLIER -105.41 128.76 53.69 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.424 -177.892 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 829' ' ' VAL . . . . . 0.63 ' HB ' HD12 ' A' ' 873' ' ' LEU . 1.2 p -114.77 114.87 47.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 121.084 0.469 . . . . 0.0 110.532 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 830' ' ' VAL . . . . . 0.482 HG22 ' HB3' ' A' ' 854' ' ' ALA . 80.3 t -109.23 105.45 18.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.918 177.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 831' ' ' ASP . . . . . 0.886 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 33.3 t0 -117.55 137.41 52.59 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.739 -177.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.05 -21.95 60.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.666 178.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 1.2 m170 -111.48 106.82 57.02 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.581 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -49.29 -44.57 33.46 Favored 'Trans proline' 0 CA--C 1.533 0.463 0 C-N-CA 123.965 3.11 . . . . 0.0 114.672 -174.047 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 835' ' ' ILE . . . . . 0.406 ' O ' ' HG3' ' A' ' 838' ' ' ARG . 0.4 OUTLIER -65.39 -36.21 77.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.862 0.363 . . . . 0.0 111.081 -178.253 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 836' ' ' ASN . . . . . 0.534 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 5.0 m120 -75.33 -35.47 61.21 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 178.186 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 837' ' ' ARG . . . . . 0.886 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 1.3 ttp180 -53.36 -45.91 69.35 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.427 175.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 838' ' ' ARG . . . . . 0.406 ' HG3' ' O ' ' A' ' 835' ' ' ILE . 1.2 ppt_? -72.03 -28.75 63.57 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.982 178.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.99 -53.21 27.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.53 -0.304 . . . . 0.0 111.807 -177.093 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 840' ' ' LEU . . . . . 0.538 HD12 HG21 ' A' ' 829' ' ' VAL . 0.0 OUTLIER -72.24 -27.69 62.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.944 0.402 . . . . 0.0 109.963 -179.997 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -64.63 -35.53 81.31 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.079 174.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -64.8 -43.94 91.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.211 176.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 843' ' ' GLN . . . . . 0.476 ' O ' HD22 ' A' ' 847' ' ' LEU . 0.9 OUTLIER -58.11 -46.45 85.54 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.128 176.526 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 844' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.5 -42.62 96.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.071 178.177 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -68.04 -22.36 74.12 Favored Glycine 0 N--CA 1.45 -0.369 0 CA-C-N 116.05 -0.523 . . . . 0.0 112.282 178.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 35.8 m -75.32 -30.34 60.29 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.515 -0.18 . . . . 0.0 110.515 177.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 847' ' ' LEU . . . . . 0.476 HD22 ' O ' ' A' ' 843' ' ' GLN . 0.1 OUTLIER -68.52 -44.51 74.45 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 120.911 0.386 . . . . 0.0 110.168 173.41 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 105.19 59.56 0.65 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.79 -0.719 . . . . 0.0 113.35 174.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -143.45 -178.59 5.95 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 122.781 -0.246 . . . . 0.0 110.348 177.51 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -74.86 122.26 23.11 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 -177.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -122.47 120.55 34.24 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.516 -177.056 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 852' ' ' LYS . . . . . 0.458 ' HB3' HD12 ' A' ' 828' ' ' LEU . 0.0 OUTLIER -110.85 115.26 29.23 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.405 178.84 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.78 114.84 26.61 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.026 -177.344 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 854' ' ' ALA . . . . . 0.482 ' HB3' HG22 ' A' ' 830' ' ' VAL . . . -132.42 171.81 13.27 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.112 0.482 . . . . 0.0 111.629 -179.391 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 855' ' ' ASN . . . . . 0.478 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 6.3 t-20 -160.8 97.53 1.18 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.305 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 856' ' ' ASP . . . . . 0.478 ' HB2' ' O ' ' A' ' 855' ' ' ASN . 48.8 t0 170.06 156.28 0.06 Allowed 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.293 179.354 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -88.61 -49.36 3.66 Favored Glycine 0 N--CA 1.447 -0.606 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.071 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -74.27 -34.83 38.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 O-C-N 122.773 -0.251 . . . . 0.0 111.138 -178.144 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 859' ' ' ASP . . . . . 0.453 ' HB2' ' OD2' ' A' ' 856' ' ' ASP . 3.7 t0 -69.05 -19.12 64.09 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 111.925 0.343 . . . . 0.0 111.925 -178.163 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -64.78 -53.02 53.58 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.5 0.666 . . . . 0.0 109.582 173.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 861' ' ' LEU . . . . . 0.849 HD13 ' HA ' ' A' ' 890' ' ' ILE . 9.6 tp -61.15 -41.54 96.94 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.481 -0.782 . . . . 0.0 109.731 175.183 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 862' ' ' ASN . . . . . 0.425 ' HB3' ' HA ' ' A' ' 859' ' ' ASP . 48.2 t30 -60.03 -29.23 68.36 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.742 -1.117 . . . . 0.0 110.834 178.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 863' ' ' VAL . . . . . 0.629 HG13 HD13 ' A' ' 869' ' ' ILE . 0.5 OUTLIER -72.92 -34.62 46.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.621 -179.211 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 864' ' ' LEU . . . . . 0.471 HD22 HD21 ' A' ' 897' ' ' LEU . 6.3 mt -64.71 -33.33 75.71 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.224 0.535 . . . . 0.0 109.774 175.305 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -78.14 -24.88 47.2 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.875 178.199 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 9.0 mtmt -77.93 -48.55 16.07 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.93 -178.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 2.1 p30 -156.72 176.55 12.59 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.21 -177.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 79.2 t60 -91.31 97.3 11.02 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.109 0.481 . . . . 0.0 112.01 -174.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 869' ' ' ILE . . . . . 0.629 HD13 HG13 ' A' ' 863' ' ' VAL . 0.7 OUTLIER -94.31 133.65 34.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 166.806 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 870' ' ' ASP . . . . . 0.408 ' O ' ' HB2' ' A' ' 897' ' ' LEU . 1.8 m-20 -86.37 -43.99 12.41 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.71 0.29 . . . . 0.0 111.143 -174.366 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 871' ' ' ILE . . . . . 0.579 ' HB ' HG23 ' A' ' 827' ' ' ILE . 43.2 mm -122.59 126.31 73.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.217 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 872' ' ' VAL . . . . . 0.437 HG21 HD21 ' A' ' 864' ' ' LEU . 3.6 t -106.46 122.48 60.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 120.683 0.278 . . . . 0.0 110.334 178.343 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 873' ' ' LEU . . . . . 0.63 HD12 ' HB ' ' A' ' 829' ' ' VAL . 0.1 OUTLIER -104.86 121.55 43.91 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.114 177.113 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -109.45 106.34 16.05 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 177.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 875' ' ' ASP . . . . . 0.468 ' OD1' ' HG2' ' A' ' 925' ' ' LYS . 7.0 t0 -106.13 119.92 40.46 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.491 -175.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 10.5 t -126.26 119.87 55.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.213 -176.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 877' ' ' ASN . . . . . 0.722 ' HB2' ' HE2' ' A' ' 925' ' ' LYS . 0.1 OUTLIER -109.78 -36.35 5.94 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.156 175.186 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 1.5 mmm . . . . . 0 C--N 1.323 -0.58 0 CA-C-O 121.017 0.437 . . . . 0.0 111.308 -178.384 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.444 0 N-CA-C 113.711 0.244 . . . . 0.0 113.711 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -70.88 -43.04 69.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.442 0.639 . . . . 0.0 109.479 -177.609 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 885' ' ' ARG . . . . . 0.464 ' HG2' ' HG3' ' A' ' 889' ' ' ARG . 0.0 OUTLIER -58.21 -32.97 68.78 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.325 177.1 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.75 -56.22 19.51 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.909 -176.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 887' ' ' THR . . . . . 0.405 ' O ' HG22 ' A' ' 890' ' ' ILE . 0.1 OUTLIER -65.83 -44.32 85.89 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.434 -176.741 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 6.3 tp60 -61.24 -50.36 73.38 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.184 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 889' ' ' ARG . . . . . 0.464 ' HG3' ' HG2' ' A' ' 885' ' ' ARG . 2.9 mtt180 -66.51 -41.45 88.82 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.436 -176.196 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 890' ' ' ILE . . . . . 0.849 ' HA ' HD13 ' A' ' 861' ' ' LEU . 10.5 tt -64.53 -41.71 93.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 C-N-CA 121.159 -0.216 . . . . 0.0 111.398 -176.305 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 891' ' ' ARG . . . . . 0.973 ' HA ' ' HB2' ' A' ' 895' ' ' LEU . 10.5 ptt85 -76.35 -32.32 58.57 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.671 179.001 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -70.02 -45.58 66.91 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.319 -176.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 893' ' ' LEU . . . . . 0.781 HD12 HD21 ' A' ' 861' ' ' LEU . 3.9 mt -75.06 -26.91 59.72 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.865 0.321 . . . . 0.0 111.865 -175.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 146.48 71.88 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.027 -1.082 . . . . 0.0 113.47 175.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 895' ' ' LEU . . . . . 0.973 ' HB2' ' HA ' ' A' ' 891' ' ' ARG . 0.5 OUTLIER -85.22 127.87 34.46 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 173.977 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -129.38 -9.29 4.67 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.126 0.489 . . . . 0.0 111.367 -177.727 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 897' ' ' LEU . . . . . 0.471 HD21 HD22 ' A' ' 864' ' ' LEU . 0.4 OUTLIER -122.89 157.98 58.57 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.832 -172.368 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -71.33 140.14 36.34 Favored 'Trans proline' 0 C--O 1.241 0.643 0 C-N-CA 123.069 2.513 . . . . 0.0 112.718 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 899' ' ' VAL . . . . . 0.926 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 43.3 t -114.53 132.98 62.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.733 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 900' ' ' ILE . . . . . 0.446 HG12 ' HB2' ' A' ' 921' ' ' SER . 89.6 mt -103.5 114.33 42.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.955 175.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 901' ' ' GLY . . . . . 0.53 ' O ' ' HA ' ' A' ' 922' ' ' CYS . . . -94.17 109.75 3.87 Favored Glycine 0 N--CA 1.443 -0.866 0 C-N-CA 120.738 -0.744 . . . . 0.0 111.518 177.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 902' ' ' VAL . . . . . 0.812 ' HB ' HD12 ' A' ' 923' ' ' LEU . 0.1 OUTLIER -108.6 118.76 56.88 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 177.707 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.95 154.06 48.53 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.859 -171.258 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -83.0 105.76 14.26 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.018 174.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 69.07 104.08 0.06 Allowed 'General case' 0 N--CA 1.467 0.409 0 O-C-N 123.803 0.689 . . . . 0.0 110.944 179.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -81.13 53.25 1.96 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.747 -175.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 1.3 mt -80.79 -58.91 2.88 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.006 0.431 . . . . 0.0 110.368 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -94.0 -19.49 20.84 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.374 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.56 -54.03 50.62 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.158 -178.172 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 910' ' ' GLU . . . . . 0.465 ' HA ' ' NH1' ' A' ' 913' ' ' ARG . 9.8 tp10 -50.85 -46.44 60.15 Favored 'General case' 0 N--CA 1.463 0.189 0 O-C-N 123.581 0.551 . . . . 0.0 111.453 -176.172 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 10.1 tmtt? -64.77 -52.49 56.64 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.399 -176.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -69.61 -43.94 71.73 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 111.699 0.259 . . . . 0.0 111.699 -174.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 913' ' ' ARG . . . . . 0.465 ' NH1' ' HA ' ' A' ' 910' ' ' GLU . 0.1 OUTLIER -65.98 -27.26 68.0 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 121.184 -0.206 . . . . 0.0 111.135 -176.9 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 78.3 m -74.63 -39.8 61.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.77 0.319 . . . . 0.0 110.377 175.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.61 -42.92 95.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.612 179.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -72.72 -42.71 63.86 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.804 179.173 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 50.7 50.0 19.81 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.807 -176.339 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -123.56 16.45 7.94 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.218 -178.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 919' ' ' MET . . . . . 0.926 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -113.77 -113.18 0.34 Allowed 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 179.221 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 920' ' ' ASP . . . . . 0.608 ' HB2' ' O ' ' A' ' 919' ' ' MET . 5.3 t70 164.52 -58.48 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.482 0 O-C-N 124.199 0.937 . . . . 0.0 109.89 174.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . 0.446 ' HB2' HG12 ' A' ' 900' ' ' ILE . 57.9 m -113.87 164.59 13.56 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.035 177.805 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 922' ' ' CYS . . . . . 0.53 ' HA ' ' O ' ' A' ' 901' ' ' GLY . 0.1 OUTLIER -148.78 140.13 23.3 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.513 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 923' ' ' LEU . . . . . 0.812 HD12 ' HB ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -147.68 177.86 8.95 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.773 0.321 . . . . 0.0 110.439 178.184 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.87 146.18 24.61 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.991 -178.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 925' ' ' LYS . . . . . 0.722 ' HE2' ' HB2' ' A' ' 877' ' ' ASN . 3.7 tmtm? -45.73 -51.62 28.45 Favored Pre-proline 0 N--CA 1.47 0.572 0 O-C-N 123.67 0.606 . . . . 0.0 112.308 177.375 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -72.1 64.61 3.41 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 121.742 1.628 . . . . 0.0 112.169 175.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 2.1 p -71.65 148.94 9.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.043 0.449 . . . . 0.0 110.633 179.199 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.82 160.25 14.76 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.552 179.298 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 929' ' ' LEU . . . . . 0.431 HD23 ' HA ' ' A' ' 929' ' ' LEU . 0.0 OUTLIER -56.67 -45.36 81.74 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.107 -179.14 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -65.99 -44.61 84.34 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.824 0.345 . . . . 0.0 110.692 -176.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 931' ' ' VAL . . . . . 0.458 ' O ' ' HG3' ' A' ' 934' ' ' GLN . 74.4 t -63.65 -42.94 97.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.785 -178.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 932' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -66.7 -33.9 66.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.444 178.43 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.84 -48.67 58.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.002 -178.763 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 934' ' ' GLN . . . . . 0.458 ' HG3' ' O ' ' A' ' 931' ' ' VAL . 0.6 OUTLIER -65.7 -40.97 92.82 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 121.132 -0.227 . . . . 0.0 111.161 -177.573 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 12.4 m -64.41 -43.77 93.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.731 0.301 . . . . 0.0 111.087 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 936' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.78 -41.94 91.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.856 178.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 39.6 m -65.43 -44.46 87.29 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.229 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.15 -40.34 89.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.081 0.467 . . . . 0.0 110.503 178.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 939' ' ' TYR . . . . . 0.488 ' HD1' ' HA ' ' A' ' 939' ' ' TYR . 0.5 OUTLIER -72.85 -36.3 67.4 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.879 -178.902 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -62.15 -39.07 91.4 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.068 0.461 . . . . 0.0 110.905 177.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 941' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.31 -24.11 43.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.349 178.319 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 942' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.6 -47.75 68.8 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.418 178.512 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 943' ' ' VAL . . . . . 0.432 HG22 ' O ' ' A' ' 939' ' ' TYR . 5.8 m -69.51 -28.76 39.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.042 176.582 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -58.57 -33.52 70.05 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.195 173.763 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 3.3 mmtp -69.1 -48.77 61.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.842 177.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.1 -42.39 72.76 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.835 -0.62 . . . . 0.0 112.658 -175.174 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 11.1 mtm-85 -89.18 -33.74 16.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.755 0.312 . . . . 0.0 111.202 -175.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 1.2 t0 . . . . . 0 C--O 1.234 0.239 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.369 -177.625 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.452 -0.333 0 CA-C-O 120.547 0.213 . . . . 0.0 111.034 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 80.99 45.84 7.41 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.848 -0.691 . . . . 0.0 113.473 173.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 4.4 tptt -145.59 153.74 41.39 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 176.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 708' ' ' ARG . . . . . 0.703 ' HG2' HG13 ' A' ' 732' ' ' VAL . 0.0 OUTLIER -118.59 156.39 29.26 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.216 0.532 . . . . 0.0 111.849 -172.716 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 709' ' ' CYS . . . . . 0.459 ' SG ' HD13 ' A' ' 726' ' ' LEU . 0.5 OUTLIER -142.19 145.25 33.95 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.794 173.741 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 710' ' ' TRP . . . . . . . . . . . . . 66.4 m95 -114.26 131.99 56.3 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 177.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 711' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -122.86 131.31 53.69 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.476 0.655 . . . . 0.0 111.658 -175.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -126.81 65.56 1.27 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.816 -1.084 . . . . 0.0 109.128 174.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 713' ' ' VAL . . . . . 0.865 ' HA ' ' HB2' ' A' ' 750' ' ' ASP . 13.4 t -113.1 134.3 56.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.681 -175.085 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -100.97 -27.6 13.2 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.68 -174.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 -74.57 124.97 27.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.942 173.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -70.37 -40.26 74.12 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.173 -173.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.66 -41.49 95.14 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.164 0.507 . . . . 0.0 110.479 178.63 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 718' ' ' LEU . . . . . 0.673 HD11 ' HD2' ' A' ' 765' ' ' PHE . 0.4 OUTLIER -71.87 -49.37 38.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.704 -179.41 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 719' ' ' CYS . . . . . 0.673 ' HB2' ' HB ' ' A' ' 713' ' ' VAL . 0.0 OUTLIER -60.25 -52.21 66.24 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.824 -177.752 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 720' ' ' GLN . . . . . 0.694 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 0.1 OUTLIER -63.49 -40.29 96.7 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -175.957 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -64.11 -43.48 95.22 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.808 0.337 . . . . 0.0 110.58 -179.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.4 -48.41 64.75 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.789 -179.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 723' ' ' GLU . . . . . 0.694 ' HG2' ' HA ' ' A' ' 720' ' ' GLN . 1.5 pt-20 -63.05 -42.49 99.74 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.379 -176.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 724' ' ' THR . . . . . 0.582 ' N ' ' HG3' ' A' ' 723' ' ' GLU . 20.1 m -70.84 -34.18 71.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.445 0.164 . . . . 0.0 111.359 -178.059 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 72.6 m -68.87 -37.76 79.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.775 0.321 . . . . 0.0 110.927 179.329 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 726' ' ' LEU . . . . . 0.524 HD21 HD12 ' A' ' 795' ' ' LEU . 14.1 mt -73.41 -42.49 62.02 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.081 0.467 . . . . 0.0 110.493 179.333 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -75.77 10.08 1.99 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.532 178.129 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.81 -35.14 64.85 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.809 0.338 . . . . 0.0 110.183 179.069 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 13.1 m -100.25 -94.22 0.27 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.677 177.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 730' ' ' GLY . . . . . . . . . . . . . . . -152.28 38.21 0.78 Allowed Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 111.336 -0.705 . . . . 0.0 111.336 -179.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 731' ' ' ILE . . . . . . . . . . . . . 42.9 mm -101.42 128.31 53.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 178.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 732' ' ' VAL . . . . . 0.703 HG13 ' HG2' ' A' ' 708' ' ' ARG . 0.9 OUTLIER -98.02 114.73 36.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.368 0.604 . . . . 0.0 110.84 -176.403 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 733' ' ' VAL . . . . . . . . . . . . . 5.2 p -98.22 147.79 6.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.023 177.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 22.3 m -141.67 137.3 31.67 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.849 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -54.9 125.34 19.83 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.727 174.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 736' ' ' TYR . . . . . 0.414 ' CE2' ' HD3' ' A' ' 755' ' ' LYS . 21.8 t80 -74.74 83.76 2.12 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.172 0.51 . . . . 0.0 111.059 -179.294 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -70.24 -60.46 2.27 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.133 175.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 179.99 49.02 0.08 OUTLIER Glycine 0 N--CA 1.445 -0.734 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.513 179.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.89 147.07 23.97 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.86 0.362 . . . . 0.0 110.278 -178.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 34.7 mp0 -68.63 143.93 95.63 Favored Pre-proline 0 C--N 1.32 -0.71 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.765 -178.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 741' ' ' PRO . . . . . 0.483 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 40.4 Cg_endo -66.14 135.0 38.7 Favored 'Trans proline' 0 C--O 1.234 0.305 0 C-N-CA 122.931 2.421 . . . . 0.0 113.417 -176.429 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 742' ' ' THR . . . . . 0.547 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.0 OUTLIER -117.92 139.59 26.69 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.416 177.491 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 743' ' ' PRO . . . . . 0.578 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 33.5 Cg_endo -64.15 -17.12 58.55 Favored 'Trans proline' 0 N--CA 1.476 0.481 0 C-N-CA 123.042 2.495 . . . . 0.0 113.633 -176.076 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 744' ' ' GLU . . . . . 0.407 ' HG2' ' CG ' ' A' ' 834' ' ' PRO . 0.9 OUTLIER -97.97 -2.89 39.44 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.915 0.388 . . . . 0.0 110.645 179.492 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -109.56 155.28 21.59 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.232 -170.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 746' ' ' VAL . . . . . 0.883 HG21 HD11 ' A' ' 795' ' ' LEU . 17.3 m -120.09 148.16 23.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.518 -0.764 . . . . 0.0 110.878 -178.266 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 747' ' ' LEU . . . . . 0.501 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 0.2 OUTLIER -117.73 106.03 12.62 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.142 178.296 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 10.4 mt -95.28 108.84 21.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 177.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -114.31 147.38 39.18 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.168 0.509 . . . . 0.0 111.625 -171.433 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 750' ' ' ASP . . . . . 0.865 ' HB2' ' HA ' ' A' ' 713' ' ' VAL . 31.0 t0 -98.1 121.75 40.4 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.427 179.573 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 751' ' ' GLU . . . . . 0.408 ' HA ' ' HB3' ' A' ' 766' ' ' CYS . 1.0 OUTLIER 57.1 -150.54 0.44 Allowed 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.063 -176.677 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 752' ' ' VAL . . . . . 0.641 HG13 HG13 ' A' ' 772' ' ' ILE . 6.6 t -97.61 106.21 18.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 O-C-N 122.015 -0.428 . . . . 0.0 112.13 -173.571 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 2.1 t -103.42 -8.12 9.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.433 169.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 3.9 m 52.59 45.48 28.54 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.82 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 755' ' ' LYS . . . . . 0.414 ' HD3' ' CE2' ' A' ' 736' ' ' TYR . 0.0 OUTLIER -96.13 116.83 29.58 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.254 177.547 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 756' ' ' LYS . . . . . 0.458 ' HD3' ' HA ' ' A' ' 756' ' ' LYS . 1.8 mmpt? -81.98 81.78 7.83 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.445 0.641 . . . . 0.0 109.801 176.213 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 757' ' ' TRP . . . . . 0.623 ' HB3' ' HB ' ' A' ' 762' ' ' VAL . 74.2 t-105 -72.03 103.46 3.26 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.222 -177.469 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.62 87.94 7.53 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 175.514 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 759' ' ' GLY . . . . . 0.578 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -161.91 -139.18 2.58 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.159 -179.017 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 14.8 ttt85 -70.04 -59.49 2.88 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.809 0.338 . . . . 0.0 110.455 -179.308 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -163.86 144.43 8.57 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.264 -178.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 762' ' ' VAL . . . . . 0.623 ' HB ' ' HB3' ' A' ' 757' ' ' TRP . 2.0 p -118.66 119.53 61.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.519 174.671 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 763' ' ' VAL . . . . . 0.643 HG11 HD21 ' A' ' 791' ' ' LEU . 45.6 t -107.88 108.34 25.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.642 -178.475 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 764' ' ' THR . . . . . 0.825 ' HB ' HG12 ' A' ' 782' ' ' VAL . 84.9 m -96.89 116.35 29.03 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.511 179.113 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 765' ' ' PHE . . . . . 0.673 ' HD2' HD11 ' A' ' 718' ' ' LEU . 1.6 m-30 -99.74 93.7 5.95 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 177.343 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 766' ' ' CYS . . . . . 0.408 ' HB3' ' HA ' ' A' ' 751' ' ' GLU . 1.3 p -118.67 132.51 56.17 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.679 -177.271 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 767' ' ' ARG . . . . . 0.823 ' HA ' ' HB3' ' A' ' 784' ' ' SER . 0.4 OUTLIER -109.46 -58.94 1.97 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.753 0.311 . . . . 0.0 110.945 -173.278 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -102.33 -25.87 13.5 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.195 -178.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -109.59 92.77 4.18 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.034 0.445 . . . . 0.0 110.079 179.607 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 3.1 mp -101.09 109.08 24.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.607 -179.065 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -133.44 -9.92 1.98 Allowed Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.927 -179.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 772' ' ' ILE . . . . . 0.641 HG13 HG13 ' A' ' 752' ' ' VAL . 14.2 mt -104.84 138.39 19.49 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.741 0.27 . . . . 0.0 110.379 -178.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 773' ' ' PRO . . . . . 0.486 ' HD3' ' HA ' ' A' ' 772' ' ' ILE . 14.6 Cg_exo -69.14 162.81 40.23 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 123.315 2.677 . . . . 0.0 112.725 -179.854 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . 0.504 ' CB ' HG22 ' A' ' 782' ' ' VAL . 0.7 OUTLIER -98.89 -156.29 0.54 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.97 -178.399 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 775' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 1.4 mp0 -61.42 72.43 0.01 OUTLIER 'General case' 0 C--O 1.234 0.251 0 CA-C-O 122.161 0.981 . . . . 0.0 112.343 176.262 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 5.2 ptmt -131.4 -25.12 2.21 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 114.067 -1.424 . . . . 0.0 108.541 170.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 777' ' ' ALA . . . . . 0.686 ' HB3' ' HB2' ' A' ' 780' ' ' GLU . . . -95.81 163.98 19.88 Favored Pre-proline 0 C--O 1.235 0.34 0 CA-C-N 114.812 -1.086 . . . . 0.0 109.511 175.644 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 778' ' ' PRO . . . . . 0.579 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 43.2 Cg_endo -68.04 70.82 0.85 Allowed 'Trans proline' 0 CA--C 1.533 0.463 0 C-N-CA 122.726 2.284 . . . . 0.0 113.237 -178.289 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 117.44 18.08 5.46 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.672 -0.775 . . . . 0.0 113.162 175.704 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 780' ' ' GLU . . . . . 0.686 ' HB2' ' HB3' ' A' ' 777' ' ' ALA . 2.2 tt0 -94.28 125.83 39.15 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 179.608 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 22.4 m95 -133.38 136.77 45.51 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . 0.825 HG12 ' HB ' ' A' ' 764' ' ' THR . 27.9 m -134.35 161.71 40.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.824 174.523 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 783' ' ' HIS . . . . . . . . . . . . . 4.6 t-160 -172.98 146.34 1.5 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.582 174.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 784' ' ' SER . . . . . 0.823 ' HB3' ' HA ' ' A' ' 767' ' ' ARG . 0.9 OUTLIER -100.22 100.36 11.18 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 173.52 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 785' ' ' VAL . . . . . 0.411 HG11 ' HG3' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -162.65 177.43 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.53 -179.716 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -121.03 63.43 0.87 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.483 177.551 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 54.75 68.44 2.62 Favored Pre-proline 0 N--CA 1.468 0.427 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.75 178.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 788' ' ' PRO . . . . . 0.843 ' HG2' ' HG2' ' A' ' 790' ' ' GLU . 76.5 Cg_endo -89.08 41.24 0.54 Allowed 'Trans proline' 0 N--CA 1.46 -0.443 0 C-N-CA 122.936 2.424 . . . . 0.0 112.978 -177.601 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 73.78 -28.17 0.19 Allowed 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 175.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 790' ' ' GLU . . . . . 0.843 ' HG2' ' HG2' ' A' ' 788' ' ' PRO . 1.2 pt-20 -65.68 -37.88 87.7 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.084 0.402 . . . . 0.0 112.084 -176.295 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 791' ' ' LEU . . . . . 0.643 HD21 HG11 ' A' ' 763' ' ' VAL . 0.2 OUTLIER -67.04 -55.0 17.31 Favored Pre-proline 0 C--N 1.327 -0.375 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -177.491 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 792' ' ' PRO . . . . . 0.43 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 9.7 Cg_endo -55.35 -34.1 87.61 Favored 'Trans proline' 0 C--N 1.354 0.856 0 C-N-CA 121.854 1.703 . . . . 0.0 112.238 176.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -67.86 -44.45 77.06 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 120.96 0.41 . . . . 0.0 110.725 177.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 794' ' ' LEU . . . . . 0.405 ' O ' ' HB ' ' A' ' 798' ' ' ILE . 0.1 OUTLIER -63.36 -39.63 95.06 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.364 178.505 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 795' ' ' LEU . . . . . 0.883 HD11 HG21 ' A' ' 746' ' ' VAL . 0.0 OUTLIER -62.06 -34.68 76.71 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.812 179.646 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -62.85 -53.42 54.4 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.297 179.052 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 797' ' ' ARG . . . . . 0.613 ' HA ' HD13 ' A' ' 800' ' ' LEU . 0.0 OUTLIER -72.04 -21.56 61.52 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.944 0.402 . . . . 0.0 111.2 -179.449 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 798' ' ' ILE . . . . . 0.405 ' HB ' ' O ' ' A' ' 794' ' ' LEU . 0.1 OUTLIER -69.25 -28.42 38.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 121.186 0.517 . . . . 0.0 109.893 175.758 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -80.85 -61.14 2.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.663 173.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 800' ' ' LEU . . . . . 0.613 HD13 ' HA ' ' A' ' 797' ' ' ARG . 2.5 tp . . . . . 0 N--CA 1.468 0.432 0 O-C-N 124.233 0.958 . . . . 0.0 111.819 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 30.7 t0 . . . . . 0 C--O 1.232 0.145 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 9.3 ttt -88.04 111.77 21.9 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.591 178.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 826' ' ' MET . . . . . 0.57 ' HG2' ' O ' ' A' ' 868' ' ' HIS . 0.9 OUTLIER -94.82 122.76 37.77 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.516 0.674 . . . . 0.0 111.367 -172.192 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 827' ' ' ILE . . . . . 0.524 HG23 ' HB ' ' A' ' 871' ' ' ILE . 1.5 mm -115.11 125.39 72.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.529 176.018 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 828' ' ' LEU . . . . . 0.511 HD22 HG22 ' A' ' 830' ' ' VAL . 0.8 OUTLIER -93.42 115.95 28.49 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.625 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 829' ' ' VAL . . . . . 0.686 HG13 HD12 ' A' ' 873' ' ' LEU . 0.0 OUTLIER -103.02 97.51 5.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.93 179.944 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 830' ' ' VAL . . . . . 0.511 HG22 HD22 ' A' ' 828' ' ' LEU . 0.0 OUTLIER -113.54 112.65 41.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.17 -179.476 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 831' ' ' ASP . . . . . 0.688 ' HB2' ' HB3' ' A' ' 875' ' ' ASP . 0.0 OUTLIER -127.22 161.98 27.27 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.942 -175.534 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 832' ' ' ASP . . . . . 0.475 ' CG ' ' H ' ' A' ' 877' ' ' ASN . 1.6 p-10 -96.24 -13.64 23.27 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -175.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 833' ' ' HIS . . . . . 0.431 ' H ' ' CG ' ' A' ' 831' ' ' ASP . 0.0 OUTLIER -122.25 102.49 39.95 Favored Pre-proline 0 C--N 1.322 -0.601 0 O-C-N 122.343 -0.223 . . . . 0.0 110.778 -175.456 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 834' ' ' PRO . . . . . 0.491 ' HB2' ' HB2' ' A' ' 743' ' ' PRO . 92.7 Cg_exo -42.82 -37.31 5.83 Favored 'Trans proline' 0 CA--C 1.533 0.47 0 C-N-CA 124.054 3.169 . . . . 0.0 114.776 -172.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -65.18 -36.54 78.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-O 121.096 0.474 . . . . 0.0 110.904 179.265 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 836' ' ' ASN . . . . . 0.63 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 0.7 OUTLIER -74.86 -40.72 60.83 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 179.039 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 837' ' ' ARG . . . . . 0.61 ' HB2' ' OD1' ' A' ' 831' ' ' ASP . 3.9 ttt-85 -52.36 -41.25 62.92 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.431 177.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 1.3 tmm_? -67.4 -41.76 84.38 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.448 177.004 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 839' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 839' ' ' LEU . 2.7 mt -63.8 -50.82 67.46 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.351 -176.412 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 840' ' ' LEU . . . . . 0.63 ' HG ' ' O ' ' A' ' 836' ' ' ASN . 0.0 OUTLIER -69.15 -32.21 71.41 Favored 'General case' 0 CA--C 1.517 -0.302 0 O-C-N 121.997 -0.439 . . . . 0.0 110.623 -178.621 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 841' ' ' ALA . . . . . 0.822 ' HB2' HG21 ' A' ' 853' ' ' THR . . . -65.08 -45.99 83.0 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 120.957 0.408 . . . . 0.0 110.49 177.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -62.75 -42.43 99.67 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.403 178.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 843' ' ' GLN . . . . . 0.42 ' HG2' HD23 ' A' ' 929' ' ' LEU . 8.6 mt-30 -62.68 -40.97 98.76 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.886 178.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 844' ' ' LEU . . . . . 0.461 ' HA ' HD13 ' A' ' 844' ' ' LEU . 0.0 OUTLIER -65.52 -32.55 74.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.155 0.503 . . . . 0.0 109.762 176.667 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -66.9 -36.56 91.25 Favored Glycine 0 N--CA 1.446 -0.638 0 CA-C-N 115.489 -0.778 . . . . 0.0 112.027 174.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.24 -29.34 70.45 Favored 'General case' 0 N--CA 1.456 -0.138 0 CA-C-O 120.952 0.406 . . . . 0.0 110.494 176.748 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 5.8 mt -74.62 -52.01 12.9 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.214 -0.448 . . . . 0.0 109.938 174.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 103.6 42.82 1.93 Allowed Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.641 176.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 1.7 m-30 -113.32 165.94 11.95 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.74 129.75 38.56 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 176.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.61 147.86 41.68 Favored 'General case' 0 C--N 1.321 -0.665 0 C-N-CA 120.584 -0.446 . . . . 0.0 111.35 -176.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 852' ' ' LYS . . . . . 0.439 ' O ' HD23 ' A' ' 828' ' ' LEU . 0.1 OUTLIER -127.84 109.59 11.77 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 173.54 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 853' ' ' THR . . . . . 0.822 HG21 ' HB2' ' A' ' 841' ' ' ALA . 0.2 OUTLIER -102.42 114.73 29.17 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -173.053 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 854' ' ' ALA . . . . . . . . . . . . . . . -134.24 178.83 6.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.156 179.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 20.1 p-10 -139.52 75.26 1.5 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.804 0.812 . . . . 0.0 111.239 179.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 856' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -172.17 159.13 4.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.577 176.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -94.14 -44.66 3.49 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.421 -0.895 . . . . 0.0 113.098 -177.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 2.0 p -75.22 -34.03 30.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 117.173 0.487 . . . . 0.0 111.947 -173.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.51 -20.34 62.85 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 120.94 -0.304 . . . . 0.0 110.687 179.266 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -63.66 -38.65 91.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.02 0.438 . . . . 0.0 109.971 174.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 861' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' A' ' 861' ' ' LEU . 0.0 OUTLIER -69.13 -38.41 78.83 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.975 176.373 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 14.1 t30 -59.07 -52.88 63.82 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.028 177.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -65.73 -31.59 54.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.855 179.022 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 864' ' ' LEU . . . . . 0.753 HD23 HD12 ' A' ' 869' ' ' ILE . 0.8 OUTLIER -58.42 -34.32 70.65 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.176 0.512 . . . . 0.0 110.763 177.017 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 1.3 m -92.15 -17.06 25.44 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.604 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 1.1 mmmm -101.88 -2.76 29.2 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -174.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -162.04 161.04 28.22 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 -178.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 868' ' ' HIS . . . . . 0.57 ' O ' ' HG2' ' A' ' 826' ' ' MET . 0.0 OUTLIER -78.96 137.8 37.77 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 110.344 -0.243 . . . . 0.0 110.344 -178.306 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 869' ' ' ILE . . . . . 0.753 HD12 HD23 ' A' ' 864' ' ' LEU . 6.7 mt -135.27 142.47 39.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.525 178.572 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -99.6 -62.95 1.17 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.829 177.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 871' ' ' ILE . . . . . 0.524 ' HB ' HG23 ' A' ' 827' ' ' ILE . 18.0 mm -121.61 140.74 44.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.215 178.234 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 872' ' ' VAL . . . . . . . . . . . . . 55.5 t -119.13 122.04 68.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 175.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 873' ' ' LEU . . . . . 0.686 HD12 HG13 ' A' ' 829' ' ' VAL . 0.0 OUTLIER -112.15 122.49 47.89 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 178.982 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -109.83 104.19 13.1 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.05 179.729 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 875' ' ' ASP . . . . . 0.688 ' HB3' ' HB2' ' A' ' 831' ' ' ASP . 37.5 t0 -97.46 112.09 24.08 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.061 -176.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 876' ' ' VAL . . . . . 0.409 ' O ' ' HA ' ' A' ' 903' ' ' THR . 1.1 t -128.38 124.89 62.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.48 0.657 . . . . 0.0 112.223 -172.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 877' ' ' ASN . . . . . 0.475 ' H ' ' CG ' ' A' ' 832' ' ' ASP . 1.3 t30 -98.94 -38.87 8.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.098 -0.955 . . . . 0.0 109.24 171.631 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.323 -0.571 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.642 177.31 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.65 0 CA-C-O 120.12 -0.267 . . . . 0.0 113.173 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 23.2 p90 -126.51 -33.2 2.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 117.289 0.544 . . . . 0.0 111.077 -177.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 885' ' ' ARG . . . . . 0.695 ' O ' ' HB2' ' A' ' 889' ' ' ARG . 0.0 OUTLIER -60.22 -32.67 71.34 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.12 -178.777 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.32 -46.95 75.13 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.675 0.274 . . . . 0.0 110.694 -177.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.22 -37.48 61.08 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.063 0.459 . . . . 0.0 111.236 -176.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 -70.95 -47.24 60.1 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.823 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 889' ' ' ARG . . . . . 0.695 ' HB2' ' O ' ' A' ' 885' ' ' ARG . 0.0 OUTLIER -62.88 -39.12 93.49 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.394 -178.708 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 890' ' ' ILE . . . . . . . . . . . . . 4.3 tt -67.63 -40.38 83.99 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 C-N-CA 120.769 -0.373 . . . . 0.0 111.116 -178.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 891' ' ' ARG . . . . . 0.501 ' HA ' ' CB ' ' A' ' 895' ' ' LEU . 2.5 ptm180 -75.82 -23.87 55.81 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 120.74 0.305 . . . . 0.0 110.807 178.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -74.44 -44.3 52.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.868 -179.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 893' ' ' LEU . . . . . 0.435 HD23 ' HA ' ' A' ' 893' ' ' LEU . 1.2 mt -67.85 -44.52 76.94 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.953 -178.198 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 155.76 67.41 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.399 178.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 895' ' ' LEU . . . . . 0.501 ' CB ' ' HA ' ' A' ' 891' ' ' ARG . 3.6 tp -76.12 111.27 11.35 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.794 0.331 . . . . 0.0 110.556 179.296 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -134.62 25.01 3.73 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.244 0.545 . . . . 0.0 110.339 177.295 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 897' ' ' LEU . . . . . 0.41 ' HA ' ' HD3' ' A' ' 898' ' ' PRO . 0.4 OUTLIER -135.76 150.13 70.91 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.863 -177.857 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 898' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 897' ' ' LEU . 14.4 Cg_exo -69.47 118.4 5.66 Favored 'Trans proline' 0 C--O 1.236 0.396 0 C-N-CA 122.812 2.341 . . . . 0.0 112.742 -178.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 899' ' ' VAL . . . . . 0.803 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 94.6 t -104.15 117.8 50.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 121.087 0.47 . . . . 0.0 109.905 175.567 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 900' ' ' ILE . . . . . 0.684 HG23 ' HB2' ' A' ' 921' ' ' SER . 5.9 mt -90.69 107.58 18.69 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.241 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 901' ' ' GLY . . . . . 0.566 ' O ' ' HA ' ' A' ' 922' ' ' CYS . . . -91.19 113.95 4.4 Favored Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.835 -0.698 . . . . 0.0 111.828 179.38 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 902' ' ' VAL . . . . . 0.673 ' HB ' HD12 ' A' ' 923' ' ' LEU . 0.3 OUTLIER -113.47 130.63 67.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 -179.9 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 903' ' ' THR . . . . . 0.523 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.3 OUTLIER -131.08 160.97 33.11 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.7 -177.422 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 904' ' ' ALA . . . . . 0.727 ' HB2' ' HB2' ' A' ' 925' ' ' LYS . . . -121.58 105.28 10.3 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.68 0.276 . . . . 0.0 111.582 -178.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 8.3 t30 61.14 51.33 4.45 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.559 172.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 906' ' ' ALA . . . . . 0.494 ' HB3' ' HG3' ' A' ' 909' ' ' GLU . . . -90.46 -27.09 19.48 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 175.308 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER 65.57 20.48 11.64 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.883 174.26 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -161.63 30.76 0.13 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.246 -0.888 . . . . 0.0 108.785 178.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 909' ' ' GLU . . . . . 0.494 ' HG3' ' HB3' ' A' ' 906' ' ' ALA . 0.7 OUTLIER -64.31 -34.36 77.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.884 -1.053 . . . . 0.0 111.182 -173.279 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 910' ' ' GLU . . . . . 0.586 ' HG2' ' N ' ' A' ' 911' ' ' LYS . 1.6 pm0 -67.6 -45.0 76.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.978 0.418 . . . . 0.0 110.52 -179.434 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 911' ' ' LYS . . . . . 0.586 ' N ' ' HG2' ' A' ' 910' ' ' GLU . 0.1 OUTLIER -72.29 -31.85 66.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.914 -177.926 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.02 -43.23 79.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.106 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 913' ' ' ARG . . . . . 0.489 ' HG3' ' N ' ' A' ' 914' ' ' CYS . 0.0 OUTLIER -66.64 -35.3 79.84 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 121.144 -0.222 . . . . 0.0 110.747 -179.663 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 914' ' ' CYS . . . . . 0.489 ' N ' ' HG3' ' A' ' 913' ' ' ARG . 91.3 m -72.4 -35.93 68.54 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.868 0.366 . . . . 0.0 110.648 178.343 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 1.1 tp -65.87 -41.42 91.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.102 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -75.2 -40.1 59.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.019 -179.38 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 50.45 45.16 26.7 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.909 177.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -145.09 25.59 1.9 Allowed Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.422 -178.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 919' ' ' MET . . . . . 0.803 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -119.4 -111.46 0.34 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.559 0.179 . . . . 0.0 110.814 -177.832 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 920' ' ' ASP . . . . . 0.512 ' HB2' ' O ' ' A' ' 919' ' ' MET . 13.8 t70 167.0 -53.95 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.971 0.908 . . . . 0.0 109.673 176.653 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . 0.684 ' HB2' HG23 ' A' ' 900' ' ' ILE . 0.0 OUTLIER -118.32 172.13 7.66 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.052 -177.717 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 922' ' ' CYS . . . . . 0.566 ' HA ' ' O ' ' A' ' 901' ' ' GLY . 0.5 OUTLIER -154.18 139.1 17.2 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.019 -179.513 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 923' ' ' LEU . . . . . 0.673 HD12 ' HB ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -156.92 -175.47 5.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.772 175.178 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 924' ' ' SER . . . . . 0.523 ' HA ' ' O ' ' A' ' 903' ' ' THR . 0.5 OUTLIER -105.05 160.27 15.18 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.608 -179.059 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 925' ' ' LYS . . . . . 0.727 ' HB2' ' HB2' ' A' ' 904' ' ' ALA . 2.1 tttp -53.59 -48.36 93.34 Favored Pre-proline 0 CA--C 1.544 0.715 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 926' ' ' PRO . . . . . 0.532 ' HD3' ' HB3' ' A' ' 925' ' ' LYS . 31.8 Cg_exo -60.6 98.5 0.13 Allowed 'Trans proline' 0 C--N 1.357 0.981 0 C-N-CA 122.101 1.867 . . . . 0.0 112.53 175.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 927' ' ' VAL . . . . . 0.59 HG13 ' HB ' ' A' ' 931' ' ' VAL . 19.8 t -134.74 125.7 46.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.825 179.224 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -88.7 173.84 8.36 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.696 -0.229 . . . . 0.0 110.751 177.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 929' ' ' LEU . . . . . 0.42 HD23 ' HG2' ' A' ' 843' ' ' GLN . 0.5 OUTLIER -61.13 -32.67 72.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.621 0.248 . . . . 0.0 110.76 -179.129 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -70.9 -39.03 73.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.883 0.373 . . . . 0.0 110.38 -178.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 931' ' ' VAL . . . . . 0.59 ' HB ' HG13 ' A' ' 927' ' ' VAL . 46.8 t -70.59 -41.24 77.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.306 178.173 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 932' ' ' ILE . . . . . 0.494 HG12 HG11 ' A' ' 927' ' ' VAL . 0.3 OUTLIER -61.77 -41.46 90.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 109.97 -0.382 . . . . 0.0 109.97 177.308 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.87 -48.9 67.37 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.213 -177.776 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 934' ' ' GLN . . . . . 0.531 ' O ' ' HB2' ' A' ' 938' ' ' LEU . 0.0 OUTLIER -64.02 -31.71 73.0 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 121.22 -0.192 . . . . 0.0 111.225 -176.751 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 15.8 m -74.52 -46.41 39.36 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 120.687 0.279 . . . . 0.0 111.008 178.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 936' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' A' ' 936' ' ' LEU . 0.0 OUTLIER -63.5 -43.18 97.99 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.496 -179.943 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 37.6 m -66.61 -41.09 88.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.544 179.057 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 938' ' ' LEU . . . . . 0.531 ' HB2' ' O ' ' A' ' 934' ' ' GLN . 0.3 OUTLIER -59.53 -46.11 89.83 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.333 0.587 . . . . 0.0 110.607 179.251 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -77.76 -25.36 49.06 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.245 -177.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -62.86 -39.72 95.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.903 0.382 . . . . 0.0 110.386 174.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 941' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.26 -34.85 71.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.137 177.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 942' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.06 -47.89 75.72 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.772 179.133 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 35.4 m -71.25 -28.49 32.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.651 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.74 -50.54 71.92 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.827 177.359 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.31 -22.67 51.6 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.789 0.328 . . . . 0.0 111.392 -178.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 49.3 m -73.6 -29.86 62.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.921 0.391 . . . . 0.0 110.724 177.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -95.83 -61.51 1.44 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.675 -178.749 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 1.7 t70 . . . . . 0 C--N 1.325 -0.475 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.785 -178.548 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 705' ' ' SER . . . . . 0.439 ' HA ' ' HA3' ' A' ' 730' ' ' GLY . 0.5 OUTLIER . . . . . 0 N--CA 1.453 -0.304 0 CA-C-O 120.719 0.295 . . . . 0.0 110.665 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 116.1 -25.94 9.07 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.148 177.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 707' ' ' LYS . . . . . 0.516 ' HA ' ' HD2' ' A' ' 707' ' ' LYS . 10.2 mmmt -69.78 132.75 46.56 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 176.51 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 708' ' ' ARG . . . . . 0.511 ' HA ' HG23 ' A' ' 732' ' ' VAL . 24.9 mtt85 -100.61 161.56 13.51 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.478 0.656 . . . . 0.0 111.33 -173.542 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 1.1 m -136.78 113.85 10.59 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.253 -0.885 . . . . 0.0 108.722 173.038 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 710' ' ' TRP . . . . . 0.463 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 87.8 m95 -90.5 112.57 24.28 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.401 0.619 . . . . 0.0 110.153 -173.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 711' ' ' LEU . . . . . 0.482 HD21 ' HB2' ' A' ' 719' ' ' CYS . 0.4 OUTLIER -111.83 119.84 39.93 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.109 -0.95 . . . . 0.0 111.061 -170.194 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -126.66 63.84 1.28 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.825 177.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 713' ' ' VAL . . . . . 0.78 HG13 ' HB3' ' A' ' 750' ' ' ASP . 90.4 t -117.27 121.42 67.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.273 -179.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 13.8 mtt85 -71.81 -34.0 68.98 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.589 -179.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -69.7 108.01 3.71 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.525 178.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 716' ' ' ALA . . . . . 0.6 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -65.15 -32.31 73.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.829 -174.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.11 -44.97 78.58 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.304 0.573 . . . . 0.0 110.344 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 718' ' ' LEU . . . . . 0.41 ' HB3' HG11 ' A' ' 713' ' ' VAL . 0.3 OUTLIER -67.93 -49.04 64.17 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.774 177.854 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 719' ' ' CYS . . . . . 0.6 ' SG ' ' HA ' ' A' ' 716' ' ' ALA . 3.0 p -63.73 -42.46 97.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.999 -175.744 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 720' ' ' GLN . . . . . 0.586 ' HB2' ' O ' ' A' ' 716' ' ' ALA . 0.1 OUTLIER -65.47 -36.73 84.76 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 111.568 0.21 . . . . 0.0 111.568 -179.26 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -55.44 -59.27 5.05 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.925 0.393 . . . . 0.0 110.508 178.641 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 722' ' ' LEU . . . . . 0.524 HD13 HG21 ' A' ' 748' ' ' ILE . 6.9 mt -65.38 -47.26 77.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.28 -178.443 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 723' ' ' GLU . . . . . 0.594 ' HA ' HG21 ' A' ' 733' ' ' VAL . 0.1 OUTLIER -60.11 -48.47 81.57 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.337 -174.411 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 724' ' ' THR . . . . . . . . . . . . . 45.7 m -67.36 -36.4 81.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.186 -177.109 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 42.9 m -68.27 -37.34 80.62 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.787 0.327 . . . . 0.0 111.297 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 726' ' ' LEU . . . . . . . . . . . . . 14.2 mt -76.51 -38.13 55.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.443 -175.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 2.5 pp0? -74.77 0.44 15.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.621 0.248 . . . . 0.0 111.531 -178.048 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 2.2 mtm180 -64.27 -35.18 80.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.824 0.345 . . . . 0.0 110.204 178.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 729' ' ' SER . . . . . 0.49 ' HB2' ' H ' ' A' ' 730' ' ' GLY . 0.0 OUTLIER -93.32 -100.24 0.14 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.26 177.418 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 730' ' ' GLY . . . . . 0.49 ' H ' ' HB2' ' A' ' 729' ' ' SER . . . -143.46 20.97 2.23 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.802 -0.713 . . . . 0.0 111.717 178.721 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 731' ' ' ILE . . . . . . . . . . . . . 20.6 mm -83.32 116.21 27.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.925 0.393 . . . . 0.0 110.226 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 732' ' ' VAL . . . . . 0.511 HG23 ' HA ' ' A' ' 708' ' ' ARG . 0.0 OUTLIER -87.19 97.29 6.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.118 0.485 . . . . 0.0 110.966 -176.64 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 733' ' ' VAL . . . . . 0.594 HG21 ' HA ' ' A' ' 723' ' ' GLU . 6.1 t -77.34 135.85 25.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.556 176.134 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -143.98 135.33 25.77 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.823 0.344 . . . . 0.0 111.219 -173.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.17 112.61 1.59 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.937 176.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 736' ' ' TYR . . . . . 0.463 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 66.7 t80 -90.24 99.33 12.37 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.984 -176.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.23 -51.21 3.29 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 173.167 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -160.41 75.57 0.19 Allowed Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.907 -0.663 . . . . 0.0 111.91 175.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 739' ' ' GLN . . . . . 0.44 ' HG2' ' CZ3' ' A' ' 710' ' ' TRP . 1.2 mp0 -111.93 -161.39 0.75 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.475 0.178 . . . . 0.0 110.74 -178.24 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -104.48 136.54 19.16 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.364 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 741' ' ' PRO . . . . . 0.433 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 64.8 Cg_endo -84.04 123.35 3.12 Favored 'Trans proline' 0 N--CA 1.454 -0.845 0 C-N-CA 122.473 2.115 . . . . 0.0 111.894 176.421 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 742' ' ' THR . . . . . 0.624 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.1 OUTLIER -96.77 140.64 22.24 Favored Pre-proline 0 C--N 1.316 -0.889 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.863 176.886 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 743' ' ' PRO . . . . . 0.624 ' HD2' HG22 ' A' ' 742' ' ' THR . 28.3 Cg_endo -61.87 -13.67 32.19 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 123.171 2.581 . . . . 0.0 113.306 -173.818 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 744' ' ' GLU . . . . . 0.426 ' C ' ' HZ1' ' A' ' 707' ' ' LYS . 0.0 OUTLIER -116.36 5.87 13.6 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.031 178.888 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -102.09 153.78 19.6 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 120.979 0.419 . . . . 0.0 110.458 -177.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 746' ' ' VAL . . . . . 0.882 HG21 HD11 ' A' ' 795' ' ' LEU . 26.9 m -117.49 147.98 20.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 121.323 0.583 . . . . 0.0 111.927 -175.085 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 747' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -106.53 125.5 51.08 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.861 175.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 748' ' ' ILE . . . . . 0.524 HG21 HD13 ' A' ' 722' ' ' LEU . 2.5 mm -113.97 107.11 22.08 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 175.456 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 1.8 t -118.1 153.26 34.07 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.73 -0.214 . . . . 0.0 110.747 -176.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 750' ' ' ASP . . . . . 0.78 ' HB3' HG13 ' A' ' 713' ' ' VAL . 1.6 p-10 -100.9 146.76 26.94 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.587 -0.279 . . . . 0.0 110.475 175.146 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 61.88 -170.88 0.16 Allowed 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.768 178.263 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 752' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 769' ' ' HIS . 9.7 t -82.44 126.65 40.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.161 177.081 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 5.4 m -132.36 157.53 43.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.059 -179.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.57 76.09 10.21 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.911 0.386 . . . . 0.0 110.168 176.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.5 149.58 36.17 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.005 -177.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 11.6 tptt -121.55 -36.13 3.11 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.595 175.076 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 757' ' ' TRP . . . . . 0.433 ' CH2' ' HA ' ' A' ' 741' ' ' PRO . 68.0 t-105 69.27 95.89 0.07 Allowed 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.342 176.661 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -83.96 51.12 1.97 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.255 0.55 . . . . 0.0 110.402 177.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 759' ' ' GLY . . . . . . . . . . . . . . . -121.26 -135.07 4.72 Favored Glycine 0 N--CA 1.444 -0.778 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.667 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 3.3 ttt-85 -81.58 -60.94 2.08 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.94 0.4 . . . . 0.0 111.24 178.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -158.31 148.34 19.93 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.947 -176.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 4.5 p -117.9 127.47 75.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-O 121.41 0.624 . . . . 0.0 110.234 176.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 763' ' ' VAL . . . . . 0.562 HG11 HD21 ' A' ' 791' ' ' LEU . 46.2 t -111.27 122.23 65.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.761 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.722 177.443 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 764' ' ' THR . . . . . . . . . . . . . 3.9 m -107.7 116.54 32.13 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.436 -176.189 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 765' ' ' PHE . . . . . 0.653 ' HE1' HG23 ' A' ' 785' ' ' VAL . 12.3 m-85 -90.24 83.86 6.02 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.609 174.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -96.38 131.34 43.03 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 -177.431 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.25 -30.24 5.66 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.886 0.374 . . . . 0.0 110.787 -175.576 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 13.2 mmm180 -102.09 -59.02 1.77 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.928 -179.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . 0.411 ' O ' HG23 ' A' ' 752' ' ' VAL . 0.6 OUTLIER -116.56 133.35 56.12 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.87 -176.818 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 3.2 mp -117.71 91.27 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 121.203 0.525 . . . . 0.0 109.739 176.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -135.02 11.56 4.47 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.03 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 772' ' ' ILE . . . . . 0.653 HG12 ' HD2' ' A' ' 773' ' ' PRO . 0.1 OUTLIER -96.49 152.56 38.72 Favored Pre-proline 0 C--N 1.324 -0.521 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 -178.536 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 773' ' ' PRO . . . . . 0.653 ' HD2' HG12 ' A' ' 772' ' ' ILE . 84.7 Cg_exo -49.63 118.62 3.89 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 123.105 2.537 . . . . 0.0 113.005 178.521 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . 0.544 ' HB2' HG22 ' A' ' 782' ' ' VAL . 0.6 OUTLIER -98.19 -168.22 1.62 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.534 178.98 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 775' ' ' GLU . . . . . 0.569 ' HG3' ' HA ' ' A' ' 781' ' ' TRP . 1.3 mp0 -63.96 72.99 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 121.793 0.806 . . . . 0.0 112.874 178.339 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -129.62 6.09 5.16 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 114.751 -1.113 . . . . 0.0 108.532 169.199 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 777' ' ' ALA . . . . . 0.477 ' HB1' ' HD2' ' A' ' 778' ' ' PRO . . . -139.96 162.99 47.43 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 114.296 -1.32 . . . . 0.0 108.751 179.338 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 778' ' ' PRO . . . . . 0.477 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 88.0 Cg_endo -80.13 36.11 0.6 Allowed 'Trans proline' 0 CA--C 1.53 0.323 0 C-N-CA 122.414 2.076 . . . . 0.0 113.255 -175.117 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 177.32 31.53 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.246 -0.978 . . . . 0.0 112.72 -179.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 780' ' ' GLU . . . . . 0.49 ' HG2' ' HB2' ' A' ' 773' ' ' PRO . 0.9 OUTLIER -137.68 123.37 19.86 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 179.798 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 781' ' ' TRP . . . . . 0.569 ' HA ' ' HG3' ' A' ' 775' ' ' GLU . 25.2 m95 -137.55 143.86 41.79 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 123.188 0.305 . . . . 0.0 110.243 -177.336 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . 0.544 HG22 ' HB2' ' A' ' 774' ' ' LEU . 35.7 m -126.34 146.96 31.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 120.872 0.367 . . . . 0.0 110.516 171.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 783' ' ' HIS . . . . . 0.462 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 2.1 t-160 -160.64 138.73 9.79 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.828 0.347 . . . . 0.0 110.71 175.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 1.7 m -105.33 100.64 10.22 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.579 174.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 785' ' ' VAL . . . . . 0.653 HG23 ' HE1' ' A' ' 765' ' ' PHE . 0.0 OUTLIER -165.93 -176.76 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 178.323 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -111.66 31.65 6.01 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.867 0.365 . . . . 0.0 110.212 176.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 55.01 67.93 2.89 Favored Pre-proline 0 N--CA 1.467 0.383 0 CA-C-N 115.084 -0.962 . . . . 0.0 112.441 178.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 788' ' ' PRO . . . . . 0.564 ' HD2' ' OE1' ' A' ' 790' ' ' GLU . 16.9 Cg_exo -67.29 -66.21 0.04 OUTLIER 'Trans proline' 0 CA--C 1.529 0.255 0 C-N-CA 122.461 2.108 . . . . 0.0 111.955 179.096 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -170.39 24.32 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.937 0.399 . . . . 0.0 111.403 179.721 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 790' ' ' GLU . . . . . 0.564 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -104.45 -48.38 3.84 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.952 0.406 . . . . 0.0 110.212 -178.983 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 791' ' ' LEU . . . . . 0.562 HD21 HG11 ' A' ' 763' ' ' VAL . 0.4 OUTLIER -67.34 -47.54 48.6 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.622 179.794 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 792' ' ' PRO . . . . . 0.52 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 9.6 Cg_endo -57.98 -27.3 78.63 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 121.698 1.599 . . . . 0.0 111.952 175.192 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -76.19 -44.05 39.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.792 0.329 . . . . 0.0 110.599 177.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -60.54 -42.69 97.02 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 121.166 0.507 . . . . 0.0 110.136 176.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 795' ' ' LEU . . . . . 0.882 HD11 HG21 ' A' ' 746' ' ' VAL . 0.2 OUTLIER -63.87 -39.06 93.32 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.602 179.343 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -61.41 -47.3 86.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.362 175.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 797' ' ' ARG . . . . . 0.419 ' CZ ' ' HB2' ' A' ' 797' ' ' ARG . 0.0 OUTLIER -59.43 -41.92 90.68 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.058 179.375 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -75.56 -17.72 15.75 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.709 -177.361 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 2.3 m-30 -103.6 9.8 37.23 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.677 0.275 . . . . 0.0 110.66 178.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 95.4 mt . . . . . 0 N--CA 1.468 0.468 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.452 179.919 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 22.3 t70 . . . . . 0 CA--C 1.518 -0.264 0 CA-C-O 121.072 0.463 . . . . 0.0 110.357 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 825' ' ' MET . . . . . 0.438 ' HA ' ' OD2' ' A' ' 870' ' ' ASP . 0.0 OUTLIER -105.26 139.73 39.47 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.516 -179.852 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 826' ' ' MET . . . . . 0.68 ' HB2' ' HA ' ' A' ' 869' ' ' ILE . 0.0 OUTLIER -123.31 135.51 54.24 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.904 0.383 . . . . 0.0 110.75 177.574 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 827' ' ' ILE . . . . . 0.885 ' HB ' HD21 ' A' ' 844' ' ' LEU . 2.3 mm -120.02 120.34 62.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 176.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 828' ' ' LEU . . . . . 0.487 ' HB2' HG21 ' A' ' 869' ' ' ILE . 0.9 OUTLIER -105.2 123.48 47.91 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.78 0.324 . . . . 0.0 110.705 -178.759 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 829' ' ' VAL . . . . . 0.603 HG21 HD12 ' A' ' 840' ' ' LEU . 1.0 OUTLIER -102.29 118.81 49.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.092 0.472 . . . . 0.0 110.441 177.332 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 830' ' ' VAL . . . . . 0.485 HG11 ' HB2' ' A' ' 860' ' ' ALA . 0.2 OUTLIER -109.22 86.98 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.75 177.594 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 831' ' ' ASP . . . . . 0.696 ' HA ' ' O ' ' A' ' 875' ' ' ASP . 0.1 OUTLIER -106.7 147.47 29.55 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.873 0.368 . . . . 0.0 110.883 -176.101 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -89.24 -25.64 21.62 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -175.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 833' ' ' HIS . . . . . 0.447 ' HA ' ' HD2' ' A' ' 834' ' ' PRO . 0.6 OUTLIER -114.71 106.21 52.39 Favored Pre-proline 0 N--CA 1.464 0.275 0 O-C-N 121.941 -0.475 . . . . 0.0 111.681 -174.167 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 834' ' ' PRO . . . . . 0.447 ' HD2' ' HA ' ' A' ' 833' ' ' HIS . 1.7 Cg_endo -40.75 -47.07 4.75 Favored 'Trans proline' 0 C--N 1.349 0.555 1 C-N-CA 125.319 4.013 . . . . 0.0 115.604 -169.59 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 1.1 pp -59.32 -38.78 76.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 CA-C-O 121.243 0.544 . . . . 0.0 111.164 -176.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 836' ' ' ASN . . . . . 0.575 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 3.2 m-80 -68.63 -46.46 69.18 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.669 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 837' ' ' ARG . . . . . 0.557 ' HB2' ' OD2' ' A' ' 831' ' ' ASP . 0.0 OUTLIER -52.49 -45.73 66.31 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.495 178.262 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -59.06 -41.81 88.83 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.166 -179.563 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.02 -53.55 25.02 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -176.484 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 840' ' ' LEU . . . . . 0.603 HD12 HG21 ' A' ' 829' ' ' VAL . 0.0 OUTLIER -73.78 -27.95 61.41 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.583 -175.824 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -69.45 -29.9 67.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.963 0.411 . . . . 0.0 110.091 177.076 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -69.49 -41.16 76.49 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.961 175.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 843' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -62.84 -39.15 93.47 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.849 176.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 844' ' ' LEU . . . . . 0.885 HD21 ' HB ' ' A' ' 827' ' ' ILE . 0.0 OUTLIER -63.61 -31.31 72.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.636 174.957 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -69.78 -27.35 73.33 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.154 176.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.06 -45.64 17.94 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.653 0.263 . . . . 0.0 110.683 177.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -152.77 84.5 1.23 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.122 0.487 . . . . 0.0 110.345 176.732 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . -155.03 23.57 0.6 Allowed Glycine 0 N--CA 1.443 -0.835 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.029 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 11.2 m-85 55.52 -128.06 2.12 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.67 108.42 18.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.801 0.334 . . . . 0.0 110.225 176.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -80.97 125.97 30.8 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.597 -177.526 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 852' ' ' LYS . . . . . 0.432 ' HB3' HD12 ' A' ' 828' ' ' LEU . 0.0 OUTLIER -122.42 146.75 47.07 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 174.827 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -131.51 142.81 50.03 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -173.687 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 854' ' ' ALA . . . . . 0.464 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -156.46 165.48 36.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.011 175.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 855' ' ' ASN . . . . . 0.434 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 0.9 OUTLIER -148.76 74.04 1.25 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.887 0.375 . . . . 0.0 111.23 176.598 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 856' ' ' ASP . . . . . 0.478 ' OD1' HG23 ' A' ' 858' ' ' VAL . 7.1 t70 172.73 145.27 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.916 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -66.0 -39.5 94.84 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.034 177.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 858' ' ' VAL . . . . . 0.478 HG23 ' OD1' ' A' ' 856' ' ' ASP . 1.5 t -73.53 -32.28 35.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 O-C-N 122.713 -0.287 . . . . 0.0 110.87 -178.737 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -70.52 -34.02 71.82 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.005 0.431 . . . . 0.0 110.271 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 860' ' ' ALA . . . . . 0.485 ' HB2' HG11 ' A' ' 830' ' ' VAL . . . -64.72 -37.42 87.52 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.192 176.117 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 861' ' ' LEU . . . . . . . . . . . . . 1.4 mt -71.18 -35.31 71.54 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.42 176.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 40.8 t30 -65.8 -49.81 66.93 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.105 -179.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 10.7 p -64.93 -32.26 57.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.361 178.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 864' ' ' LEU . . . . . 0.515 HD21 HD22 ' A' ' 897' ' ' LEU . 0.5 OUTLIER -64.59 -42.75 95.39 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.624 175.642 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 16.5 m -69.08 -22.19 64.02 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.859 -179.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -79.16 -27.77 42.72 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.924 175.419 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 19.4 t30 62.61 94.66 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.133 -0.94 . . . . 0.0 112.644 175.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -171.18 53.08 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.251 170.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 869' ' ' ILE . . . . . 0.68 ' HA ' ' HB2' ' A' ' 826' ' ' MET . 0.1 OUTLIER -152.11 154.66 7.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.525 179.316 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 870' ' ' ASP . . . . . 0.438 ' OD2' ' HA ' ' A' ' 825' ' ' MET . 13.7 m-20 -112.11 -49.46 2.97 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.568 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 871' ' ' ILE . . . . . . . . . . . . . 41.8 mm -118.62 133.86 64.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.023 177.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 872' ' ' VAL . . . . . 0.696 HG23 HD11 ' A' ' 897' ' ' LEU . 13.5 t -116.72 128.48 74.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.954 -0.388 . . . . 0.0 109.954 177.034 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 873' ' ' LEU . . . . . 0.413 HD12 ' HB ' ' A' ' 829' ' ' VAL . 0.2 OUTLIER -109.74 113.24 25.84 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.875 0.369 . . . . 0.0 110.686 179.835 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.81 96.32 9.71 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 175.408 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 875' ' ' ASP . . . . . 0.726 ' CG ' ' HZ3' ' A' ' 925' ' ' LYS . 48.0 t0 -105.83 117.9 35.21 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.005 -173.376 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 2.4 t -141.58 133.31 27.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.114 0.483 . . . . 0.0 111.517 -175.019 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 877' ' ' ASN . . . . . 0.459 ' HB2' ' CE ' ' A' ' 925' ' ' LYS . 40.4 t-20 -127.47 54.77 1.65 Allowed 'General case' 0 C--O 1.234 0.273 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 171.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.322 -0.607 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.915 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.614 0 N-CA-C 110.264 -1.134 . . . . 0.0 110.264 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -177.66 -24.05 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -173.212 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 885' ' ' ARG . . . . . 0.422 ' C ' ' HD2' ' A' ' 885' ' ' ARG . 2.1 tmm_? -55.2 -49.6 71.53 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.989 -178.602 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 886' ' ' LEU . . . . . 0.515 ' HG ' ' N ' ' A' ' 887' ' ' THR . 0.2 OUTLIER -65.51 -34.22 77.75 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.359 -177.652 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 887' ' ' THR . . . . . 0.833 HG21 ' HG2' ' A' ' 919' ' ' MET . 0.0 OUTLIER -75.81 -33.33 60.1 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-O 120.742 0.306 . . . . 0.0 111.502 -178.413 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -57.26 -41.81 80.35 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 173.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.07 -33.53 72.04 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.2 177.344 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 890' ' ' ILE . . . . . 0.578 HG22 ' O ' ' A' ' 887' ' ' THR . 1.5 tp -68.09 -36.97 77.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 N-CA-C 111.798 0.295 . . . . 0.0 111.798 -177.654 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 891' ' ' ARG . . . . . 0.602 ' HA ' HD23 ' A' ' 895' ' ' LEU . 1.9 ptm180 -75.39 -28.58 59.52 Favored 'General case' 0 N--CA 1.46 0.067 0 C-N-CA 120.289 -0.564 . . . . 0.0 110.459 177.605 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -69.99 -34.61 73.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.061 0.458 . . . . 0.0 110.797 175.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 893' ' ' LEU . . . . . 0.488 HD23 ' HA ' ' A' ' 893' ' ' LEU . 2.7 mt -74.64 -45.72 42.91 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.808 179.423 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 122.61 70.23 0.25 Allowed Glycine 0 N--CA 1.448 -0.513 0 N-CA-C 111.386 -0.685 . . . . 0.0 111.386 -178.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 895' ' ' LEU . . . . . 0.602 HD23 ' HA ' ' A' ' 891' ' ' ARG . 0.6 OUTLIER -64.45 117.36 7.19 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.393 0.616 . . . . 0.0 110.843 -176.883 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.57 0.5 24.58 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.26 -178.257 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 897' ' ' LEU . . . . . 0.696 HD11 HG23 ' A' ' 872' ' ' VAL . 1.0 OUTLIER -126.81 154.02 75.98 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.788 -175.595 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -73.09 127.79 12.41 Favored 'Trans proline' 0 C--O 1.239 0.533 0 C-N-CA 123.084 2.522 . . . . 0.0 112.326 179.175 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 899' ' ' VAL . . . . . 0.812 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 3.2 t -108.42 116.07 50.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.365 178.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 900' ' ' ILE . . . . . 0.421 ' CG2' ' HG ' ' A' ' 923' ' ' LEU . 42.0 mt -95.09 106.67 18.48 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.887 178.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -86.94 93.32 1.87 Allowed Glycine 0 N--CA 1.445 -0.762 0 C-N-CA 120.867 -0.682 . . . . 0.0 112.341 -177.705 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 902' ' ' VAL . . . . . 0.617 ' O ' ' HA ' ' A' ' 875' ' ' ASP . 0.2 OUTLIER -91.0 108.76 20.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-O 121.663 0.744 . . . . 0.0 109.603 178.007 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -126.33 152.86 45.66 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.919 -179.014 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -71.23 105.39 3.42 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 168.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -48.31 110.76 0.37 Allowed 'General case' 0 CA--C 1.515 -0.376 0 O-C-N 124.073 0.858 . . . . 0.0 110.96 -171.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -85.52 -56.96 3.26 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.199 -175.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -166.84 -50.04 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 178.054 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -134.48 42.65 2.84 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.012 0.434 . . . . 0.0 111.335 -174.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.03 -31.72 72.44 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.394 -178.483 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 910' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -39.65 94.96 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.163 176.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.47 -36.61 79.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.109 178.293 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -60.39 -47.9 84.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.169 176.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.85 -43.77 90.86 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.147 179.761 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 75.6 m -63.99 -32.5 74.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.807 0.337 . . . . 0.0 110.794 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 2.5 tp -70.59 -51.57 27.42 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.454 -179.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.54 -44.08 45.38 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.708 -175.392 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 51.19 42.48 28.86 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.208 0.528 . . . . 0.0 111.143 -176.226 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -119.59 -25.75 2.55 Favored Glycine 0 N--CA 1.447 -0.629 0 CA-C-N 115.716 -0.674 . . . . 0.0 112.225 -177.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 919' ' ' MET . . . . . 0.833 ' HG2' HG21 ' A' ' 887' ' ' THR . 2.1 mtt -78.41 -102.83 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.774 0.321 . . . . 0.0 110.158 177.12 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 920' ' ' ASP . . . . . 0.498 ' HB2' ' O ' ' A' ' 919' ' ' MET . 19.6 t70 170.3 -65.31 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 123.699 0.8 . . . . 0.0 109.772 175.196 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -113.26 158.32 20.66 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.802 -177.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 922' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -116.72 118.99 34.08 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 175.553 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 923' ' ' LEU . . . . . 0.421 ' HG ' ' CG2' ' A' ' 900' ' ' ILE . 0.3 OUTLIER -116.02 161.23 19.17 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.119 -178.858 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 2.6 m -102.15 137.62 40.17 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.313 178.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 925' ' ' LYS . . . . . 0.726 ' HZ3' ' CG ' ' A' ' 875' ' ' ASP . 0.0 OUTLIER -52.0 -41.46 79.86 Favored Pre-proline 0 CA--C 1.541 0.597 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 177.726 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -67.78 65.94 0.88 Allowed 'Trans proline' 0 C--N 1.357 1.004 0 C-N-CA 121.975 1.783 . . . . 0.0 112.417 171.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 5.3 p -99.19 145.65 9.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.139 179.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 34.0 p -102.91 174.06 6.04 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.586 0.231 . . . . 0.0 110.441 179.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 929' ' ' LEU . . . . . 0.429 HD23 ' HA ' ' A' ' 929' ' ' LEU . 0.0 OUTLIER -60.85 -34.74 75.06 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 175.141 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -74.45 -45.62 45.17 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.209 -177.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 79.0 t -67.4 -38.99 81.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 120.905 0.383 . . . . 0.0 110.735 -179.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 932' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -63.47 -37.59 79.96 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 175.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 20.2 ttmt -63.66 -48.38 77.43 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.579 177.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -55.04 -54.97 36.2 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.346 178.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 1.5 m -62.11 -46.29 89.69 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.725 -176.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 936' ' ' LEU . . . . . 0.4 ' HA ' HD12 ' A' ' 936' ' ' LEU . 0.9 OUTLIER -62.7 -44.51 96.06 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.61 -0.268 . . . . 0.0 110.797 -179.507 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 56.1 m -64.33 -48.24 76.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.307 -179.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 3.1 tp -63.1 -37.38 86.97 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.433 -176.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -79.43 -34.2 41.87 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.779 -0.368 . . . . 0.0 111.034 -179.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 940' ' ' ALA . . . . . 0.454 ' O ' ' HB2' ' A' ' 944' ' ' ARG . . . -66.43 -38.85 88.35 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.841 178.085 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 941' ' ' GLU . . . . . 0.532 ' HG3' ' N ' ' A' ' 942' ' ' ARG . 0.0 OUTLIER -70.3 -33.82 72.0 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 177.001 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 942' ' ' ARG . . . . . 0.532 ' N ' ' HG3' ' A' ' 941' ' ' GLU . 1.6 tpm_? -64.84 -48.17 75.31 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.85 179.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 31.4 m -69.2 -29.57 43.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 178.118 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 944' ' ' ARG . . . . . 0.454 ' HB2' ' O ' ' A' ' 940' ' ' ALA . 0.0 OUTLIER -64.58 -35.13 79.98 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.78 176.814 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 945' ' ' LYS . . . . . 0.402 ' HG2' ' O ' ' A' ' 941' ' ' GLU . 1.1 mmtp -65.08 -42.34 94.22 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.296 0.57 . . . . 0.0 110.362 176.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 5.0 m -72.18 -17.68 61.92 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.297 179.069 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.4 -61.15 1.76 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.863 0.364 . . . . 0.0 110.972 -179.497 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 . . . . . 0 C--N 1.326 -0.444 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.055 -177.469 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.421 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 122.85 -11.23 8.84 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.482 -179.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 4.1 mmtt -74.41 147.0 42.46 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 178.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 708' ' ' ARG . . . . . 0.471 ' HA ' HG23 ' A' ' 732' ' ' VAL . 2.7 mtm180 -102.81 156.47 17.63 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.078 0.466 . . . . 0.0 111.754 -172.128 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 709' ' ' CYS . . . . . 0.431 ' SG ' ' HE2' ' A' ' 799' ' ' TYR . 1.0 OUTLIER -142.37 115.04 8.58 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.973 174.794 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 710' ' ' TRP . . . . . 0.491 ' CZ3' ' HB ' ' A' ' 734' ' ' THR . 91.1 m95 -91.41 118.12 30.27 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 -178.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 711' ' ' LEU . . . . . 0.573 HD22 HG12 ' A' ' 733' ' ' VAL . 1.9 pt? -118.72 127.61 53.72 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.496 0.665 . . . . 0.0 111.605 -177.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -127.05 58.73 1.43 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.541 175.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 713' ' ' VAL . . . . . 0.801 HG13 ' HB2' ' A' ' 750' ' ' ASP . 21.2 t -96.93 121.42 47.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.628 -179.547 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 714' ' ' ARG . . . . . 0.603 ' H ' ' HB3' ' A' ' 750' ' ' ASP . 38.0 mtp85 -66.96 -46.86 73.39 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.193 -175.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 715' ' ' ASN . . . . . 0.487 ' O ' ' HB2' ' A' ' 719' ' ' CYS . 7.6 p30 -78.96 133.39 36.88 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.236 179.131 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -77.69 -17.39 57.7 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.529 -175.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.43 -56.58 19.64 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.098 0.475 . . . . 0.0 110.182 178.382 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 718' ' ' LEU . . . . . 0.557 ' HB3' HG11 ' A' ' 713' ' ' VAL . 0.6 OUTLIER -72.58 -39.47 67.37 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.552 178.579 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 719' ' ' CYS . . . . . 0.734 ' SG ' ' HB ' ' A' ' 713' ' ' VAL . 0.1 OUTLIER -55.48 -52.64 62.97 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.12 -178.905 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 720' ' ' GLN . . . . . 0.525 ' O ' ' HG2' ' A' ' 723' ' ' GLU . 0.6 OUTLIER -67.85 -42.85 80.75 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.392 -177.705 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 721' ' ' PHE . . . . . 0.462 ' HE2' ' HG3' ' A' ' 792' ' ' PRO . 57.2 t80 -58.18 -54.76 43.31 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.734 0.302 . . . . 0.0 110.738 -179.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 722' ' ' LEU . . . . . 0.443 HD21 HD12 ' A' ' 791' ' ' LEU . 0.7 OUTLIER -60.09 -44.36 94.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.892 -177.72 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 723' ' ' GLU . . . . . 0.525 ' HG2' ' O ' ' A' ' 720' ' ' GLN . 6.3 pt-20 -62.64 -36.3 82.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.881 -178.233 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 724' ' ' THR . . . . . . . . . . . . . 87.8 m -65.12 -44.56 88.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.178 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.98 -37.66 85.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.987 0.422 . . . . 0.0 111.173 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 726' ' ' LEU . . . . . 0.5 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 23.7 mt -74.49 -48.09 29.34 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.988 -177.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.71 -5.74 44.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.733 -177.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.13 -27.65 59.87 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 175.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 729' ' ' SER . . . . . 0.445 ' HB2' ' H ' ' A' ' 730' ' ' GLY . 0.3 OUTLIER -90.03 -104.15 0.09 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.897 175.796 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 730' ' ' GLY . . . . . 0.445 ' H ' ' HB2' ' A' ' 729' ' ' SER . . . -148.26 31.24 1.3 Allowed Glycine 0 N--CA 1.446 -0.691 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 175.216 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 731' ' ' ILE . . . . . 0.5 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 15.3 mm -95.77 126.0 48.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.736 0.303 . . . . 0.0 110.369 -177.307 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 732' ' ' VAL . . . . . 0.471 HG23 ' HA ' ' A' ' 708' ' ' ARG . 0.0 OUTLIER -85.86 98.53 6.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 121.275 0.559 . . . . 0.0 110.553 179.629 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 733' ' ' VAL . . . . . 0.573 HG12 HD22 ' A' ' 711' ' ' LEU . 0.1 OUTLIER -71.59 113.33 8.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.159 177.867 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 734' ' ' THR . . . . . 0.491 ' HB ' ' CZ3' ' A' ' 710' ' ' TRP . 0.2 OUTLIER -118.46 127.03 53.26 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.19 0.519 . . . . 0.0 110.824 -178.408 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -55.66 124.61 17.97 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.972 174.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 736' ' ' TYR . . . . . 0.663 ' HE2' ' HD3' ' A' ' 755' ' ' LYS . 9.4 t80 -81.19 70.07 7.95 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.622 0.725 . . . . 0.0 109.846 177.063 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 737' ' ' GLU . . . . . 0.482 ' H ' ' HG3' ' A' ' 737' ' ' GLU . 3.5 mt-10 -75.51 -25.04 56.91 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.788 -177.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 154.3 60.9 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.344 0 N-CA-C 111.431 -0.668 . . . . 0.0 111.431 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 26.7 mp0 -112.55 -178.84 3.5 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.77 0.319 . . . . 0.0 110.89 -175.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 740' ' ' GLU . . . . . 0.432 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 0.0 OUTLIER -81.6 143.99 51.96 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.941 -177.497 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 741' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 740' ' ' GLU . 1.3 Cg_endo -82.32 123.17 3.84 Favored 'Trans proline' 0 N--CA 1.452 -0.925 0 C-N-CA 122.644 2.229 . . . . 0.0 111.701 175.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 742' ' ' THR . . . . . 0.419 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.1 OUTLIER -110.73 136.18 20.71 Favored Pre-proline 0 C--N 1.32 -0.703 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.755 178.966 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 743' ' ' PRO . . . . . 0.419 ' HD2' HG22 ' A' ' 742' ' ' THR . 37.8 Cg_endo -66.5 -1.91 6.46 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 123.053 2.502 . . . . 0.0 112.883 -179.279 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.27 -9.63 18.44 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.498 178.279 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -109.27 152.18 25.56 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.415 -0.812 . . . . 0.0 111.204 -170.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 16.2 m -116.68 147.85 19.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.429 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 747' ' ' LEU . . . . . 0.665 HD22 HG23 ' A' ' 749' ' ' THR . 0.4 OUTLIER -108.14 135.22 49.85 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.001 177.813 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 1.7 mt -117.77 118.09 57.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 173.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 749' ' ' THR . . . . . 0.665 HG23 HD22 ' A' ' 747' ' ' LEU . 2.5 p -125.18 150.19 47.19 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -167.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 750' ' ' ASP . . . . . 0.801 ' HB2' HG13 ' A' ' 713' ' ' VAL . 34.8 t0 -113.54 116.59 29.78 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.773 175.005 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 751' ' ' GLU . . . . . 0.678 ' HG3' ' H ' ' A' ' 752' ' ' VAL . 1.8 tp10 68.17 -177.85 0.21 Allowed 'General case' 0 CA--C 1.536 0.432 0 O-C-N 123.868 0.73 . . . . 0.0 111.063 -177.173 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 752' ' ' VAL . . . . . 0.678 ' H ' ' HG3' ' A' ' 751' ' ' GLU . 15.2 t -75.19 100.2 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.298 -176.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 753' ' ' VAL . . . . . 0.422 HG21 HG21 ' A' ' 749' ' ' THR . 19.5 m -90.33 -0.29 8.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.483 176.38 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 58.31 41.35 23.38 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.351 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 755' ' ' LYS . . . . . 0.663 ' HD3' ' HE2' ' A' ' 736' ' ' TYR . 0.1 OUTLIER -120.03 126.97 52.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.318 180.0 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 2.1 tmtm? -81.43 -42.27 20.63 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.06 -179.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 76.0 t-105 62.46 90.44 0.07 Allowed 'General case' 0 CA--C 1.53 0.21 0 O-C-N 123.71 0.631 . . . . 0.0 111.657 179.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -83.23 58.82 4.66 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.148 0.499 . . . . 0.0 109.822 175.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 759' ' ' GLY . . . . . . . . . . . . . . . -117.62 -144.28 7.68 Favored Glycine 0 N--CA 1.444 -0.791 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.901 -178.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 760' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 760' ' ' ARG . 0.7 OUTLIER -75.81 -53.27 8.74 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.96 0.41 . . . . 0.0 110.242 179.217 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -161.49 156.56 23.7 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.386 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 762' ' ' VAL . . . . . 0.597 HG23 ' HB3' ' A' ' 747' ' ' LEU . 3.0 p -140.75 126.87 20.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-O 121.126 0.489 . . . . 0.0 109.852 179.004 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 18.6 t -111.65 105.29 18.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.05 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 764' ' ' THR . . . . . 0.482 ' HA ' ' OG1' ' A' ' 749' ' ' THR . 33.4 m -97.66 119.68 36.66 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.219 0.533 . . . . 0.0 110.607 178.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 765' ' ' PHE . . . . . 0.757 ' HZ ' ' HG ' ' A' ' 791' ' ' LEU . 33.0 m-85 -76.98 123.88 26.97 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.633 175.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 766' ' ' CYS . . . . . 0.494 ' SG ' ' HB ' ' A' ' 782' ' ' VAL . 0.0 OUTLIER -95.58 131.64 41.57 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 176.925 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.72 -69.34 0.74 Allowed 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.902 0.382 . . . . 0.0 110.672 -177.034 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 768' ' ' ARG . . . . . 0.439 ' HA ' ' HD2' ' A' ' 768' ' ' ARG . 0.0 OUTLIER -118.69 -30.09 5.21 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.261 -177.988 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -114.77 134.06 55.41 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.312 0.577 . . . . 0.0 110.965 -178.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 2.7 mp -97.51 156.28 3.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 173.131 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . 175.45 -43.37 0.12 Allowed Glycine 0 CA--C 1.505 -0.571 0 N-CA-C 110.612 -0.995 . . . . 0.0 110.612 -177.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 772' ' ' ILE . . . . . 0.456 ' HA ' ' HD3' ' A' ' 773' ' ' PRO . 17.5 mm -87.03 123.4 70.3 Favored Pre-proline 0 C--N 1.321 -0.643 0 N-CA-C 108.374 -0.972 . . . . 0.0 108.374 169.358 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 773' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' A' ' 772' ' ' ILE . 23.7 Cg_exo -62.63 -85.62 0.01 OUTLIER 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.982 2.455 . . . . 0.0 112.673 -175.371 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . 0.603 ' O ' ' HB3' ' A' ' 780' ' ' GLU . 0.9 OUTLIER 171.53 -155.41 0.01 OUTLIER 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 -179.901 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 775' ' ' GLU . . . . . 0.575 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 2.6 mp0 -60.3 75.13 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 122.082 0.944 . . . . 0.0 112.269 174.242 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 12.5 mmmt -119.19 -45.71 2.54 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 114.17 -1.377 . . . . 0.0 109.008 171.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 777' ' ' ALA . . . . . 0.689 ' HB1' ' HD2' ' A' ' 778' ' ' PRO . . . -91.57 165.88 19.66 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 115.333 -0.848 . . . . 0.0 110.233 179.771 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 778' ' ' PRO . . . . . 0.689 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 24.0 Cg_endo -60.91 91.81 0.1 OUTLIER 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.829 2.352 . . . . 0.0 113.18 -178.325 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 99.05 15.06 34.37 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.797 176.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 780' ' ' GLU . . . . . 0.603 ' HB3' ' O ' ' A' ' 774' ' ' LEU . 2.2 tt0 -84.23 122.01 28.29 Favored 'General case' 0 C--O 1.218 -0.589 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 -179.138 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 17.6 m95 -133.49 143.54 48.85 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.626 0.25 . . . . 0.0 110.344 178.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . 0.578 HG13 ' HA ' ' A' ' 774' ' ' LEU . 17.1 m -134.66 156.57 40.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 172.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 783' ' ' HIS . . . . . 0.466 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.1 OUTLIER -176.22 144.34 0.56 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.725 0.298 . . . . 0.0 110.896 178.228 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 4.9 m -105.74 102.77 12.19 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.354 175.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 785' ' ' VAL . . . . . 0.517 HG23 ' HE2' ' A' ' 765' ' ' PHE . 0.1 OUTLIER -150.57 155.28 7.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.67 0.271 . . . . 0.0 110.543 178.191 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -86.73 7.41 26.86 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.428 174.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 787' ' ' ALA . . . . . 0.469 ' H ' ' HB ' ' A' ' 785' ' ' VAL . . . 57.8 63.6 4.51 Favored Pre-proline 0 N--CA 1.464 0.251 0 CA-C-N 115.22 -0.9 . . . . 0.0 112.2 179.109 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 788' ' ' PRO . . . . . 0.42 ' HD3' ' N ' ' A' ' 787' ' ' ALA . 21.2 Cg_exo -66.58 -54.84 0.41 Allowed 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.135 1.89 . . . . 0.0 111.725 176.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 7.3 p-80 -161.05 -22.12 0.05 Allowed 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 176.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 790' ' ' GLU . . . . . 0.428 ' CD ' ' H ' ' A' ' 790' ' ' GLU . 2.0 pm0 -72.83 -38.6 67.08 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -175.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 791' ' ' LEU . . . . . 0.757 ' HG ' ' HZ ' ' A' ' 765' ' ' PHE . 1.2 tm? -62.21 -54.62 47.96 Favored Pre-proline 0 CA--C 1.536 0.438 0 N-CA-C 111.65 0.241 . . . . 0.0 111.65 -178.067 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 792' ' ' PRO . . . . . 0.462 ' HG3' ' HE2' ' A' ' 721' ' ' PHE . 11.2 Cg_endo -58.37 -26.6 78.17 Favored 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 121.523 1.482 . . . . 0.0 112.201 176.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -71.79 -40.56 69.15 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.789 176.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 794' ' ' LEU . . . . . 0.435 HD22 ' HD2' ' A' ' 797' ' ' ARG . 1.9 tm? -59.62 -47.17 86.66 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.107 0.48 . . . . 0.0 109.784 176.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 795' ' ' LEU . . . . . 0.496 ' HA ' ' HB ' ' A' ' 798' ' ' ILE . 0.2 OUTLIER -70.89 -29.7 65.85 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.13 -178.755 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -62.67 -46.51 87.84 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 174.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 797' ' ' ARG . . . . . 0.435 ' HD2' HD22 ' A' ' 794' ' ' LEU . 0.1 OUTLIER -64.3 -33.51 76.0 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.06 177.054 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 798' ' ' ILE . . . . . 0.496 ' HB ' ' HA ' ' A' ' 795' ' ' LEU . 0.3 OUTLIER -62.01 -32.28 53.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.879 178.771 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 799' ' ' TYR . . . . . 0.435 ' HD1' ' HA ' ' A' ' 799' ' ' TYR . 0.6 OUTLIER -103.91 15.54 28.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.155 179.6 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 9.7 mt . . . . . 0 C--O 1.233 0.192 0 CA-C-N 115.878 -0.601 . . . . 0.0 112.127 176.34 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 824' ' ' ASP . . . . . 0.436 ' HB3' ' H ' ' A' ' 825' ' ' MET . 0.9 OUTLIER . . . . . 0 N--CA 1.445 -0.686 0 CA-C-O 121.14 0.495 . . . . 0.0 111.13 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 825' ' ' MET . . . . . 0.436 ' H ' ' HB3' ' A' ' 824' ' ' ASP . 2.7 ttm -151.53 140.86 21.44 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.004 -175.336 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 826' ' ' MET . . . . . 0.736 ' HG3' ' HA ' ' A' ' 869' ' ' ILE . 1.6 ptp -135.05 123.34 23.09 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.155 0.502 . . . . 0.0 110.841 178.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 827' ' ' ILE . . . . . 0.534 HG23 ' HB ' ' A' ' 871' ' ' ILE . 5.5 mm -108.25 140.72 25.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.816 -179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 828' ' ' LEU . . . . . 0.422 HD23 HG22 ' A' ' 872' ' ' VAL . 16.2 tp -106.55 118.33 36.39 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.139 0.495 . . . . 0.0 110.615 -178.179 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 829' ' ' VAL . . . . . 0.673 HG12 HD11 ' A' ' 873' ' ' LEU . 0.0 OUTLIER -106.27 109.88 29.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.257 -179.803 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 830' ' ' VAL . . . . . 0.487 HG22 ' HB3' ' A' ' 854' ' ' ALA . 13.4 t -109.54 100.39 10.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.232 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 831' ' ' ASP . . . . . 0.497 ' HA ' ' O ' ' A' ' 875' ' ' ASP . 7.2 t0 -112.34 149.2 32.79 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 -177.75 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -91.02 -22.13 20.93 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.841 179.76 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 833' ' ' HIS . . . . . 0.417 ' HA ' ' HD2' ' A' ' 834' ' ' PRO . 1.7 m80 -111.93 113.68 52.19 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.553 -176.053 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 834' ' ' PRO . . . . . 0.417 ' HD2' ' HA ' ' A' ' 833' ' ' HIS . 5.4 Cg_endo -48.22 -46.46 22.65 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 124.106 3.204 . . . . 0.0 114.173 -174.385 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -56.35 -46.6 81.86 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 120.961 0.41 . . . . 0.0 111.395 -178.868 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 836' ' ' ASN . . . . . 0.615 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 3.0 m120 -75.75 -35.13 60.28 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 -178.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 837' ' ' ARG . . . . . 0.464 HH11 ' HB ' ' A' ' 853' ' ' THR . 0.8 OUTLIER -53.09 -46.26 68.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.44 176.996 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 1.7 tmm_? -65.66 -39.95 91.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.448 177.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.71 -53.57 55.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.112 -176.655 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 840' ' ' LEU . . . . . 0.615 ' HG ' ' O ' ' A' ' 836' ' ' ASN . 0.0 OUTLIER -73.64 -33.31 64.46 Favored 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 120.603 -0.439 . . . . 0.0 111.144 -177.281 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -63.75 -45.43 89.89 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.967 0.413 . . . . 0.0 110.866 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -65.99 -38.99 89.91 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.52 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 843' ' ' GLN . . . . . 0.443 ' HG3' ' CD2' ' A' ' 929' ' ' LEU . 0.0 OUTLIER -70.67 -32.41 69.66 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.985 -178.514 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 844' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.2 -37.12 81.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.037 0.446 . . . . 0.0 109.842 173.631 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -64.57 -37.33 94.28 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.303 176.041 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -67.07 -26.69 66.86 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.953 0.406 . . . . 0.0 111.044 178.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.25 -13.17 61.09 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.572 177.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 84.68 30.04 27.86 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.877 -0.677 . . . . 0.0 112.849 176.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -124.61 144.45 50.16 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 20.6 mm-40 -65.92 134.75 53.65 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.903 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.06 133.63 55.73 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.131 -172.744 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.05 126.17 51.76 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 174.17 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 853' ' ' THR . . . . . 0.464 ' HB ' HH11 ' A' ' 837' ' ' ARG . 0.0 OUTLIER -106.66 138.62 42.5 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.926 0.393 . . . . 0.0 111.747 -174.593 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 854' ' ' ALA . . . . . 0.487 ' HB3' HG22 ' A' ' 830' ' ' VAL . . . -140.4 145.22 36.79 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.277 175.558 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 855' ' ' ASN . . . . . 0.467 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 0.6 OUTLIER -121.89 72.63 1.04 Allowed 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 176.146 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 856' ' ' ASP . . . . . 0.517 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 35.0 t70 164.25 141.06 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.007 0.923 . . . . 0.0 109.544 178.195 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 857' ' ' GLY . . . . . 0.514 ' HA3' ' HB2' ' A' ' 886' ' ' LEU . . . -67.18 -49.61 51.72 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.972 -0.632 . . . . 0.0 113.228 -177.516 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -73.73 -31.31 31.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.135 0.493 . . . . 0.0 110.728 -177.021 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 859' ' ' ASP . . . . . 0.517 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 18.9 t0 -58.91 -31.16 68.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.824 177.425 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 860' ' ' ALA . . . . . 0.408 ' O ' HG12 ' A' ' 863' ' ' VAL . . . -62.85 -33.79 75.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.79 177.329 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 861' ' ' LEU . . . . . 0.677 HD21 ' HA ' ' A' ' 890' ' ' ILE . 0.3 OUTLIER -69.01 -40.77 78.5 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.022 0.439 . . . . 0.0 110.261 178.794 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -59.35 -49.67 76.91 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.634 177.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 863' ' ' VAL . . . . . 0.408 HG12 ' O ' ' A' ' 860' ' ' ALA . 0.8 OUTLIER -66.42 -31.66 54.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.778 179.789 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 864' ' ' LEU . . . . . 0.476 HD22 ' HA ' ' A' ' 864' ' ' LEU . 0.6 OUTLIER -63.38 -41.93 98.81 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.012 0.434 . . . . 0.0 110.52 177.13 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 3.5 m -76.02 -22.68 55.51 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.578 -176.453 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.46 -44.61 9.51 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.388 -178.595 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -96.11 -133.03 0.2 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.405 -177.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 3.5 m170 -136.69 -76.9 0.42 Allowed 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 178.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 869' ' ' ILE . . . . . 0.736 ' HA ' ' HG3' ' A' ' 826' ' ' MET . 3.0 mt 69.35 134.6 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 O-C-N 123.792 0.682 . . . . 0.0 111.405 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -98.28 -47.95 5.25 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.485 -178.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 871' ' ' ILE . . . . . 0.611 HD12 ' HD2' ' A' ' 939' ' ' TYR . 36.3 mm -121.62 131.51 72.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.298 -179.607 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 872' ' ' VAL . . . . . 0.752 HG23 HD11 ' A' ' 897' ' ' LEU . 17.0 t -111.82 135.38 51.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 110.125 -0.324 . . . . 0.0 110.125 177.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 873' ' ' LEU . . . . . 0.673 HD11 HG12 ' A' ' 829' ' ' VAL . 1.2 pp -139.99 141.72 36.35 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.937 0.399 . . . . 0.0 110.382 174.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -119.72 102.06 8.34 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.639 -179.024 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 875' ' ' ASP . . . . . 0.595 ' OD1' ' HG2' ' A' ' 925' ' ' LYS . 0.4 OUTLIER -89.1 106.28 18.33 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.896 -179.583 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -119.16 125.7 74.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-O 121.165 0.507 . . . . 0.0 111.654 -173.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 877' ' ' ASN . . . . . 0.425 ' CB ' ' HD2' ' A' ' 925' ' ' LYS . 0.1 OUTLIER -96.47 -35.61 11.08 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 172.418 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.319 -0.749 0 CA-C-N 114.882 -1.054 . . . . 0.0 108.741 172.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.275 0 N-CA-C 112.859 -0.096 . . . . 0.0 112.859 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -131.15 -28.07 1.96 Allowed 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 177.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.51 -39.82 67.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.704 -178.538 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 886' ' ' LEU . . . . . 0.604 ' HG ' ' N ' ' A' ' 887' ' ' THR . 0.0 OUTLIER -70.8 -44.19 67.11 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 121.123 -0.231 . . . . 0.0 110.949 -176.852 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 887' ' ' THR . . . . . 0.604 ' N ' ' HG ' ' A' ' 886' ' ' LEU . 0.0 OUTLIER -67.14 -41.78 85.49 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.972 0.415 . . . . 0.0 110.46 -178.964 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 888' ' ' GLN . . . . . 0.47 ' O ' ' HB2' ' A' ' 892' ' ' GLN . 8.6 tp60 -58.18 -41.01 82.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.15 176.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 11.0 mmt-85 -70.99 -35.03 71.93 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.941 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 890' ' ' ILE . . . . . 0.677 ' HA ' HD21 ' A' ' 861' ' ' LEU . 0.0 OUTLIER -66.75 -41.5 88.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 C-N-CA 121.175 -0.21 . . . . 0.0 110.914 -179.018 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 891' ' ' ARG . . . . . 0.492 ' HD2' ' HA3' ' A' ' 918' ' ' GLY . 0.0 OUTLIER -75.32 -24.11 57.37 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 120.711 -0.396 . . . . 0.0 110.502 175.843 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 892' ' ' GLN . . . . . 0.47 ' HB2' ' O ' ' A' ' 888' ' ' GLN . 0.0 OUTLIER -65.45 -38.87 91.12 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.796 178.274 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -83.81 -11.47 57.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.664 -179.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 87.04 85.92 1.11 Allowed Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.798 -0.715 . . . . 0.0 111.778 -178.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 895' ' ' LEU . . . . . 0.595 ' HG ' ' O ' ' A' ' 895' ' ' LEU . 0.5 OUTLIER -71.83 111.59 7.22 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.46 0.648 . . . . 0.0 110.827 -177.388 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -88.15 -12.61 43.5 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.011 179.74 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 897' ' ' LEU . . . . . 0.752 HD11 HG23 ' A' ' 872' ' ' VAL . 1.8 pt? -124.34 147.83 56.25 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.121 -177.634 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 898' ' ' PRO . . . . . 0.78 ' HB2' ' HE2' ' A' ' 939' ' ' TYR . 57.2 Cg_endo -71.28 141.19 38.65 Favored 'Trans proline' 0 C--O 1.242 0.701 0 C-N-CA 122.648 2.232 . . . . 0.0 112.748 -178.105 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 899' ' ' VAL . . . . . 0.877 HG13 ' HA ' ' A' ' 919' ' ' MET . 0.2 OUTLIER -127.28 144.74 36.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.409 0.623 . . . . 0.0 110.548 179.783 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 900' ' ' ILE . . . . . . . . . . . . . 2.5 mt -108.61 119.05 57.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.155 177.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -94.74 98.78 2.34 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.858 -0.686 . . . . 0.0 111.542 179.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 902' ' ' VAL . . . . . 0.843 ' HB ' HD12 ' A' ' 923' ' ' LEU . 0.1 OUTLIER -99.56 101.46 12.12 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 CA-C-O 121.717 0.77 . . . . 0.0 109.203 178.769 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 903' ' ' THR . . . . . 0.493 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.1 OUTLIER -105.12 173.73 6.18 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.812 -174.269 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -79.76 103.84 9.94 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.807 -0.357 . . . . 0.0 110.713 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 45.7 t30 18.82 91.78 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.76 0 O-C-N 125.219 1.574 . . . . 0.0 114.787 177.031 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -95.29 8.46 43.05 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.246 -0.434 . . . . 0.0 109.884 172.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 3.1 tp 69.25 -67.89 0.21 Allowed 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.596 -176.447 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -99.22 67.89 1.61 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.128 0.49 . . . . 0.0 109.814 176.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.42 -27.88 67.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.676 -178.44 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 910' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.84 -40.87 94.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.638 176.359 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 3.9 tttt -70.53 -32.83 70.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.269 -179.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.5 -44.29 94.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.715 174.641 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 913' ' ' ARG . . . . . 0.839 ' HA ' ' HE1' ' A' ' 919' ' ' MET . 1.0 OUTLIER -59.93 -42.54 94.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.905 177.211 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 66.6 m -68.38 -34.73 76.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.282 -179.03 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.47 -44.69 74.27 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.817 -178.78 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 916' ' ' GLU . . . . . 0.573 ' OE1' ' HB ' ' A' ' 887' ' ' THR . 0.3 OUTLIER -77.14 -50.93 11.9 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.505 -177.701 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 2.1 m 50.24 47.88 23.04 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.568 -174.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 918' ' ' GLY . . . . . 0.492 ' HA3' ' HD2' ' A' ' 891' ' ' ARG . . . -132.67 7.37 5.24 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.166 -1.016 . . . . 0.0 112.965 -179.165 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 919' ' ' MET . . . . . 0.877 ' HA ' HG13 ' A' ' 899' ' ' VAL . 0.0 OUTLIER -121.89 -89.32 0.6 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.734 0.302 . . . . 0.0 110.296 -178.143 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 920' ' ' ASP . . . . . 0.527 ' HB2' ' O ' ' A' ' 919' ' ' MET . 25.5 t70 165.74 -54.79 0.0 OUTLIER 'General case' 0 CA--C 1.516 -0.347 0 O-C-N 124.404 1.065 . . . . 0.0 108.562 176.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . 0.519 ' HA ' ' NH1' ' A' ' 913' ' ' ARG . 20.7 m -129.68 166.61 19.45 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.348 177.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 922' ' ' CYS . . . . . 0.405 ' HB2' ' HB2' ' A' ' 913' ' ' ARG . 0.8 OUTLIER -144.74 147.63 33.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.829 -178.898 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 923' ' ' LEU . . . . . 0.843 HD12 ' HB ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -150.2 -176.82 5.61 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 175.176 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 924' ' ' SER . . . . . 0.493 ' HA ' ' O ' ' A' ' 903' ' ' THR . 1.5 m -108.67 147.49 31.83 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 121.255 -0.178 . . . . 0.0 110.553 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 925' ' ' LYS . . . . . 0.595 ' HG2' ' OD1' ' A' ' 875' ' ' ASP . 0.0 OUTLIER -51.56 -40.79 72.67 Favored Pre-proline 0 CA--C 1.54 0.558 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 -175.577 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 926' ' ' PRO . . . . . 0.554 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 10.9 Cg_endo -57.18 84.86 0.04 OUTLIER 'Trans proline' 0 C--N 1.358 1.035 0 C-N-CA 121.915 1.744 . . . . 0.0 112.1 171.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 927' ' ' VAL . . . . . 0.621 HG13 ' HB ' ' A' ' 931' ' ' VAL . 2.3 t -122.55 129.2 75.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.341 -177.09 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.86 172.12 10.32 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.97 178.379 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 929' ' ' LEU . . . . . 0.443 ' CD2' ' HG3' ' A' ' 843' ' ' GLN . 1.0 OUTLIER -60.93 -41.9 97.11 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.416 -175.837 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.67 -29.07 68.26 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.989 0.424 . . . . 0.0 110.584 -179.105 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 931' ' ' VAL . . . . . 0.621 ' HB ' HG13 ' A' ' 927' ' ' VAL . 60.2 t -70.55 -51.11 40.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.956 -178.507 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 932' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -63.45 -37.52 79.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-O 120.842 0.353 . . . . 0.0 110.107 179.075 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.36 -45.76 92.35 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.32 175.78 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 934' ' ' GLN . . . . . 0.514 ' O ' ' HB2' ' A' ' 938' ' ' LEU . 47.5 mt-30 -67.54 -32.88 73.97 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.086 -178.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 8.6 m -64.67 -48.03 76.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.801 0.334 . . . . 0.0 110.438 178.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 936' ' ' LEU . . . . . . . . . . . . . 1.4 mp -62.93 -48.23 79.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.569 178.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 28.3 m -60.56 -44.83 95.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.548 -178.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 938' ' ' LEU . . . . . 0.514 ' HB2' ' O ' ' A' ' 934' ' ' GLN . 0.1 OUTLIER -58.5 -43.17 88.98 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.253 -177.989 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 939' ' ' TYR . . . . . 0.78 ' HE2' ' HB2' ' A' ' 898' ' ' PRO . 4.5 m-85 -79.17 -35.95 41.12 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.097 -177.37 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -62.3 -44.32 96.79 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.864 0.364 . . . . 0.0 110.717 178.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 941' ' ' GLU . . . . . 0.486 ' O ' ' HE2' ' A' ' 945' ' ' LYS . 4.1 pt-20 -70.41 -33.36 71.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.448 178.515 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 942' ' ' ARG . . . . . 0.428 ' N ' ' HG3' ' A' ' 941' ' ' GLU . 0.3 OUTLIER -64.34 -48.19 76.51 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.822 -179.336 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 28.6 m -71.15 -29.71 37.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.828 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.85 -47.15 86.36 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.237 178.679 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 945' ' ' LYS . . . . . 0.486 ' HE2' ' O ' ' A' ' 941' ' ' GLU . 0.1 OUTLIER -77.23 -22.47 52.22 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.901 -0.32 . . . . 0.0 111.124 -177.685 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 69.5 m -76.71 -32.84 58.11 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.809 0.338 . . . . 0.0 110.621 175.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.4 -42.59 18.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.079 -178.733 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 4.7 t70 . . . . . 0 C--N 1.325 -0.475 0 CA-C-O 121.235 0.541 . . . . 0.0 110.312 178.756 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.464 0.253 0 CA-C-O 120.98 0.419 . . . . 0.0 111.976 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 145.24 -11.9 1.82 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.199 -1.001 . . . . 0.0 112.644 -178.244 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 11.3 mmtt -67.27 140.03 57.34 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 175.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 708' ' ' ARG . . . . . 0.448 ' HG2' HG23 ' A' ' 732' ' ' VAL . 0.8 OUTLIER -105.31 141.89 36.04 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.037 0.446 . . . . 0.0 111.464 -174.759 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 1.5 m -121.94 110.24 15.61 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.275 174.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 710' ' ' TRP . . . . . 0.583 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 70.0 m95 -91.85 134.21 34.97 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 -178.467 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 711' ' ' LEU . . . . . 0.483 HD22 HG23 ' A' ' 733' ' ' VAL . 2.2 pt? -131.79 137.94 48.35 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 121.355 0.598 . . . . 0.0 111.264 -177.465 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -126.05 37.38 4.35 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.902 -1.044 . . . . 0.0 109.161 175.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 713' ' ' VAL . . . . . 0.832 ' HB ' ' HB3' ' A' ' 719' ' ' CYS . 2.1 t -87.75 116.34 29.69 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.833 177.751 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 714' ' ' ARG . . . . . 0.427 ' NH2' ' HB2' ' A' ' 751' ' ' GLU . 15.4 mtm180 -84.41 -16.2 43.57 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.439 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 54.9 t-20 -70.57 105.71 3.21 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.214 172.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 716' ' ' ALA . . . . . 0.644 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -60.92 -41.92 97.08 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.677 -174.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.69 -41.3 94.87 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.31 0.576 . . . . 0.0 110.376 179.21 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 718' ' ' LEU . . . . . 0.416 ' HB3' HG11 ' A' ' 713' ' ' VAL . 0.3 OUTLIER -73.74 -49.19 26.79 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.347 -177.891 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 719' ' ' CYS . . . . . 0.832 ' HB3' ' HB ' ' A' ' 713' ' ' VAL . 31.8 p -68.42 -40.68 81.11 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.013 -175.487 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 720' ' ' GLN . . . . . 0.587 ' O ' ' HG3' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -66.44 -39.75 89.09 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.46 -178.947 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -63.17 -46.58 86.43 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 121.165 0.507 . . . . 0.0 110.586 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.72 -47.42 78.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.921 -179.408 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 723' ' ' GLU . . . . . 0.587 ' HG3' ' O ' ' A' ' 720' ' ' GLN . 0.3 OUTLIER -60.12 -42.17 94.2 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.151 -176.75 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 724' ' ' THR . . . . . 0.61 ' O ' ' HG3' ' A' ' 728' ' ' ARG . 91.8 m -64.12 -36.87 85.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.881 0.372 . . . . 0.0 110.784 -179.553 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 725' ' ' SER . . . . . 0.441 ' HA ' ' HE ' ' A' ' 728' ' ' ARG . 19.5 m -70.47 -48.02 57.79 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.665 -179.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 726' ' ' LEU . . . . . 0.444 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 16.3 mt -66.35 -38.92 88.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.905 0.383 . . . . 0.0 111.548 -176.888 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 727' ' ' GLN . . . . . 0.438 ' HG2' ' O ' ' A' ' 723' ' ' GLU . 6.8 pt20 -72.58 -7.39 49.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.545 -177.629 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 728' ' ' ARG . . . . . 0.61 ' HG3' ' O ' ' A' ' 724' ' ' THR . 33.4 mtm180 -79.16 -34.63 42.98 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.112 0.482 . . . . 0.0 110.467 178.681 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -86.25 -24.52 25.98 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.658 -176.57 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 730' ' ' GLY . . . . . . . . . . . . . . . 120.36 14.9 5.22 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.525 -0.845 . . . . 0.0 111.855 -177.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 731' ' ' ILE . . . . . 0.444 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 9.6 mm -91.49 114.11 28.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 175.603 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 732' ' ' VAL . . . . . 0.448 HG23 ' HG2' ' A' ' 708' ' ' ARG . 0.0 OUTLIER -77.93 100.52 3.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 121.309 0.575 . . . . 0.0 110.963 -176.492 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 733' ' ' VAL . . . . . 0.483 HG23 HD22 ' A' ' 711' ' ' LEU . 1.3 p -74.31 133.12 32.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.056 176.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 734' ' ' THR . . . . . 0.414 ' O ' ' HA ' ' A' ' 710' ' ' TRP . 7.7 m -141.96 132.16 24.84 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.936 0.398 . . . . 0.0 110.399 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.22 124.89 20.96 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.754 176.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 736' ' ' TYR . . . . . 0.583 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 31.7 t80 -85.39 81.53 8.71 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.058 0.456 . . . . 0.0 110.536 -179.252 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -58.05 -45.76 86.49 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.503 174.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 149.33 41.83 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.547 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.944 178.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.19 -87.52 0.06 Allowed 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 120.396 0.141 . . . . 0.0 111.263 -176.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 740' ' ' GLU . . . . . 0.483 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 1.1 mt-10 -149.59 141.38 14.95 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-O 120.546 0.212 . . . . 0.0 111.23 -175.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 741' ' ' PRO . . . . . 0.587 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 5.3 Cg_endo -88.25 123.32 1.61 Allowed 'Trans proline' 0 N--CA 1.455 -0.744 0 C-N-CA 123.424 2.749 . . . . 0.0 112.239 175.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 742' ' ' THR . . . . . 0.493 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.2 OUTLIER -104.27 138.65 19.58 Favored Pre-proline 0 C--N 1.322 -0.622 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.929 179.073 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 743' ' ' PRO . . . . . 0.493 ' HD2' HG22 ' A' ' 742' ' ' THR . 37.0 Cg_endo -67.43 -7.13 18.24 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.882 2.388 . . . . 0.0 112.764 179.595 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -102.87 -8.72 20.5 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.114 0.483 . . . . 0.0 110.455 177.052 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -111.8 158.97 18.75 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.774 -171.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 746' ' ' VAL . . . . . 0.655 HG21 HD11 ' A' ' 795' ' ' LEU . 27.3 m -120.76 148.55 23.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.173 -176.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 747' ' ' LEU . . . . . 0.568 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 1.0 OUTLIER -117.64 112.24 20.24 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.036 177.766 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 748' ' ' ILE . . . . . 0.825 HG23 ' HB ' ' A' ' 763' ' ' VAL . 0.2 OUTLIER -99.37 107.15 20.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.906 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 176.151 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 12.6 t -107.39 158.33 17.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.289 0.566 . . . . 0.0 112.079 -173.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 750' ' ' ASP . . . . . 0.455 ' HB2' HG13 ' A' ' 713' ' ' VAL . 3.5 t70 -106.22 129.05 54.34 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.027 175.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 751' ' ' GLU . . . . . 0.427 ' HB2' ' NH2' ' A' ' 714' ' ' ARG . 3.8 mm-40 66.94 -175.75 0.19 Allowed 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.514 0.726 . . . . 0.0 111.988 178.337 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 752' ' ' VAL . . . . . 0.561 HG23 ' HB2' ' A' ' 769' ' ' HIS . 55.9 t -69.88 130.43 34.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.743 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -123.01 158.47 27.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.68 -178.543 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.89 -36.34 25.43 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.208 0.527 . . . . 0.0 110.185 178.533 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 755' ' ' LYS . . . . . 0.471 ' HE2' ' HE2' ' A' ' 736' ' ' TYR . 0.0 OUTLIER -113.24 110.38 20.29 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 176.937 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 756' ' ' LYS . . . . . 0.496 ' O ' ' HB2' ' A' ' 757' ' ' TRP . 0.0 OUTLIER -73.2 -57.59 3.91 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.432 -178.815 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 757' ' ' TRP . . . . . 0.667 ' HB2' ' HB ' ' A' ' 762' ' ' VAL . 2.3 t-105 164.31 162.58 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.459 -169.351 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -147.1 53.27 1.08 Allowed 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 174.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 759' ' ' GLY . . . . . 0.414 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -146.53 -133.98 2.54 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.884 -175.621 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.22 -57.69 5.02 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.722 0.296 . . . . 0.0 111.316 -176.531 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -162.61 145.89 11.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.032 0.444 . . . . 0.0 111.298 -178.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 762' ' ' VAL . . . . . 0.667 ' HB ' ' HB2' ' A' ' 757' ' ' TRP . 2.0 p -118.58 123.23 71.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.838 175.472 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 763' ' ' VAL . . . . . 0.825 ' HB ' HG23 ' A' ' 748' ' ' ILE . 48.0 t -103.74 108.99 25.82 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-O 121.058 0.456 . . . . 0.0 109.812 178.457 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 764' ' ' THR . . . . . . . . . . . . . 5.5 m -93.14 112.53 24.51 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.156 -178.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 765' ' ' PHE . . . . . 0.489 ' CZ ' ' HG ' ' A' ' 791' ' ' LEU . 34.0 m-85 -83.97 125.99 32.59 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 175.071 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 766' ' ' CYS . . . . . 0.412 ' HB3' HG12 ' A' ' 770' ' ' ILE . 0.0 OUTLIER -95.28 133.85 38.71 Favored 'General case' 0 C--N 1.314 -0.944 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.106 -179.453 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.76 -74.3 0.64 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.37 -0.377 . . . . 0.0 109.986 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 1.7 mmt85 -106.86 -35.38 6.96 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 175.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . 0.561 ' HB2' HG23 ' A' ' 752' ' ' VAL . 5.7 m80 -117.77 155.38 30.14 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.382 175.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 770' ' ' ILE . . . . . 0.449 ' O ' HG22 ' A' ' 752' ' ' VAL . 52.1 mt -107.8 -55.01 5.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 176.026 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . 70.7 -74.28 0.6 Allowed Glycine 0 C--N 1.33 0.231 0 CA-C-N 115.749 -0.659 . . . . 0.0 112.373 177.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 772' ' ' ILE . . . . . 0.417 ' HA ' ' HD3' ' A' ' 773' ' ' PRO . 14.6 mm -65.24 122.78 81.78 Favored Pre-proline 0 C--N 1.324 -0.53 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 177.419 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 773' ' ' PRO . . . . . 0.508 ' HB2' ' HG3' ' A' ' 776' ' ' LYS . 41.6 Cg_exo -56.91 -72.06 0.03 OUTLIER 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.679 2.252 . . . . 0.0 112.672 -176.107 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . 0.604 ' O ' ' HB3' ' A' ' 780' ' ' GLU . 1.1 pt? 169.83 -153.12 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.277 0 N-CA-C 108.65 -0.871 . . . . 0.0 108.65 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 775' ' ' GLU . . . . . 0.566 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 1.5 mp0 -59.47 69.14 0.01 OUTLIER 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.306 0.574 . . . . 0.0 111.869 170.47 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 776' ' ' LYS . . . . . 0.508 ' HG3' ' HB2' ' A' ' 773' ' ' PRO . 0.0 OUTLIER -106.28 -38.38 6.25 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.1 174.863 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -103.0 153.21 38.45 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.398 171.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -61.3 98.4 0.15 Allowed 'Trans proline' 0 CA--C 1.529 0.252 0 C-N-CA 122.494 2.129 . . . . 0.0 112.258 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 116.63 -1.24 20.19 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.265 179.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 780' ' ' GLU . . . . . 0.604 ' HB3' ' O ' ' A' ' 774' ' ' LEU . 0.9 OUTLIER -87.69 122.77 31.78 Favored 'General case' 0 C--O 1.219 -0.519 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 -179.546 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 28.2 m95 -132.82 146.78 52.12 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 177.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . 0.558 HG13 ' HA ' ' A' ' 774' ' ' LEU . 33.6 m -136.34 158.26 37.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 176.375 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 783' ' ' HIS . . . . . 0.46 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.0 OUTLIER -172.86 120.27 0.37 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.746 175.044 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.63 101.52 14.2 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 172.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 785' ' ' VAL . . . . . 0.675 HG13 ' H ' ' A' ' 787' ' ' ALA . 4.9 p -175.42 158.01 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.191 -176.55 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -86.85 9.66 18.48 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.038 178.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 787' ' ' ALA . . . . . 0.675 ' H ' HG13 ' A' ' 785' ' ' VAL . . . 58.33 71.87 0.95 Allowed Pre-proline 0 N--CA 1.468 0.427 0 CA-C-N 115.647 -0.706 . . . . 0.0 112.262 177.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 788' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -66.27 -61.8 0.08 OUTLIER 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.35 2.033 . . . . 0.0 111.589 178.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -141.25 -31.68 0.57 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.937 0.399 . . . . 0.0 111.153 176.105 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 790' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -61.8 -44.49 96.77 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.802 -0.636 . . . . 0.0 112.659 -170.322 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 791' ' ' LEU . . . . . 0.489 ' HG ' ' CZ ' ' A' ' 765' ' ' PHE . 0.6 OUTLIER -68.93 -53.47 14.47 Favored Pre-proline 0 C--N 1.326 -0.437 0 C-N-CA 120.601 -0.44 . . . . 0.0 111.67 -176.87 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 792' ' ' PRO . . . . . 0.43 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 9.6 Cg_endo -57.03 -32.47 93.23 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 121.554 1.503 . . . . 0.0 112.048 175.736 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -69.58 -40.99 76.4 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.784 0.326 . . . . 0.0 110.85 177.072 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -59.63 -44.76 93.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.152 0.501 . . . . 0.0 109.751 177.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 795' ' ' LEU . . . . . 0.655 HD11 HG21 ' A' ' 746' ' ' VAL . 0.7 OUTLIER -63.32 -48.56 77.53 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.904 -179.768 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -61.99 -41.61 98.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.352 -179.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.17 -33.92 76.52 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.88 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -69.31 -32.97 55.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.695 179.57 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -96.29 3.16 53.22 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.4 -179.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 1.2 mp . . . . . 0 N--CA 1.471 0.579 0 C-N-CA 123.611 0.764 . . . . 0.0 112.482 175.36 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 8.3 t70 . . . . . 0 CA--C 1.521 -0.171 0 CA-C-O 120.928 0.394 . . . . 0.0 110.806 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 825' ' ' MET . . . . . 0.517 ' HE1' HG12 ' A' ' 871' ' ' ILE . 0.0 OUTLIER -100.19 109.1 21.35 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.747 178.198 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 826' ' ' MET . . . . . 0.567 ' HG3' ' HA ' ' A' ' 869' ' ' ILE . 0.0 OUTLIER -115.37 129.17 56.51 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.113 0.482 . . . . 0.0 110.952 -176.071 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 827' ' ' ILE . . . . . . . . . . . . . 2.9 mm -118.02 127.29 75.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.58 -0.737 . . . . 0.0 109.52 179.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 828' ' ' LEU . . . . . 0.507 ' HB2' HG12 ' A' ' 869' ' ' ILE . 7.7 tp -104.53 130.19 52.5 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.523 0.202 . . . . 0.0 110.748 -177.672 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 829' ' ' VAL . . . . . 0.58 HG21 HD11 ' A' ' 840' ' ' LEU . 0.3 OUTLIER -112.92 121.78 65.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.98 177.452 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 830' ' ' VAL . . . . . 0.56 HG11 ' HB2' ' A' ' 860' ' ' ALA . 0.2 OUTLIER -115.74 86.85 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.112 178.552 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 831' ' ' ASP . . . . . 0.887 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 55.0 t0 -108.94 134.02 52.16 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.434 -176.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -73.99 -13.72 60.91 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.866 178.547 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 1.1 m80 -109.24 92.65 11.66 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.179 177.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 834' ' ' PRO . . . . . 0.577 ' HA ' ' HD3' ' A' ' 837' ' ' ARG . 2.5 Cg_endo -46.33 -37.66 19.36 Favored 'Trans proline' 0 CA--C 1.534 0.521 0 C-N-CA 123.733 2.955 . . . . 0.0 114.167 -175.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 1.1 pp -65.3 -42.7 94.44 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 CA-C-O 120.921 0.391 . . . . 0.0 111.74 -178.168 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 836' ' ' ASN . . . . . 0.614 ' HB3' ' OD2' ' A' ' 831' ' ' ASP . 0.3 OUTLIER -69.62 -43.87 71.81 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.506 -0.554 . . . . 0.0 109.506 179.856 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 837' ' ' ARG . . . . . 0.887 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 1.1 ttt-85 -55.64 -40.6 72.41 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.872 -1.058 . . . . 0.0 111.032 177.077 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 838' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 838' ' ' ARG . 0.0 OUTLIER -64.75 -39.85 94.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.586 178.768 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.48 -49.16 67.53 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.211 -177.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 840' ' ' LEU . . . . . 0.58 HD11 HG21 ' A' ' 829' ' ' VAL . 2.3 pp -73.95 -27.68 61.13 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.933 -0.307 . . . . 0.0 111.173 -177.138 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -66.15 -32.69 74.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.987 0.422 . . . . 0.0 110.061 174.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -63.62 -45.73 88.95 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.928 176.119 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 843' ' ' GLN . . . . . 0.63 ' HG2' HD23 ' A' ' 929' ' ' LEU . 3.1 mt-30 -60.25 -42.21 94.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.283 175.564 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 844' ' ' LEU . . . . . . . . . . . . . 1.2 mp -58.88 -44.61 91.18 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.004 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -63.72 -41.43 98.97 Favored Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.905 -0.588 . . . . 0.0 112.326 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 68.8 m -73.19 -13.74 61.22 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.687 0.279 . . . . 0.0 111.331 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 847' ' ' LEU . . . . . 0.565 HD21 ' HA ' ' A' ' 933' ' ' LYS . 0.1 OUTLIER -83.62 -4.93 59.0 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.872 0.368 . . . . 0.0 110.691 176.828 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 87.86 17.06 58.72 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.943 -0.646 . . . . 0.0 112.884 177.091 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 849' ' ' TYR . . . . . 0.415 ' CD2' HD23 ' A' ' 936' ' ' LEU . 30.1 m-85 -112.11 144.06 42.11 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.726 0.298 . . . . 0.0 110.475 -178.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -75.69 108.25 8.4 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.108 0.48 . . . . 0.0 109.726 -179.723 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -87.61 122.03 30.8 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.55 -174.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 852' ' ' LYS . . . . . 0.4 ' O ' HD12 ' A' ' 828' ' ' LEU . 7.0 mptt -107.73 120.58 42.63 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 174.543 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -99.77 137.79 37.76 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 120.904 0.383 . . . . 0.0 111.852 -173.42 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 854' ' ' ALA . . . . . 0.411 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -150.41 157.97 43.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.056 176.294 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -149.19 75.56 1.29 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.708 179.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 856' ' ' ASP . . . . . . . . . . . . . 24.4 t70 175.16 136.95 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.828 179.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 857' ' ' GLY . . . . . 0.45 ' HA2' HD13 ' A' ' 886' ' ' LEU . . . -65.1 -44.4 94.23 Favored Glycine 0 CA--C 1.519 0.309 0 C-N-CA 120.985 -0.626 . . . . 0.0 113.307 -179.001 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 37.7 t -73.91 -44.98 50.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.029 0.442 . . . . 0.0 110.597 -177.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -66.36 -19.72 65.88 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.154 -176.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 860' ' ' ALA . . . . . 0.56 ' HB2' HG11 ' A' ' 830' ' ' VAL . . . -61.72 -39.56 91.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.905 0.383 . . . . 0.0 110.403 174.324 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 861' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.52 -34.07 65.07 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.226 178.006 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 19.9 t30 -63.28 -41.99 99.06 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.247 176.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -70.92 -31.48 45.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.374 177.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 864' ' ' LEU . . . . . 0.691 HD21 HD11 ' A' ' 897' ' ' LEU . 0.9 OUTLIER -58.89 -36.0 73.93 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.776 176.151 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -83.58 -38.27 21.87 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.847 179.828 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.69 -52.73 63.88 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.078 0.466 . . . . 0.0 110.645 179.274 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 867' ' ' ASN . . . . . 0.552 ' HB3' ' H ' ' A' ' 868' ' ' HIS . 0.1 OUTLIER -106.19 -127.35 0.25 Allowed 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.798 -0.816 . . . . 0.0 108.798 176.292 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 868' ' ' HIS . . . . . 0.552 ' H ' ' HB3' ' A' ' 867' ' ' ASN . 0.2 OUTLIER -165.19 -56.17 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 110.07 -0.345 . . . . 0.0 110.07 174.371 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 869' ' ' ILE . . . . . 0.567 ' HA ' ' HG3' ' A' ' 826' ' ' MET . 2.4 mp 74.24 140.55 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 O-C-N 123.758 0.661 . . . . 0.0 111.562 174.73 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -87.43 -57.99 2.75 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.417 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 871' ' ' ILE . . . . . 0.517 HG12 ' HE1' ' A' ' 825' ' ' MET . 41.4 mm -111.82 126.99 69.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.323 -179.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 872' ' ' VAL . . . . . 0.659 ' HB ' ' HB ' ' A' ' 899' ' ' VAL . 0.1 OUTLIER -105.11 137.02 36.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.788 -178.689 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 873' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -125.0 124.76 42.68 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 173.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -121.89 101.79 7.78 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 120.989 0.423 . . . . 0.0 109.993 178.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 875' ' ' ASP . . . . . 0.67 ' HB2' ' HE2' ' A' ' 925' ' ' LYS . 0.5 OUTLIER -107.48 115.67 30.56 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 122.013 0.911 . . . . 0.0 110.907 -178.673 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 3.1 p -137.33 128.87 41.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 114.951 -1.022 . . . . 0.0 110.213 -176.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 877' ' ' ASN . . . . . 0.582 ' ND2' ' HB3' ' A' ' 904' ' ' ALA . 1.8 t30 -155.96 64.28 0.58 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.43 0.633 . . . . 0.0 110.393 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 6.8 mmt . . . . . 0 C--N 1.32 -0.699 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 176.401 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.34 0 N-CA-C 112.406 -0.278 . . . . 0.0 112.406 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 884' ' ' TYR . . . . . 0.432 ' O ' ' HB2' ' A' ' 888' ' ' GLN . 2.7 t80 -138.5 -50.91 0.56 Allowed 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 177.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -66.05 -46.54 77.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.64 179.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 886' ' ' LEU . . . . . 0.524 ' HG ' ' N ' ' A' ' 887' ' ' THR . 0.0 OUTLIER -62.97 -45.94 90.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.67 -177.974 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 887' ' ' THR . . . . . 0.524 ' N ' ' HG ' ' A' ' 886' ' ' LEU . 0.0 OUTLIER -65.39 -42.37 92.72 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.075 -179.469 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 888' ' ' GLN . . . . . 0.432 ' HB2' ' O ' ' A' ' 884' ' ' TYR . 0.3 OUTLIER -64.69 -47.3 78.87 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.889 -178.712 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 889' ' ' ARG . . . . . 0.532 ' HD3' ' OE1' ' A' ' 892' ' ' GLN . 13.1 mmt180 -66.54 -32.41 73.75 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.532 -0.303 . . . . 0.0 111.074 -177.537 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 890' ' ' ILE . . . . . 0.499 HG23 HD13 ' A' ' 895' ' ' LEU . 5.3 mt -60.55 -51.17 76.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.964 0.412 . . . . 0.0 110.718 178.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 891' ' ' ARG . . . . . 0.632 ' HB3' ' HA2' ' A' ' 918' ' ' GLY . 0.1 OUTLIER -74.67 -31.16 61.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.859 -178.997 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 892' ' ' GLN . . . . . 0.532 ' OE1' ' HD3' ' A' ' 889' ' ' ARG . 7.5 mt-30 -65.61 -41.99 92.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.589 179.313 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.14 -29.21 68.86 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.009 177.218 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 92.7 64.03 1.11 Allowed Glycine 0 N--CA 1.443 -0.842 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.736 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 895' ' ' LEU . . . . . 0.499 HD13 HG23 ' A' ' 890' ' ' ILE . 0.3 OUTLIER -67.26 111.09 3.79 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 178.173 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.66 0.58 56.28 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.14 -176.167 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 897' ' ' LEU . . . . . 0.691 HD11 HD21 ' A' ' 864' ' ' LEU . 0.0 OUTLIER -107.95 135.78 19.82 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.436 176.806 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -67.96 124.78 12.23 Favored 'Trans proline' 0 C--O 1.235 0.338 0 C-N-CA 122.653 2.235 . . . . 0.0 112.32 -177.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 899' ' ' VAL . . . . . 0.659 ' HB ' ' HB ' ' A' ' 872' ' ' VAL . 0.2 OUTLIER -113.62 131.8 64.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 121.573 0.702 . . . . 0.0 110.526 179.783 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 900' ' ' ILE . . . . . 0.679 HG23 ' HB2' ' A' ' 921' ' ' SER . 0.4 OUTLIER -101.09 117.85 46.95 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.161 178.873 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -91.68 117.06 5.13 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.809 -0.71 . . . . 0.0 111.496 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 902' ' ' VAL . . . . . 0.713 ' HB ' ' HB2' ' A' ' 923' ' ' LEU . 0.5 OUTLIER -105.66 134.4 47.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.717 0 CA-C-O 121.425 0.631 . . . . 0.0 110.699 -175.921 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -139.73 159.32 42.44 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.344 -175.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 904' ' ' ALA . . . . . 0.612 ' HB2' ' HB2' ' A' ' 925' ' ' LYS . . . -109.95 114.33 27.79 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 122.35 -0.219 . . . . 0.0 110.485 179.157 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 61.02 54.66 3.31 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.667 -178.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -104.33 93.28 4.73 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.36 177.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.37 125.66 21.76 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.598 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . 59.59 48.08 9.97 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.143 -178.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.22 -30.03 70.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.153 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 910' ' ' GLU . . . . . 0.49 ' HA ' ' SG ' ' A' ' 922' ' ' CYS . 0.0 OUTLIER -65.01 -43.99 90.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.014 175.646 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -63.33 -43.25 98.28 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.341 177.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -61.46 -42.38 98.69 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.977 179.17 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.97 -41.52 91.07 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.145 -179.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 69.4 m -69.5 -31.67 70.05 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.862 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.65 -46.25 89.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.94 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 916' ' ' GLU . . . . . 0.546 ' HG2' ' H ' ' A' ' 918' ' ' GLY . 0.0 OUTLIER -77.71 -32.29 52.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.557 178.615 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 917' ' ' SER . . . . . 0.488 ' N ' ' HG2' ' A' ' 916' ' ' GLU . 0.1 OUTLIER 47.03 46.82 16.06 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.383 -178.664 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 918' ' ' GLY . . . . . 0.632 ' HA2' ' HB3' ' A' ' 891' ' ' ARG . . . -122.56 -32.2 0.98 Allowed Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.605 -178.361 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 919' ' ' MET . . . . . 0.651 ' HA ' HG13 ' A' ' 899' ' ' VAL . 3.3 mtt -83.16 -86.87 0.1 Allowed 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 121.206 -0.198 . . . . 0.0 110.5 179.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 920' ' ' ASP . . . . . 0.555 ' HB2' ' O ' ' A' ' 919' ' ' MET . 43.8 t0 161.18 -67.72 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.616 0 O-C-N 124.183 0.927 . . . . 0.0 109.276 177.295 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . 0.679 ' HB2' HG23 ' A' ' 900' ' ' ILE . 66.3 m -127.06 -177.87 4.21 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.502 -178.578 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 922' ' ' CYS . . . . . 0.49 ' SG ' ' HA ' ' A' ' 910' ' ' GLU . 0.5 OUTLIER -139.59 145.44 38.58 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.897 0.379 . . . . 0.0 111.094 -177.021 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 923' ' ' LEU . . . . . 0.713 ' HB2' ' HB ' ' A' ' 902' ' ' VAL . 58.4 mt -130.04 166.73 19.53 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.041 179.346 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 924' ' ' SER . . . . . 0.508 ' O ' HG23 ' A' ' 927' ' ' VAL . 0.7 OUTLIER -91.52 144.75 25.23 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.016 173.971 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 925' ' ' LYS . . . . . 0.67 ' HE2' ' HB2' ' A' ' 875' ' ' ASP . 2.7 tmtt? -58.72 -46.71 99.55 Favored Pre-proline 0 N--CA 1.467 0.38 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 926' ' ' PRO . . . . . 0.496 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 46.7 Cg_endo -69.69 55.38 1.24 Allowed 'Trans proline' 0 C--N 1.355 0.908 0 C-N-CA 122.055 1.837 . . . . 0.0 112.592 174.296 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 927' ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' ' 924' ' ' SER . 0.9 OUTLIER -67.97 129.19 32.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.789 176.786 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.57 167.89 10.86 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.824 179.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 929' ' ' LEU . . . . . 0.63 HD23 ' HG2' ' A' ' 843' ' ' GLN . 0.0 OUTLIER -54.9 -45.38 74.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.872 0.367 . . . . 0.0 110.764 179.201 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -64.06 -40.22 95.8 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.912 0.387 . . . . 0.0 110.721 -178.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 13.6 t -65.27 -49.98 75.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.802 -178.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 932' ' ' ILE . . . . . 0.591 ' O ' ' HB2' ' A' ' 936' ' ' LEU . 2.9 tp -66.23 -31.4 53.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.812 0.339 . . . . 0.0 110.659 -179.123 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 933' ' ' LYS . . . . . 0.565 ' HA ' HD21 ' A' ' 847' ' ' LEU . 0.3 OUTLIER -66.21 -49.17 68.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.983 178.936 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 934' ' ' GLN . . . . . 0.467 ' HG3' ' N ' ' A' ' 935' ' ' THR . 0.1 OUTLIER -75.22 -42.31 55.75 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.648 -174.375 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 935' ' ' THR . . . . . 0.467 ' N ' ' HG3' ' A' ' 934' ' ' GLN . 3.3 m -70.14 -42.2 72.89 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.531 0.197 . . . . 0.0 111.531 -175.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 936' ' ' LEU . . . . . 0.591 ' HB2' ' O ' ' A' ' 932' ' ' ILE . 0.7 OUTLIER -67.17 -44.54 79.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.695 0.283 . . . . 0.0 110.788 -179.985 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 80.4 m -68.17 -38.66 82.3 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.226 -178.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 938' ' ' LEU . . . . . 0.505 ' O ' ' HB2' ' A' ' 942' ' ' ARG . 0.0 OUTLIER -63.52 -42.18 98.46 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.907 0.384 . . . . 0.0 110.423 178.078 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 939' ' ' TYR . . . . . 0.492 ' O ' HG22 ' A' ' 943' ' ' VAL . 0.4 OUTLIER -69.28 -40.91 77.48 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.91 179.311 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -59.15 -47.83 83.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.588 -178.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 941' ' ' GLU . . . . . 0.441 ' HG3' ' N ' ' A' ' 942' ' ' ARG . 3.8 pt-20 -71.53 -32.96 68.74 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.759 0.314 . . . . 0.0 110.598 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 942' ' ' ARG . . . . . 0.505 ' HB2' ' O ' ' A' ' 938' ' ' LEU . 2.3 ttp180 -65.23 -48.26 73.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.315 -178.016 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 943' ' ' VAL . . . . . 0.492 HG22 ' O ' ' A' ' 939' ' ' TYR . 18.1 m -70.92 -36.67 64.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 120.962 0.411 . . . . 0.0 111.367 -178.112 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.3 -38.68 63.27 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.494 -176.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 8.5 pttp -70.76 -35.39 72.6 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.657 0.265 . . . . 0.0 110.669 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 19.8 m -73.03 -23.26 60.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.13 0.491 . . . . 0.0 110.423 177.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.22 -21.57 33.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.371 176.647 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 32.3 t0 . . . . . 0 N--CA 1.464 0.274 0 O-C-N 123.874 0.733 . . . . 0.0 110.826 179.482 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.452 -0.351 0 CA-C-O 120.808 0.337 . . . . 0.0 111.547 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 88.8 3.31 77.26 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.832 -0.699 . . . . 0.0 113.402 171.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.87 137.83 57.46 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 178.326 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 708' ' ' ARG . . . . . . . . . . . . . 3.8 mtt85 -103.02 156.29 17.78 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.215 0.531 . . . . 0.0 111.615 -177.354 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -138.74 128.78 25.34 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.02 -0.991 . . . . 0.0 108.741 174.167 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 710' ' ' TRP . . . . . 0.823 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 96.5 m95 -92.26 129.31 38.24 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.408 0.623 . . . . 0.0 110.468 -176.263 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 711' ' ' LEU . . . . . 0.636 HD21 ' HB2' ' A' ' 719' ' ' CYS . 0.9 OUTLIER -118.1 125.95 51.3 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.668 -172.657 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -126.15 52.7 1.67 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.311 0.577 . . . . 0.0 110.045 177.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 713' ' ' VAL . . . . . 0.699 ' HA ' ' HB3' ' A' ' 750' ' ' ASP . 87.5 t -111.95 120.96 63.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.917 179.434 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 714' ' ' ARG . . . . . 0.471 ' NH2' ' HB3' ' A' ' 751' ' ' GLU . 1.9 mtm180 -81.34 -19.57 42.52 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.081 0.467 . . . . 0.0 110.461 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -75.62 100.17 4.54 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.853 176.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 716' ' ' ALA . . . . . 0.622 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -61.68 -35.29 77.57 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.714 -173.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -65.07 -46.79 79.74 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.008 0.433 . . . . 0.0 110.44 177.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 2.3 tt -69.27 -45.17 70.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.762 -179.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 719' ' ' CYS . . . . . 0.636 ' HB2' HD21 ' A' ' 711' ' ' LEU . 8.3 p -66.82 -40.68 88.12 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.941 -177.325 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 720' ' ' GLN . . . . . 0.456 ' HB2' ' O ' ' A' ' 716' ' ' ALA . 0.1 OUTLIER -59.95 -41.33 91.63 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-O 120.586 0.232 . . . . 0.0 110.811 177.925 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -56.71 -52.82 63.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.899 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 722' ' ' LEU . . . . . 0.443 HD13 HG21 ' A' ' 748' ' ' ILE . 3.2 mt -67.08 -47.46 71.17 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.094 -178.44 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 723' ' ' GLU . . . . . 0.909 ' HA ' HG21 ' A' ' 733' ' ' VAL . 0.3 OUTLIER -61.42 -39.29 90.25 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.278 -174.386 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 724' ' ' THR . . . . . 0.558 ' HA ' ' CG ' ' A' ' 727' ' ' GLN . 88.3 m -73.01 -34.2 66.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.693 0.282 . . . . 0.0 111.155 -178.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 50.4 m -61.98 -36.15 80.62 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.761 0.315 . . . . 0.0 110.933 177.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 726' ' ' LEU . . . . . 0.554 HD21 HD12 ' A' ' 795' ' ' LEU . 1.1 mt -78.42 -41.36 33.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.271 -178.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 727' ' ' GLN . . . . . 0.558 ' CG ' ' HA ' ' A' ' 724' ' ' THR . 1.7 pt20 -74.2 -4.82 38.23 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.973 0.416 . . . . 0.0 111.111 -179.287 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.4 -22.26 65.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.171 175.102 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 729' ' ' SER . . . . . 0.51 ' HB2' ' H ' ' A' ' 730' ' ' GLY . 0.1 OUTLIER -104.38 -107.98 0.28 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.227 177.358 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 730' ' ' GLY . . . . . 0.51 ' H ' ' HB2' ' A' ' 729' ' ' SER . . . -138.93 25.55 2.79 Favored Glycine 0 CA--C 1.51 -0.239 0 N-CA-C 110.922 -0.871 . . . . 0.0 110.922 179.134 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 731' ' ' ILE . . . . . 0.44 ' O ' ' HA ' ' A' ' 727' ' ' GLN . 1.0 OUTLIER -107.47 146.68 13.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 -178.067 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 732' ' ' VAL . . . . . . . . . . . . . 2.1 p -123.36 131.57 72.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.043 0.449 . . . . 0.0 110.981 -176.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 733' ' ' VAL . . . . . 0.909 HG21 ' HA ' ' A' ' 723' ' ' GLU . 3.7 t -101.44 147.56 8.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 177.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -149.01 141.61 24.41 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.816 0.341 . . . . 0.0 111.057 -173.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -59.48 118.21 5.77 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.829 178.325 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 736' ' ' TYR . . . . . 0.823 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 36.5 t80 -85.31 91.01 8.06 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.189 0.519 . . . . 0.0 110.833 -179.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 737' ' ' GLU . . . . . 0.491 ' H ' ' HG3' ' A' ' 737' ' ' GLU . 0.0 OUTLIER -93.46 -128.66 0.12 Allowed 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.312 172.061 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 738' ' ' GLY . . . . . 0.482 ' H ' ' HB2' ' A' ' 737' ' ' GLU . . . -80.93 59.33 4.75 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.615 -0.803 . . . . 0.0 112.398 178.155 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 739' ' ' GLN . . . . . 0.495 ' HG2' ' CH2' ' A' ' 710' ' ' TRP . 0.9 OUTLIER -107.37 176.24 5.22 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 -179.049 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 740' ' ' GLU . . . . . 0.441 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 1.1 mt-10 -87.0 141.02 32.91 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.788 -177.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 741' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 740' ' ' GLU . 5.4 Cg_endo -87.69 121.39 1.55 Allowed 'Trans proline' 0 N--CA 1.453 -0.888 0 C-N-CA 123.023 2.482 . . . . 0.0 111.585 175.031 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 742' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.16 136.24 20.5 Favored Pre-proline 0 C--N 1.32 -0.708 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.444 -174.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 743' ' ' PRO . . . . . 0.752 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 31.8 Cg_endo -65.89 -9.62 23.79 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 123.045 2.497 . . . . 0.0 112.644 177.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -101.84 -1.1 32.97 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.657 175.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 37.2 m-20 -110.79 150.85 28.52 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.894 0.378 . . . . 0.0 110.911 -174.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 2.4 p -117.23 136.75 53.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.449 -178.057 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 747' ' ' LEU . . . . . 0.408 HD23 ' O ' ' A' ' 710' ' ' TRP . 0.4 OUTLIER -100.45 136.8 39.76 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.015 -0.538 . . . . 0.0 109.984 177.707 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 748' ' ' ILE . . . . . 0.443 HG21 HD13 ' A' ' 722' ' ' LEU . 18.0 mt -120.12 107.69 21.52 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 171.22 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.05 164.79 11.69 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.813 -0.631 . . . . 0.0 112.159 -170.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 750' ' ' ASP . . . . . 0.699 ' HB3' ' HA ' ' A' ' 713' ' ' VAL . 0.0 OUTLIER -129.01 129.34 45.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.936 173.751 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 751' ' ' GLU . . . . . 0.968 ' HG2' ' H ' ' A' ' 752' ' ' VAL . 20.7 tt0 65.3 -178.44 0.18 Allowed 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.682 0.753 . . . . 0.0 111.697 -179.741 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 752' ' ' VAL . . . . . 0.968 ' H ' ' HG2' ' A' ' 751' ' ' GLU . 4.5 p -61.66 132.55 27.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 114.917 -1.038 . . . . 0.0 111.294 178.176 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 8.1 p -129.69 153.77 39.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.168 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -96.54 40.95 1.12 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.758 0.313 . . . . 0.0 111.559 -177.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.08 154.29 40.02 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 177.722 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 756' ' ' LYS . . . . . 0.429 ' O ' ' HB3' ' A' ' 757' ' ' TRP . 3.7 tptp -102.24 -37.6 8.03 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 121.316 -0.154 . . . . 0.0 111.271 -177.182 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 757' ' ' TRP . . . . . 0.525 ' CD1' ' HB ' ' A' ' 762' ' ' VAL . 63.5 t-105 72.1 105.34 0.07 Allowed 'General case' 0 N--CA 1.468 0.432 0 O-C-N 123.88 0.737 . . . . 0.0 111.312 179.273 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 4.9 mm100 -100.27 84.4 2.81 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.061 177.177 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 759' ' ' GLY . . . . . 0.752 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -144.71 -149.08 4.97 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.574 -0.822 . . . . 0.0 113.134 -177.534 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.97 -53.74 45.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.238 0.542 . . . . 0.0 109.872 -179.566 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -164.04 156.3 17.1 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.068 178.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 762' ' ' VAL . . . . . 0.525 ' HB ' ' CD1' ' A' ' 757' ' ' TRP . 2.4 p -134.39 113.71 17.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 175.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -111.67 105.87 19.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.22 -177.65 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 764' ' ' THR . . . . . 0.783 ' HB ' HG12 ' A' ' 782' ' ' VAL . 68.1 m -99.23 120.48 39.61 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.546 -177.218 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 765' ' ' PHE . . . . . 0.527 ' CE1' HG23 ' A' ' 785' ' ' VAL . 8.8 m-85 -76.64 130.34 37.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.138 175.424 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 766' ' ' CYS . . . . . 0.545 ' O ' ' HA ' ' A' ' 784' ' ' SER . 3.2 m -105.25 131.45 52.69 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-O 120.968 0.413 . . . . 0.0 109.964 176.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.6 22.54 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 178.687 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 768' ' ' ARG . . . . . 0.436 ' HB3' ' H ' ' A' ' 769' ' ' HIS . 0.0 OUTLIER -157.66 -104.24 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.8 -1.091 . . . . 0.0 108.424 -177.088 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . 0.436 ' H ' ' HB3' ' A' ' 768' ' ' ARG . 0.2 OUTLIER -111.13 147.77 34.15 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 109.921 -0.399 . . . . 0.0 109.921 171.409 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 4.6 mt -106.81 154.05 7.86 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.802 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.867 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 771' ' ' GLY . . . . . 0.72 ' HA3' HG23 ' A' ' 752' ' ' VAL . . . -151.09 -39.65 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.871 -0.68 . . . . 0.0 111.765 -179.451 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 772' ' ' ILE . . . . . 0.443 ' HA ' ' HD3' ' A' ' 773' ' ' PRO . 32.9 mm -88.42 131.26 42.76 Favored Pre-proline 0 C--N 1.324 -0.503 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 176.608 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 773' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 772' ' ' ILE . 12.1 Cg_exo -70.64 172.98 12.45 Favored 'Trans proline' 0 N--CA 1.463 -0.316 0 C-N-CA 122.759 2.306 . . . . 0.0 111.936 178.43 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . 0.554 ' HB3' HG22 ' A' ' 782' ' ' VAL . 0.7 OUTLIER -90.16 -152.57 0.26 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.734 -179.045 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 775' ' ' GLU . . . . . 0.534 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 1.2 mp0 -62.21 72.42 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.61 -21.47 30.33 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 168.177 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 777' ' ' ALA . . . . . 0.46 ' HB3' ' HG3' ' A' ' 780' ' ' GLU . . . -143.1 155.35 62.02 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 114.321 -1.309 . . . . 0.0 109.102 179.623 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -65.22 78.08 0.23 Allowed 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.891 2.394 . . . . 0.0 111.731 175.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 163.59 -28.31 0.23 Allowed Glycine 0 N--CA 1.447 -0.604 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.54 -178.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 780' ' ' GLU . . . . . 0.534 ' O ' ' HG3' ' A' ' 775' ' ' GLU . 3.5 mt-10 -89.04 121.95 31.89 Favored 'General case' 0 C--O 1.222 -0.39 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 179.385 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 34.4 m95 -139.38 139.0 37.06 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.929 0.395 . . . . 0.0 110.647 -178.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . 0.783 HG12 ' HB ' ' A' ' 764' ' ' THR . 28.5 m -138.37 153.52 26.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 169.334 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 783' ' ' HIS . . . . . . . . . . . . . 4.9 t-160 -155.88 120.7 4.71 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.765 0.317 . . . . 0.0 110.454 176.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 784' ' ' SER . . . . . 0.545 ' HA ' ' O ' ' A' ' 766' ' ' CYS . 0.4 OUTLIER -84.73 100.86 11.77 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.059 178.268 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 785' ' ' VAL . . . . . 0.527 HG23 ' CE1' ' A' ' 765' ' ' PHE . 0.0 OUTLIER -162.01 -178.51 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.53 178.548 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -113.8 31.87 6.23 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.79 0.329 . . . . 0.0 110.572 178.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 59.46 73.19 0.7 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.009 178.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 788' ' ' PRO . . . . . 0.676 ' HD2' ' OE1' ' A' ' 790' ' ' GLU . 12.0 Cg_exo -71.8 -67.91 0.02 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.711 2.274 . . . . 0.0 110.947 173.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 1.4 p-80 176.45 28.48 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 122.784 0.434 . . . . 0.0 110.816 175.246 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 790' ' ' GLU . . . . . 0.676 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -101.25 -43.83 5.85 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.02 0.438 . . . . 0.0 110.265 -177.923 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 791' ' ' LEU . . . . . 0.486 HD22 ' CE2' ' A' ' 765' ' ' PHE . 0.2 OUTLIER -66.66 -47.47 56.21 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 115.822 -0.627 . . . . 0.0 111.788 179.07 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 792' ' ' PRO . . . . . 0.437 ' HG3' HD23 ' A' ' 722' ' ' LEU . 39.8 Cg_exo -57.25 -33.65 96.4 Favored 'Trans proline' 0 C--N 1.359 1.102 0 C-N-CA 121.701 1.6 . . . . 0.0 111.58 175.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -68.61 -41.76 79.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.584 177.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.57 -28.43 65.96 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.878 178.431 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 795' ' ' LEU . . . . . 0.554 HD12 HD21 ' A' ' 726' ' ' LEU . 0.2 OUTLIER -63.88 -40.5 96.69 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.959 -0.386 . . . . 0.0 109.959 177.521 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -68.71 -34.61 75.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.025 0.44 . . . . 0.0 110.764 176.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.9 -49.05 64.15 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.666 179.681 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -66.09 -31.17 52.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.595 177.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -62.16 -34.4 76.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.024 177.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 4.6 mt . . . . . 0 C--O 1.234 0.255 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.409 -178.253 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 2.0 t0 . . . . . 0 N--CA 1.454 -0.274 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 2.6 mtt -76.41 120.45 21.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.237 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 826' ' ' MET . . . . . . . . . . . . . 37.0 ttm -94.02 121.36 35.42 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.288 0.566 . . . . 0.0 111.579 -177.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 827' ' ' ILE . . . . . 0.613 HG21 HD11 ' A' ' 936' ' ' LEU . 13.6 mm -112.91 130.74 66.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 114.966 -1.015 . . . . 0.0 109.087 175.292 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 828' ' ' LEU . . . . . 0.637 ' HB3' HG22 ' A' ' 872' ' ' VAL . 34.6 tp -95.21 114.41 26.2 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.196 0.522 . . . . 0.0 110.024 -179.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 829' ' ' VAL . . . . . 0.882 ' HB ' ' HD2' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -103.09 107.31 21.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.033 -178.94 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 830' ' ' VAL . . . . . 0.656 HG22 ' HB3' ' A' ' 854' ' ' ALA . 8.9 t -109.2 130.85 61.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.197 179.59 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 831' ' ' ASP . . . . . 0.757 ' HB2' ' NE ' ' A' ' 837' ' ' ARG . 8.6 t0 -135.97 146.01 46.79 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 175.036 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.49 -17.9 62.32 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.234 0.54 . . . . 0.0 109.802 173.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 7.6 m80 -108.25 103.43 50.51 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.393 175.247 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_exo -57.34 -48.85 15.73 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 123.123 2.548 . . . . 0.0 113.984 -173.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 835' ' ' ILE . . . . . 0.428 HD13 ' HA ' ' A' ' 835' ' ' ILE . 0.3 OUTLIER -63.94 -35.62 74.0 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-O 120.957 0.408 . . . . 0.0 110.185 -178.164 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 836' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -62.46 -49.02 77.09 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.62 177.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 837' ' ' ARG . . . . . 0.882 ' HD2' ' HB ' ' A' ' 829' ' ' VAL . 0.0 OUTLIER -60.27 -47.0 87.87 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.633 -178.915 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 838' ' ' ARG . . . . . 0.41 ' HG2' HD13 ' A' ' 835' ' ' ILE . 0.0 OUTLIER -63.79 -31.11 72.18 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 123.112 0.258 . . . . 0.0 111.144 -176.256 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.82 -47.43 21.48 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.388 -176.19 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 840' ' ' LEU . . . . . . . . . . . . . 2.6 pp -73.36 -26.1 60.87 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.537 178.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -67.61 -29.7 69.1 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 173.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -64.57 -43.34 94.2 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 174.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 843' ' ' GLN . . . . . 0.407 ' HB3' ' CD2' ' A' ' 929' ' ' LEU . 8.1 mm-40 -61.24 -41.23 96.53 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.413 175.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 844' ' ' LEU . . . . . 0.501 HD11 HD12 ' A' ' 932' ' ' ILE . 0.1 OUTLIER -58.88 -35.14 72.52 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.373 175.397 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -71.27 -35.22 63.83 Favored Glycine 0 N--CA 1.449 -0.468 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.053 177.072 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.62 -16.73 63.44 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 120.958 0.408 . . . . 0.0 110.431 176.715 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 24.3 mt -80.19 -12.42 59.64 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.588 176.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 92.4 19.8 37.28 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 121.018 -0.61 . . . . 0.0 112.784 178.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 31.1 m-85 -110.82 163.28 13.95 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.632 0.253 . . . . 0.0 110.611 -179.022 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.81 108.06 20.66 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.255 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -98.77 135.74 39.81 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.669 -178.08 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.71 128.06 55.6 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 173.537 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.66 131.86 40.0 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.291 0.567 . . . . 0.0 112.19 -173.237 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 854' ' ' ALA . . . . . 0.656 ' HB3' HG22 ' A' ' 830' ' ' VAL . . . -140.01 156.95 46.38 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.631 175.379 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 855' ' ' ASN . . . . . 0.579 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 0.1 OUTLIER -146.04 71.77 1.27 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.229 0.537 . . . . 0.0 111.667 -179.149 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 856' ' ' ASP . . . . . 0.579 ' HB2' ' O ' ' A' ' 855' ' ' ASN . 3.9 t70 162.96 174.52 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.209 1.004 . . . . 0.0 108.769 175.191 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 857' ' ' GLY . . . . . 0.401 ' HA3' ' HB2' ' A' ' 886' ' ' LEU . . . -83.93 -39.19 9.58 Favored Glycine 0 N--CA 1.446 -0.684 0 N-CA-C 110.878 -0.889 . . . . 0.0 110.878 175.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 858' ' ' VAL . . . . . 0.433 ' O ' ' HB2' ' A' ' 862' ' ' ASN . 6.7 m -73.41 -31.56 33.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.811 0.338 . . . . 0.0 110.297 177.488 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 859' ' ' ASP . . . . . 0.404 ' H ' ' HB3' ' A' ' 856' ' ' ASP . 25.5 t0 -65.59 -48.72 71.37 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.521 178.358 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -62.66 -42.42 99.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.411 -179.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 861' ' ' LEU . . . . . 0.578 HD21 ' HG ' ' A' ' 893' ' ' LEU . 56.3 tp -69.26 -38.19 78.29 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.877 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 862' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' A' ' 858' ' ' VAL . 33.7 t30 -57.83 -54.93 41.35 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.9 -179.29 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 8.1 p -63.09 -31.49 52.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.646 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 864' ' ' LEU . . . . . 0.522 HD11 HD21 ' A' ' 897' ' ' LEU . 0.6 OUTLIER -64.39 -36.69 84.96 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.02 178.673 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -76.3 -24.73 54.38 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.263 0.554 . . . . 0.0 110.255 179.627 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.44 -53.21 8.44 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.015 179.413 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -135.31 144.57 46.81 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.207 -175.786 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -70.4 138.24 51.13 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.184 0.516 . . . . 0.0 111.792 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 869' ' ' ILE . . . . . 0.623 HG21 ' HB2' ' A' ' 828' ' ' LEU . 5.6 mt -131.69 139.42 50.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 175.514 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -77.06 -59.39 2.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.863 0.363 . . . . 0.0 111.197 -173.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 871' ' ' ILE . . . . . 0.434 HG22 HG23 ' A' ' 827' ' ' ILE . 1.1 mp -117.95 130.46 72.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 CA-C-O 120.908 0.385 . . . . 0.0 110.141 -179.442 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 872' ' ' VAL . . . . . 0.637 HG22 ' HB3' ' A' ' 828' ' ' LEU . 53.8 t -123.42 125.11 71.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.21 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 873' ' ' LEU . . . . . 0.667 HD11 HG12 ' A' ' 829' ' ' VAL . 0.1 OUTLIER -118.74 131.63 56.13 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.9 0.381 . . . . 0.0 110.268 178.391 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -109.8 101.2 10.09 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.699 -178.125 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 875' ' ' ASP . . . . . 0.522 ' HB3' ' HE2' ' A' ' 925' ' ' LYS . 0.3 OUTLIER -90.48 118.15 29.73 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.466 -179.368 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -131.58 117.04 33.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-O 120.883 0.373 . . . . 0.0 111.229 179.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -62.61 -61.03 2.71 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 172.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.319 -0.749 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 168.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 0.204 0 CA-C-O 120.126 -0.264 . . . . 0.0 113.717 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -59.27 -28.89 67.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.5 0.667 . . . . 0.0 109.562 176.68 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 885' ' ' ARG . . . . . 0.478 ' HD2' ' N ' ' A' ' 886' ' ' LEU . 0.0 OUTLIER -61.02 -31.68 71.3 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.144 -0.934 . . . . 0.0 110.728 -179.275 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 886' ' ' LEU . . . . . 0.478 ' N ' ' HD2' ' A' ' 885' ' ' ARG . 0.0 OUTLIER -67.7 -47.63 68.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.748 0.308 . . . . 0.0 110.299 -178.768 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 887' ' ' THR . . . . . 0.427 ' N ' ' HG ' ' A' ' 886' ' ' LEU . 0.0 OUTLIER -69.53 -38.46 77.52 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.311 0.577 . . . . 0.0 110.655 -178.704 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -62.83 -51.29 67.6 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.745 177.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 889' ' ' ARG . . . . . 0.465 ' HB2' ' O ' ' A' ' 885' ' ' ARG . 0.0 OUTLIER -62.48 -42.78 99.72 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.988 -174.432 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 890' ' ' ILE . . . . . . . . . . . . . 1.4 tt -67.96 -41.27 84.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 120.857 -0.337 . . . . 0.0 111.411 -176.298 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 891' ' ' ARG . . . . . 0.649 ' HA ' HD23 ' A' ' 895' ' ' LEU . 0.1 OUTLIER -75.31 -27.03 59.14 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.675 0.274 . . . . 0.0 111.26 179.717 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 30.4 tp60 -77.63 -37.16 50.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.046 -179.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 893' ' ' LEU . . . . . 0.578 ' HG ' HD21 ' A' ' 861' ' ' LEU . 0.5 OUTLIER -73.97 -32.35 63.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.751 179.764 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 121.91 83.11 0.67 Allowed Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.877 176.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 895' ' ' LEU . . . . . 0.649 HD23 ' HA ' ' A' ' 891' ' ' ARG . 0.2 OUTLIER -89.09 135.99 33.26 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 110.236 -0.283 . . . . 0.0 110.236 178.035 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -131.48 26.5 4.76 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.919 0.39 . . . . 0.0 111.532 -177.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 897' ' ' LEU . . . . . 0.522 HD21 HD11 ' A' ' 864' ' ' LEU . 0.0 OUTLIER -145.56 154.65 52.8 Favored Pre-proline 0 C--N 1.323 -0.56 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.311 -175.784 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -63.67 110.6 1.3 Allowed 'Trans proline' 0 C--O 1.236 0.41 0 C-N-CA 122.72 2.28 . . . . 0.0 112.16 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 899' ' ' VAL . . . . . . . . . . . . . 26.7 t -100.95 112.94 35.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.44 0.638 . . . . 0.0 110.643 177.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 900' ' ' ILE . . . . . 0.674 HG23 ' HB2' ' A' ' 921' ' ' SER . 2.0 mt -90.45 106.63 17.55 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.812 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.303 179.512 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 901' ' ' GLY . . . . . 0.583 ' O ' ' HA ' ' A' ' 922' ' ' CYS . . . -85.91 119.09 5.01 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 120.755 -0.736 . . . . 0.0 111.511 178.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 902' ' ' VAL . . . . . 0.667 ' HB ' HD12 ' A' ' 923' ' ' LEU . 0.1 OUTLIER -124.12 119.5 56.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-O 121.084 0.468 . . . . 0.0 110.251 -178.203 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 903' ' ' THR . . . . . 0.445 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.0 OUTLIER -120.02 160.05 23.56 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.981 -176.193 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 904' ' ' ALA . . . . . 0.601 ' HA ' ' HB2' ' A' ' 925' ' ' LYS . . . -72.48 139.41 47.63 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 173.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -64.68 105.36 0.97 Allowed 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.091 0.472 . . . . 0.0 110.451 -177.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -117.99 -42.93 2.78 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.509 -0.769 . . . . 0.0 111.195 -174.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -158.76 -73.97 0.08 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.363 -176.136 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -161.58 55.22 0.27 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.308 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 909' ' ' GLU . . . . . 0.439 ' H ' ' HG3' ' A' ' 909' ' ' GLU . 0.0 OUTLIER -65.88 -29.84 70.34 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.456 -177.232 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 910' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.67 -37.49 76.13 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.537 174.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -67.77 -41.57 83.06 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.303 178.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -62.28 -37.14 84.35 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.405 177.414 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 913' ' ' ARG . . . . . 0.406 HH11 ' HD3' ' A' ' 913' ' ' ARG . 0.0 OUTLIER -66.17 -37.37 85.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.508 177.288 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 76.9 m -65.97 -33.54 76.05 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.321 176.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.97 -39.69 75.82 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.637 176.451 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -66.22 -52.02 51.93 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.138 -178.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 46.6 48.18 14.34 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -133.0 -33.41 0.37 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.937 176.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 919' ' ' MET . . . . . 0.537 ' O ' ' HB2' ' A' ' 920' ' ' ASP . 12.8 mtt -65.76 -80.96 0.03 OUTLIER 'General case' 0 C--O 1.236 0.394 0 CA-C-O 120.654 0.264 . . . . 0.0 111.386 179.254 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 920' ' ' ASP . . . . . 0.537 ' HB2' ' O ' ' A' ' 919' ' ' MET . 12.4 t70 168.54 -85.53 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.788 177.067 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . 0.674 ' HB2' HG23 ' A' ' 900' ' ' ILE . 0.0 OUTLIER -109.33 175.79 5.32 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.151 -173.562 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 922' ' ' CYS . . . . . 0.583 ' HA ' ' O ' ' A' ' 901' ' ' GLY . 0.0 OUTLIER -146.43 137.54 24.34 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 120.753 0.311 . . . . 0.0 111.501 -179.925 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 923' ' ' LEU . . . . . 0.667 HD12 ' HB ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -143.0 -175.81 4.66 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.846 175.387 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 924' ' ' SER . . . . . 0.609 ' HB3' ' HD2' ' A' ' 926' ' ' PRO . 0.5 OUTLIER -114.35 150.53 34.43 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.744 0.307 . . . . 0.0 110.776 -179.644 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 925' ' ' LYS . . . . . 0.601 ' HB2' ' HA ' ' A' ' 904' ' ' ALA . 0.0 OUTLIER -50.56 -40.29 59.5 Favored Pre-proline 0 CA--C 1.54 0.579 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 -175.515 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 926' ' ' PRO . . . . . 0.609 ' HD2' ' HB3' ' A' ' 924' ' ' SER . 40.8 Cg_exo -61.08 72.33 0.08 OUTLIER 'Trans proline' 0 C--N 1.361 1.187 0 C-N-CA 121.892 1.728 . . . . 0.0 113.286 174.503 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 927' ' ' VAL . . . . . 0.686 HG13 HG12 ' A' ' 931' ' ' VAL . 3.8 t -107.44 124.75 63.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.92 177.08 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 928' ' ' THR . . . . . 0.546 ' OG1' ' HB ' ' A' ' 931' ' ' VAL . 3.0 p -88.89 171.0 10.23 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.162 -179.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 929' ' ' LEU . . . . . 0.48 HD22 ' O ' ' A' ' 929' ' ' LEU . 1.3 tm? -63.47 -46.33 86.68 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.864 0.364 . . . . 0.0 110.087 176.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -63.76 -42.15 97.86 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.832 0.348 . . . . 0.0 110.858 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 931' ' ' VAL . . . . . 0.686 HG12 HG13 ' A' ' 927' ' ' VAL . 0.8 OUTLIER -68.37 -32.41 55.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.656 179.618 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 932' ' ' ILE . . . . . 0.638 ' O ' ' HB2' ' A' ' 936' ' ' LEU . 0.4 OUTLIER -64.68 -40.06 87.77 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.255 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 175.565 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 5.2 ttmt -66.17 -45.95 79.09 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.545 178.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -61.5 -53.81 51.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.24 -179.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 3.6 m -65.07 -39.35 93.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.189 -177.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 936' ' ' LEU . . . . . 0.638 ' HB2' ' O ' ' A' ' 932' ' ' ILE . 4.9 tp -60.85 -48.15 83.14 Favored 'General case' 0 C--O 1.223 -0.308 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.316 177.368 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 93.2 m -62.93 -41.58 99.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.169 -179.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.66 -46.89 87.67 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.105 0.478 . . . . 0.0 111.456 -179.362 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -78.51 -32.84 48.31 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.218 -177.443 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 940' ' ' ALA . . . . . 0.491 ' O ' ' HB2' ' A' ' 944' ' ' ARG . . . -66.94 -41.41 87.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.945 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 941' ' ' GLU . . . . . 0.569 ' HG3' ' N ' ' A' ' 942' ' ' ARG . 0.2 OUTLIER -66.94 -35.78 80.74 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.84 -0.429 . . . . 0.0 109.84 176.795 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 942' ' ' ARG . . . . . 0.569 ' N ' ' HG3' ' A' ' 941' ' ' GLU . 0.0 OUTLIER -60.23 -48.43 81.78 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.855 -179.764 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 13.7 m -76.11 -30.21 20.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.021 -179.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 944' ' ' ARG . . . . . 0.491 ' HB2' ' O ' ' A' ' 940' ' ' ALA . 0.0 OUTLIER -65.47 -41.26 93.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.178 179.67 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 945' ' ' LYS . . . . . 0.475 ' HG2' ' O ' ' A' ' 942' ' ' ARG . 4.4 pttt -71.9 -31.31 66.27 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.706 179.615 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 15.0 m -68.96 -35.51 76.84 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 120.879 0.371 . . . . 0.0 110.952 174.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 3.1 ttm180 -77.52 -19.89 55.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.531 178.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 15.3 t0 . . . . . 0 C--N 1.33 -0.244 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.129 177.847 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 705' ' ' SER . . . . . 0.411 ' HA ' ' O ' ' A' ' 730' ' ' GLY . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.267 0 CA-C-O 121.216 0.531 . . . . 0.0 110.854 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . -157.31 -0.66 0.1 OUTLIER Glycine 0 N--CA 1.445 -0.702 0 C-N-CA 120.295 -0.955 . . . . 0.0 113.428 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 707' ' ' LYS . . . . . 0.486 ' HG2' ' N ' ' A' ' 708' ' ' ARG . 0.0 OUTLIER -131.88 154.75 48.89 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 117.487 0.644 . . . . 0.0 110.039 179.699 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 708' ' ' ARG . . . . . 0.486 ' N ' ' HG2' ' A' ' 707' ' ' LYS . 0.0 OUTLIER -108.92 154.87 21.54 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.687 -175.18 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 709' ' ' CYS . . . . . 0.434 ' O ' ' HA ' ' A' ' 733' ' ' VAL . 74.6 m -142.73 143.93 32.45 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.773 175.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 710' ' ' TRP . . . . . 0.552 ' CZ3' ' HG3' ' A' ' 739' ' ' GLN . 86.0 m95 -111.36 143.79 41.6 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 120.939 0.4 . . . . 0.0 110.577 -179.868 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 711' ' ' LEU . . . . . 0.441 ' CD1' ' HB2' ' A' ' 719' ' ' CYS . 0.3 OUTLIER -133.51 132.86 41.47 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.46 0.648 . . . . 0.0 110.806 179.178 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -127.24 60.22 1.4 Allowed 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.326 176.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 713' ' ' VAL . . . . . 0.747 HG13 ' HB3' ' A' ' 750' ' ' ASP . 28.8 t -108.47 120.8 60.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.745 179.588 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 4.0 mtm180 -79.7 -27.47 40.72 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.06 -177.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -72.43 111.8 7.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.907 175.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 716' ' ' ALA . . . . . 0.547 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -66.42 -35.37 80.13 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.55 -174.197 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.78 -45.1 87.74 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.063 0.459 . . . . 0.0 110.631 178.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 718' ' ' LEU . . . . . 0.648 HD11 ' HA ' ' A' ' 786' ' ' ALA . 0.3 OUTLIER -71.03 -45.1 64.51 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.868 179.805 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 719' ' ' CYS . . . . . 0.547 ' SG ' ' HA ' ' A' ' 716' ' ' ALA . 2.4 p -65.5 -43.61 89.6 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.821 -177.011 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 720' ' ' GLN . . . . . 0.632 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 19.0 tp60 -63.3 -39.74 95.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.942 -179.589 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -55.91 -54.85 39.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.895 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 6.7 mt -68.17 -48.35 65.53 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.19 -178.28 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 723' ' ' GLU . . . . . 0.638 ' HB2' HG11 ' A' ' 733' ' ' VAL . 0.2 OUTLIER -64.07 -38.13 89.96 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.675 -173.439 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 724' ' ' THR . . . . . 0.566 ' N ' ' HG3' ' A' ' 723' ' ' GLU . 4.1 m -71.77 -40.27 69.38 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 120.601 0.239 . . . . 0.0 110.728 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 20.1 m -62.06 -38.57 89.27 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.465 178.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 726' ' ' LEU . . . . . 0.425 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 49.5 mt -67.55 -48.95 65.47 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.454 177.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -59.65 -27.28 66.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.233 -179.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 728' ' ' ARG . . . . . 0.406 ' HD3' HH11 ' A' ' 728' ' ' ARG . 0.1 OUTLIER -64.42 -24.57 67.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.542 -179.321 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 72.1 m -103.19 7.09 38.63 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.946 0.403 . . . . 0.0 111.23 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 730' ' ' GLY . . . . . 0.411 ' O ' ' HA ' ' A' ' 705' ' ' SER . . . 92.26 1.46 69.37 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.774 177.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 731' ' ' ILE . . . . . 0.425 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 11.9 mm -66.91 127.21 28.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 120.647 0.261 . . . . 0.0 110.33 177.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 732' ' ' VAL . . . . . 0.484 ' O ' ' HG2' ' A' ' 708' ' ' ARG . 0.7 OUTLIER -88.73 104.59 14.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.461 0.648 . . . . 0.0 109.856 179.888 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 733' ' ' VAL . . . . . 0.638 HG11 ' HB2' ' A' ' 723' ' ' GLU . 1.6 p -99.53 141.7 16.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.385 -179.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 734' ' ' THR . . . . . 0.447 ' HB ' ' CZ3' ' A' ' 710' ' ' TRP . 0.2 OUTLIER -136.93 138.49 40.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.493 178.974 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.6 136.18 52.63 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.418 176.137 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -78.49 79.98 4.9 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.224 -176.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -70.18 -79.36 0.06 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.768 177.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -151.77 61.0 0.4 Allowed Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 121.149 -0.548 . . . . 0.0 111.828 179.216 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 739' ' ' GLN . . . . . 0.552 ' HG3' ' CZ3' ' A' ' 710' ' ' TRP . 1.1 mm-40 -114.45 176.24 5.13 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.824 0.345 . . . . 0.0 110.557 -177.413 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 740' ' ' GLU . . . . . 0.449 ' HG3' ' HD2' ' A' ' 741' ' ' PRO . 0.8 OUTLIER -93.42 141.13 23.52 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.866 -179.683 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 741' ' ' PRO . . . . . 0.567 ' HA ' ' CZ3' ' A' ' 757' ' ' TRP . 15.7 Cg_endo -58.45 132.38 48.2 Favored 'Trans proline' 0 C--O 1.234 0.291 0 C-N-CA 123.014 2.476 . . . . 0.0 112.219 176.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 742' ' ' THR . . . . . 0.537 ' HB ' ' HB2' ' A' ' 745' ' ' ASP . 0.2 OUTLIER -105.92 131.8 21.43 Favored Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.611 179.631 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -66.12 -17.99 55.72 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 123.363 2.709 . . . . 0.0 113.391 -175.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -105.41 4.15 30.42 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.691 0.281 . . . . 0.0 110.531 178.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 745' ' ' ASP . . . . . 0.537 ' HB2' ' HB ' ' A' ' 742' ' ' THR . 14.0 m-20 -115.37 156.86 24.77 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.158 -174.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 29.4 m -119.97 148.11 23.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.922 -177.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 747' ' ' LEU . . . . . 0.556 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 0.0 OUTLIER -112.76 118.48 35.09 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.627 -0.261 . . . . 0.0 110.367 178.062 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 4.3 mt -104.47 107.24 21.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 173.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 1.5 t -117.42 163.8 15.83 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.59 0.233 . . . . 0.0 110.851 -175.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 750' ' ' ASP . . . . . 0.747 ' HB3' HG13 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -121.02 130.21 53.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.172 0.51 . . . . 0.0 110.902 -179.797 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 67.06 177.93 0.23 Allowed 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 114.656 -1.156 . . . . 0.0 111.297 -175.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 752' ' ' VAL . . . . . 0.607 HG22 HG12 ' A' ' 772' ' ' ILE . 69.9 t -80.68 91.82 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.411 0.624 . . . . 0.0 110.939 -176.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 2.0 t -86.9 -6.62 10.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.421 176.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 3.6 m 59.26 39.81 22.15 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.635 179.172 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.83 133.91 44.6 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.257 -0.428 . . . . 0.0 109.988 176.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 756' ' ' LYS . . . . . 0.498 ' HA ' ' HD2' ' A' ' 756' ' ' LYS . 4.9 mmmt -100.8 81.4 2.28 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.138 0.494 . . . . 0.0 110.326 -179.682 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 757' ' ' TRP . . . . . 0.567 ' CZ3' ' HA ' ' A' ' 741' ' ' PRO . 65.7 t-105 -75.96 95.5 3.58 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.378 178.628 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -94.6 59.83 2.51 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.336 0.588 . . . . 0.0 110.025 175.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 759' ' ' GLY . . . . . . . . . . . . . . . -108.07 -127.01 5.55 Favored Glycine 0 N--CA 1.446 -0.647 0 N-CA-C 111.187 -0.765 . . . . 0.0 111.187 176.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 32.0 ttt85 -77.47 -58.83 3.06 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.15 0.5 . . . . 0.0 109.83 175.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -156.64 152.95 27.78 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.525 -0.762 . . . . 0.0 109.749 179.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 762' ' ' VAL . . . . . 0.466 ' HB ' ' HB3' ' A' ' 757' ' ' TRP . 2.1 p -131.82 123.41 51.6 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-O 121.171 0.51 . . . . 0.0 110.421 178.359 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 763' ' ' VAL . . . . . 0.571 HG11 HD11 ' A' ' 791' ' ' LEU . 84.3 t -105.92 115.15 47.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.091 178.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 764' ' ' THR . . . . . 0.455 ' O ' ' HA ' ' A' ' 782' ' ' VAL . 9.2 m -106.99 110.87 23.12 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.175 -178.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 765' ' ' PHE . . . . . 0.499 ' HE1' HG23 ' A' ' 785' ' ' VAL . 40.5 m-85 -70.73 152.72 43.51 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 171.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 766' ' ' CYS . . . . . 0.469 ' SG ' ' HB ' ' A' ' 782' ' ' VAL . 0.0 OUTLIER -157.5 133.56 9.49 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 178.32 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 767' ' ' ARG . . . . . 0.417 ' HB2' ' HE ' ' A' ' 767' ' ' ARG . 0.0 OUTLIER -126.1 -8.97 6.51 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.775 177.105 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 768' ' ' ARG . . . . . 0.525 ' HA ' ' HD2' ' A' ' 768' ' ' ARG . 2.3 mmm-85 -122.45 -72.89 0.66 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.013 0.435 . . . . 0.0 110.983 179.441 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -103.29 129.94 50.42 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.222 -0.658 . . . . 0.0 109.222 -178.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 770' ' ' ILE . . . . . 0.469 ' O ' HG23 ' A' ' 770' ' ' ILE . 0.2 OUTLIER -114.65 12.51 8.02 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 CA-C-O 121.645 0.736 . . . . 0.0 111.328 -173.241 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -76.15 41.83 1.58 Allowed Glycine 0 CA--C 1.521 0.411 0 CA-C-N 115.542 -0.753 . . . . 0.0 113.291 -177.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 772' ' ' ILE . . . . . 0.607 HG12 HG22 ' A' ' 752' ' ' VAL . 1.1 mm -105.84 145.01 30.04 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 174.514 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 773' ' ' PRO . . . . . 0.498 ' HB2' ' HG2' ' A' ' 780' ' ' GLU . 54.3 Cg_exo -51.11 107.77 0.19 Allowed 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.165 1.91 . . . . 0.0 111.817 173.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . 0.61 ' HG ' ' HG2' ' A' ' 776' ' ' LYS . 0.5 OUTLIER -101.99 -155.37 0.52 Allowed 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.255 179.618 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 775' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 1.8 mp0 -66.35 10.0 0.14 Allowed 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -179.085 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 776' ' ' LYS . . . . . 0.61 ' HG2' ' HG ' ' A' ' 774' ' ' LEU . 8.9 ptpt -71.03 -18.32 62.58 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 166.272 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -121.06 136.23 25.49 Favored Pre-proline 0 N--CA 1.451 -0.421 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.325 174.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -65.28 111.82 1.91 Allowed 'Trans proline' 0 CA--C 1.529 0.24 0 C-N-CA 122.587 2.191 . . . . 0.0 112.59 -177.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 110.14 -8.66 31.21 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.907 -0.663 . . . . 0.0 112.024 179.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 780' ' ' GLU . . . . . 0.498 ' HG2' ' HB2' ' A' ' 773' ' ' PRO . 0.1 OUTLIER -107.59 134.76 50.12 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 179.954 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 30.4 m95 -135.79 148.73 48.87 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.245 -0.28 . . . . 0.0 110.245 -178.086 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . 0.469 ' HB ' ' SG ' ' A' ' 766' ' ' CYS . 19.3 m -132.1 165.23 32.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 168.215 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 783' ' ' HIS . . . . . 0.416 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.2 OUTLIER -171.29 134.16 0.88 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.973 0.416 . . . . 0.0 111.502 177.038 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 784' ' ' SER . . . . . 0.487 ' O ' HG13 ' A' ' 785' ' ' VAL . 0.0 OUTLIER -98.81 99.25 10.31 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.515 178.208 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 785' ' ' VAL . . . . . 0.499 HG23 ' HE1' ' A' ' 765' ' ' PHE . 0.0 OUTLIER -171.39 -179.3 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 C-N-CA 122.796 0.438 . . . . 0.0 110.17 178.816 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 786' ' ' ALA . . . . . 0.648 ' HA ' HD11 ' A' ' 718' ' ' LEU . . . -107.95 22.24 16.23 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.696 -0.683 . . . . 0.0 109.92 171.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 787' ' ' ALA . . . . . 0.407 ' HB2' ' CZ ' ' A' ' 765' ' ' PHE . . . 58.98 63.11 3.9 Favored Pre-proline 0 N--CA 1.468 0.43 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.973 -178.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 788' ' ' PRO . . . . . 0.459 ' HD3' ' HB ' ' A' ' 785' ' ' VAL . 24.3 Cg_exo -63.71 -53.46 1.32 Allowed 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.569 2.179 . . . . 0.0 112.844 -178.151 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 8.2 p-80 -172.13 25.71 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 790' ' ' GLU . . . . . 0.451 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -121.9 -46.81 2.2 Favored 'General case' 0 C--N 1.323 -0.578 0 O-C-N 122.034 -0.416 . . . . 0.0 111.091 -179.963 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 791' ' ' LEU . . . . . 0.571 HD11 HG11 ' A' ' 763' ' ' VAL . 0.5 OUTLIER -57.85 -54.61 53.59 Favored Pre-proline 0 CA--C 1.537 0.48 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -178.826 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 792' ' ' PRO . . . . . 0.406 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 12.7 Cg_endo -60.59 -26.74 83.51 Favored 'Trans proline' 0 C--N 1.355 0.915 0 C-N-CA 121.432 1.421 . . . . 0.0 112.019 178.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -70.43 -43.54 69.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.955 0.407 . . . . 0.0 110.264 177.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 794' ' ' LEU . . . . . 0.528 ' O ' ' HB ' ' A' ' 798' ' ' ILE . 0.1 OUTLIER -61.91 -37.82 86.08 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.332 177.537 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 795' ' ' LEU . . . . . 0.422 HD21 HG21 ' A' ' 763' ' ' VAL . 1.3 mm? -63.04 -49.9 72.78 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.156 0.503 . . . . 0.0 110.816 179.477 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -59.99 -48.33 82.16 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.185 -179.227 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 797' ' ' ARG . . . . . 0.446 ' HG2' ' HA ' ' A' ' 794' ' ' LEU . 0.3 OUTLIER -71.99 -20.83 61.66 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.667 -178.288 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 798' ' ' ILE . . . . . 0.528 ' HB ' ' O ' ' A' ' 794' ' ' LEU . 0.1 OUTLIER -72.01 -31.19 39.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.959 0.409 . . . . 0.0 110.247 178.442 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -85.37 -56.22 3.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.216 175.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 800' ' ' LEU . . . . . 0.432 ' HG ' ' HA ' ' A' ' 797' ' ' ARG . 4.8 mt . . . . . 0 N--CA 1.467 0.391 0 O-C-N 123.934 0.771 . . . . 0.0 112.562 178.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 824' ' ' ASP . . . . . 0.41 ' HB3' ' HE1' ' A' ' 849' ' ' TYR . 25.1 t70 . . . . . 0 CA--C 1.517 -0.315 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -106.78 124.57 49.8 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.457 173.092 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 826' ' ' MET . . . . . . . . . . . . . 2.9 ttt -96.64 113.26 24.81 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.456 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 827' ' ' ILE . . . . . 0.661 HD12 ' HB ' ' A' ' 871' ' ' ILE . 9.4 mm -113.13 134.46 55.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.281 -179.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 828' ' ' LEU . . . . . 0.908 HD23 HG12 ' A' ' 869' ' ' ILE . 0.3 OUTLIER -101.06 120.42 40.18 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.897 178.215 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -102.85 95.78 4.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.209 0.528 . . . . 0.0 110.088 178.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 830' ' ' VAL . . . . . 0.476 HG22 HD12 ' A' ' 828' ' ' LEU . 1.7 t -113.16 109.13 27.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.346 -177.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 831' ' ' ASP . . . . . 0.728 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 18.8 t70 -124.88 159.46 31.07 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 110.22 -0.289 . . . . 0.0 110.22 179.073 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 832' ' ' ASP . . . . . 0.697 ' HB3' ' HB3' ' A' ' 877' ' ' ASN . 35.0 t70 -75.0 -27.55 60.19 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.954 -176.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 6.6 m170 -120.47 111.32 34.96 Favored Pre-proline 0 C--N 1.326 -0.421 0 O-C-N 122.322 -0.236 . . . . 0.0 111.053 -174.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 834' ' ' PRO . . . . . 0.467 ' HA ' ' HD2' ' A' ' 837' ' ' ARG . 87.6 Cg_exo -43.59 -36.89 7.59 Favored 'Trans proline' 0 CA--C 1.532 0.407 0 C-N-CA 123.643 2.895 . . . . 0.0 114.369 -176.052 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 835' ' ' ILE . . . . . 0.512 ' O ' ' HG3' ' A' ' 838' ' ' ARG . 1.1 pp -66.13 -44.46 91.72 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 CA-C-O 120.888 0.375 . . . . 0.0 111.214 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 836' ' ' ASN . . . . . 0.503 HD22 ' CG ' ' A' ' 831' ' ' ASP . 42.5 t30 -72.14 -41.87 66.65 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 177.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 837' ' ' ARG . . . . . 0.728 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 0.1 OUTLIER -53.8 -46.07 70.97 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.733 -1.121 . . . . 0.0 111.437 179.044 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 838' ' ' ARG . . . . . 0.512 ' HG3' ' O ' ' A' ' 835' ' ' ILE . 0.0 OUTLIER -72.76 -29.05 63.0 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 121.0 -0.28 . . . . 0.0 110.88 179.265 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.34 -47.11 83.53 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.645 -0.252 . . . . 0.0 111.371 -178.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 840' ' ' LEU . . . . . 0.473 ' HG ' ' H ' ' A' ' 840' ' ' LEU . 0.0 OUTLIER -71.35 -32.72 68.86 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.952 0.406 . . . . 0.0 110.254 178.188 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -63.64 -33.98 76.83 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.327 0.584 . . . . 0.0 110.39 177.047 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -65.53 -44.63 86.33 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.396 177.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 843' ' ' GLN . . . . . 0.752 ' HG3' HD23 ' A' ' 929' ' ' LEU . 1.2 mp0 -64.75 -41.69 95.73 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.542 179.012 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 844' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.66 -31.82 72.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.419 175.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -61.8 -43.12 99.65 Favored Glycine 0 N--CA 1.451 -0.329 0 CA-C-N 115.771 -0.649 . . . . 0.0 112.301 176.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -31.48 72.7 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.849 0.356 . . . . 0.0 110.626 176.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 847' ' ' LEU . . . . . 0.403 ' HA ' HD23 ' A' ' 847' ' ' LEU . 14.8 mt -66.77 -32.65 74.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.63 177.584 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 87.65 27.55 26.67 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.639 177.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 849' ' ' TYR . . . . . 0.467 ' HD1' ' HA ' ' A' ' 849' ' ' TYR . 0.1 OUTLIER -114.45 167.11 11.0 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 122.804 -0.233 . . . . 0.0 110.674 -179.261 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -71.01 118.64 14.05 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.481 -175.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -123.54 107.82 11.96 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.456 179.287 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.58 119.4 35.0 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 177.048 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.13 110.19 21.22 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.074 0.464 . . . . 0.0 111.709 -171.201 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 854' ' ' ALA . . . . . 0.446 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -121.78 155.93 34.26 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.897 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -137.23 79.07 1.73 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.341 -177.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 856' ' ' ASP . . . . . 0.434 ' CG ' ' H ' ' A' ' 857' ' ' GLY . 7.5 t70 -175.61 -166.92 0.22 Allowed 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.1 177.074 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 857' ' ' GLY . . . . . 0.434 ' H ' ' CG ' ' A' ' 856' ' ' ASP . . . -124.14 -53.61 0.19 Allowed Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 121.226 -0.511 . . . . 0.0 111.907 178.796 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -71.7 -31.02 40.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.899 0.381 . . . . 0.0 110.757 -177.346 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.76 -19.91 65.16 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.973 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 860' ' ' ALA . . . . . 0.473 ' O ' ' HG ' ' A' ' 864' ' ' LEU . . . -64.73 -51.06 64.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.753 0.311 . . . . 0.0 110.203 176.077 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 861' ' ' LEU . . . . . 0.859 HD23 HG13 ' A' ' 890' ' ' ILE . 1.4 tm? -58.87 -39.78 82.4 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.375 0.607 . . . . 0.0 109.636 175.275 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 28.7 t30 -55.02 -42.31 72.45 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.027 177.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 863' ' ' VAL . . . . . 0.591 HG13 HD13 ' A' ' 869' ' ' ILE . 0.4 OUTLIER -71.16 -32.34 47.36 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.71 -177.497 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 864' ' ' LEU . . . . . 0.724 HD13 HD21 ' A' ' 897' ' ' LEU . 4.4 mt -68.02 -37.59 81.57 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.409 0.623 . . . . 0.0 110.5 178.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 1.4 m -78.92 -16.14 57.39 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.317 179.254 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 1.4 mtmm -81.53 -57.49 3.44 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.514 177.169 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -139.53 151.32 46.03 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.448 -178.339 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 80.3 t60 -78.24 105.52 9.53 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.286 0.565 . . . . 0.0 111.156 -177.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 869' ' ' ILE . . . . . 0.908 HG12 HD23 ' A' ' 828' ' ' LEU . 1.5 mp -93.86 146.24 6.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 171.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -84.06 -52.34 6.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.817 0.341 . . . . 0.0 110.884 -175.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 871' ' ' ILE . . . . . 0.661 ' HB ' HD12 ' A' ' 827' ' ' ILE . 12.9 mm -124.59 122.46 63.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.14 -179.237 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 872' ' ' VAL . . . . . 0.634 ' HB ' HG13 ' A' ' 899' ' ' VAL . 2.5 t -103.54 124.94 58.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.863 178.147 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 873' ' ' LEU . . . . . . . . . . . . . 67.7 mt -107.25 110.29 22.29 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 176.186 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -113.62 99.7 7.93 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.679 -179.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 875' ' ' ASP . . . . . 0.516 ' HA ' HG13 ' A' ' 902' ' ' VAL . 47.2 t0 -97.48 113.26 24.91 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.219 -178.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -103.86 103.53 15.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.868 -178.004 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 877' ' ' ASN . . . . . 0.697 ' HB3' ' HB3' ' A' ' 832' ' ' ASP . 0.4 OUTLIER -65.45 -42.6 92.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.623 178.129 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 10.1 ttp . . . . . 0 C--N 1.327 -0.409 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.942 -177.561 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.652 0 N-CA-C 111.504 -0.639 . . . . 0.0 111.504 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.63 -33.21 75.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.208 0.527 . . . . 0.0 109.754 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 885' ' ' ARG . . . . . 0.408 ' O ' ' HB2' ' A' ' 889' ' ' ARG . 0.6 OUTLIER -72.56 -31.33 65.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.528 176.919 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.59 -51.05 62.67 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.808 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 887' ' ' THR . . . . . 0.651 HG21 ' HB2' ' A' ' 916' ' ' GLU . 44.4 m -63.52 -41.48 98.48 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.037 0.446 . . . . 0.0 111.007 178.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 888' ' ' GLN . . . . . 0.478 ' O ' ' HB2' ' A' ' 892' ' ' GLN . 1.5 tp60 -63.2 -41.7 99.2 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.765 178.757 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 889' ' ' ARG . . . . . 0.408 ' HB2' ' O ' ' A' ' 885' ' ' ARG . 0.0 OUTLIER -66.09 -43.39 87.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.264 -178.227 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 890' ' ' ILE . . . . . 0.859 HG13 HD23 ' A' ' 861' ' ' LEU . 13.0 tt -66.37 -41.1 88.28 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.502 -176.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 891' ' ' ARG . . . . . 0.433 ' HG3' ' N ' ' A' ' 892' ' ' GLN . 0.2 OUTLIER -75.4 -29.09 59.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.541 0.21 . . . . 0.0 111.153 179.413 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 892' ' ' GLN . . . . . 0.478 ' HB2' ' O ' ' A' ' 888' ' ' GLN . 1.2 tp60 -73.31 -50.36 22.53 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 120.83 0.348 . . . . 0.0 111.389 -177.545 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.12 -38.16 78.73 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.725 -177.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 121.95 82.39 0.64 Allowed Glycine 0 N--CA 1.445 -0.752 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.656 177.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 895' ' ' LEU . . . . . 0.571 ' HG ' ' O ' ' A' ' 895' ' ' LEU . 0.1 OUTLIER -59.73 130.85 48.84 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 175.793 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -117.96 13.27 13.94 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.57 0.582 . . . . 0.0 112.57 -171.547 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 897' ' ' LEU . . . . . 0.724 HD21 HD13 ' A' ' 864' ' ' LEU . 0.0 OUTLIER -157.31 166.52 16.44 Favored Pre-proline 0 C--N 1.321 -0.645 0 CA-C-N 116.616 -0.266 . . . . 0.0 111.331 -174.38 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_exo -71.06 108.55 2.35 Favored 'Trans proline' 0 C--O 1.239 0.545 0 C-N-CA 122.492 2.128 . . . . 0.0 111.622 173.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 899' ' ' VAL . . . . . 0.634 HG13 ' HB ' ' A' ' 872' ' ' VAL . 2.4 t -97.54 121.32 47.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.868 176.539 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 900' ' ' ILE . . . . . . . . . . . . . 2.7 mp -103.48 106.27 19.87 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-O 121.242 0.544 . . . . 0.0 109.987 178.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -94.61 97.73 2.2 Favored Glycine 0 N--CA 1.443 -0.897 0 CA-C-N 115.458 -0.792 . . . . 0.0 112.203 -178.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 902' ' ' VAL . . . . . 0.516 HG13 ' HA ' ' A' ' 875' ' ' ASP . 0.2 OUTLIER -79.86 123.77 37.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 175.098 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -118.68 143.73 46.66 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.015 0.436 . . . . 0.0 111.094 -174.111 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 904' ' ' ALA . . . . . 0.548 ' HA ' ' HB2' ' A' ' 925' ' ' LYS . . . -82.22 119.23 23.82 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.198 178.7 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 62.8 56.68 1.87 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.985 174.412 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 906' ' ' ALA . . . . . 0.541 ' HB3' ' HG3' ' A' ' 909' ' ' GLU . . . -107.46 -39.08 5.75 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.232 174.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 72.48 -65.68 0.34 Allowed 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.797 177.673 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -82.86 53.93 2.56 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.077 0.465 . . . . 0.0 109.791 176.328 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 909' ' ' GLU . . . . . 0.541 ' HG3' ' HB3' ' A' ' 906' ' ' ALA . 3.4 mp0 -62.63 -35.24 78.95 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.928 -177.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 910' ' ' GLU . . . . . 0.476 ' H ' ' HG3' ' A' ' 910' ' ' GLU . 0.0 OUTLIER -62.62 -45.29 93.53 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.421 0.629 . . . . 0.0 110.194 176.289 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 1.1 tttt -63.69 -37.21 86.49 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.489 177.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 18.6 tt0 -60.57 -42.58 96.95 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.471 177.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.88 -40.34 76.03 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.563 178.542 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 3.9 m -75.58 -31.16 59.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.037 179.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.73 -52.73 18.98 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.664 -175.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 916' ' ' GLU . . . . . 0.651 ' HB2' HG21 ' A' ' 887' ' ' THR . 0.2 OUTLIER -79.23 -44.68 21.33 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.457 -177.341 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 67.4 m 50.72 45.4 27.12 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 123.257 0.348 . . . . 0.0 111.852 -176.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 918' ' ' GLY . . . . . 0.407 ' H ' ' CD ' ' A' ' 916' ' ' GLU . . . -122.23 -33.56 0.89 Allowed Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.561 -0.828 . . . . 0.0 112.133 -179.706 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 919' ' ' MET . . . . . 0.61 ' HB3' ' HB ' ' A' ' 899' ' ' VAL . 5.4 mmt -90.9 -71.82 0.61 Allowed 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 176.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 920' ' ' ASP . . . . . 0.449 ' HB2' ' O ' ' A' ' 919' ' ' MET . 13.6 t70 158.59 -67.34 0.0 OUTLIER 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 114.399 -1.273 . . . . 0.0 108.959 175.135 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -118.9 167.71 11.46 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.26 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 922' ' ' CYS . . . . . 0.535 ' HB2' ' O ' ' A' ' 909' ' ' GLU . 85.0 m -143.47 133.71 24.51 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.225 -0.443 . . . . 0.0 109.985 177.221 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 923' ' ' LEU . . . . . . . . . . . . . 56.0 mt -120.93 169.4 10.5 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.9 -178.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 924' ' ' SER . . . . . 0.435 ' O ' HG23 ' A' ' 927' ' ' VAL . 0.7 OUTLIER -84.66 150.4 25.17 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.4 177.066 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 925' ' ' LYS . . . . . 0.548 ' HB2' ' HA ' ' A' ' 904' ' ' ALA . 0.0 OUTLIER -58.38 -40.82 85.69 Favored Pre-proline 0 CA--C 1.541 0.621 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -179.432 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -64.8 73.83 0.22 Allowed 'Trans proline' 0 C--N 1.357 0.999 0 C-N-CA 122.102 1.868 . . . . 0.0 112.757 173.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 927' ' ' VAL . . . . . 0.435 HG23 ' O ' ' A' ' 924' ' ' SER . 8.9 t -100.94 114.54 40.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 121.12 0.486 . . . . 0.0 109.828 174.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.53 177.46 7.74 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.251 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 929' ' ' LEU . . . . . 0.752 HD23 ' HG3' ' A' ' 843' ' ' GLN . 1.6 tm? -57.82 -45.45 86.15 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.804 0.335 . . . . 0.0 110.401 177.723 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 930' ' ' ASP . . . . . 0.443 ' O ' ' HG2' ' A' ' 934' ' ' GLN . 3.4 t0 -66.5 -40.65 89.37 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.665 -178.452 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 50.8 t -64.7 -47.9 86.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.868 -179.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 932' ' ' ILE . . . . . 0.407 HG22 ' O ' ' A' ' 929' ' ' LEU . 0.0 OUTLIER -64.95 -31.97 56.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.936 0.398 . . . . 0.0 110.09 178.673 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 4.8 ttmt -65.74 -48.31 72.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.242 177.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 934' ' ' GLN . . . . . 0.459 ' O ' ' HB3' ' A' ' 938' ' ' LEU . 56.5 mm-40 -60.54 -48.77 80.29 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.447 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 13.4 m -59.62 -51.85 68.06 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.371 -178.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 936' ' ' LEU . . . . . 0.466 HD11 HG13 ' A' ' 827' ' ' ILE . 0.3 OUTLIER -63.65 -47.19 82.28 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.208 -177.76 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 32.3 m -63.53 -50.29 70.15 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -178.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 938' ' ' LEU . . . . . 0.459 ' HB3' ' O ' ' A' ' 934' ' ' GLN . 0.0 OUTLIER -66.32 -36.33 82.66 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.466 -0.333 . . . . 0.0 111.232 -175.832 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -76.03 -37.66 58.11 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.843 -0.343 . . . . 0.0 111.03 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -65.07 -37.77 88.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.947 0.403 . . . . 0.0 110.713 178.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 941' ' ' GLU . . . . . 0.649 ' O ' ' HG2' ' A' ' 945' ' ' LYS . 2.2 pt-20 -75.76 -29.01 58.69 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.678 -0.409 . . . . 0.0 110.52 177.385 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 942' ' ' ARG . . . . . . . . . . . . . 1.4 tpt85 -66.59 -47.49 72.56 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.567 179.09 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 27.9 m -67.24 -29.16 44.96 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 121.283 0.563 . . . . 0.0 109.861 176.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.91 -24.93 66.15 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.804 175.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 945' ' ' LYS . . . . . 0.649 ' HG2' ' O ' ' A' ' 941' ' ' GLU . 9.6 mmtt -73.87 -43.63 58.0 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 120.855 0.36 . . . . 0.0 110.183 176.821 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.32 -30.89 71.92 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.743 177.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.39 -19.31 46.6 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.248 174.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 29.6 t70 . . . . . 0 C--N 1.33 -0.267 0 CA-C-N 114.957 -1.02 . . . . 0.0 111.538 177.914 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 3.3 m . . . . . 0 N--CA 1.454 -0.245 0 CA-C-O 120.908 0.385 . . . . 0.0 111.368 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 106.75 -12.71 42.18 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.76 175.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -75.48 132.0 40.49 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 174.618 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 708' ' ' ARG . . . . . 0.726 ' HG3' ' HB ' ' A' ' 732' ' ' VAL . 2.8 ttt180 -97.3 152.78 18.55 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.19 0.519 . . . . 0.0 111.445 -171.586 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -130.18 117.84 20.51 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.947 176.502 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 710' ' ' TRP . . . . . 0.469 ' O ' HD23 ' A' ' 747' ' ' LEU . 47.2 m95 -94.82 120.19 34.65 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.56 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 711' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -122.36 132.38 54.35 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.393 0.616 . . . . 0.0 111.199 -177.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -125.76 70.4 1.2 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.422 176.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 713' ' ' VAL . . . . . 0.643 HG13 ' HB3' ' A' ' 750' ' ' ASP . 60.8 t -128.15 120.58 53.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.114 -0.948 . . . . 0.0 109.952 -176.727 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 714' ' ' ARG . . . . . 0.572 ' HD2' ' OD2' ' A' ' 750' ' ' ASP . 0.3 OUTLIER -91.94 -8.99 44.71 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.385 -175.734 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -83.23 113.65 20.82 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 176.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 716' ' ' ALA . . . . . 0.402 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -58.0 -43.95 86.93 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.49 -173.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.34 -45.66 86.89 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.009 0.433 . . . . 0.0 110.331 -179.171 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.15 -50.55 60.8 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.235 -179.396 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 719' ' ' CYS . . . . . 0.402 ' SG ' ' HA ' ' A' ' 716' ' ' ALA . 13.9 p -67.13 -44.9 78.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.221 -174.446 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 720' ' ' GLN . . . . . 0.631 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 0.3 OUTLIER -65.51 -37.87 88.04 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 121.002 -0.279 . . . . 0.0 111.173 -177.016 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 39.2 t80 -60.59 -48.16 83.02 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 121.013 -0.275 . . . . 0.0 110.692 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 722' ' ' LEU . . . . . 0.418 HD13 HG21 ' A' ' 748' ' ' ILE . 15.9 mt -66.16 -48.78 69.62 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.628 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 723' ' ' GLU . . . . . 0.887 ' HB2' HG11 ' A' ' 733' ' ' VAL . 8.7 pt-20 -61.88 -37.49 84.75 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.721 -175.181 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 724' ' ' THR . . . . . 0.541 ' HA ' ' HG2' ' A' ' 727' ' ' GLN . 26.2 m -68.96 -38.23 79.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.92 0.391 . . . . 0.0 110.797 179.226 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 24.3 m -70.71 -28.41 64.71 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.11 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 726' ' ' LEU . . . . . . . . . . . . . 18.3 mt -80.14 -44.21 20.3 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.98 0.419 . . . . 0.0 110.747 179.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 727' ' ' GLN . . . . . 0.541 ' HG2' ' HA ' ' A' ' 724' ' ' THR . 12.2 pt20 -72.03 -7.89 51.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.957 0.408 . . . . 0.0 110.705 178.183 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.74 -29.06 70.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.922 178.104 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 2.1 p -104.66 -88.55 0.43 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.065 0.459 . . . . 0.0 110.553 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 730' ' ' GLY . . . . . . . . . . . . . . . -158.05 19.68 0.35 Allowed Glycine 0 N--CA 1.445 -0.751 0 N-CA-C 111.343 -0.703 . . . . 0.0 111.343 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 731' ' ' ILE . . . . . . . . . . . . . 35.0 mm -79.35 128.09 38.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 120.886 0.374 . . . . 0.0 110.601 -179.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 732' ' ' VAL . . . . . 0.726 ' HB ' ' HG3' ' A' ' 708' ' ' ARG . 0.1 OUTLIER -79.15 89.26 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.554 -179.525 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 733' ' ' VAL . . . . . 0.887 HG11 ' HB2' ' A' ' 723' ' ' GLU . 94.7 t -66.09 114.43 3.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.015 176.416 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -130.13 133.41 46.62 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.15 0.5 . . . . 0.0 110.862 -178.703 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.8 124.15 20.74 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.926 178.532 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -85.09 96.29 9.39 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.296 0.57 . . . . 0.0 110.556 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -107.95 -10.81 15.45 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.299 178.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 148.27 57.1 0.01 OUTLIER Glycine 0 CA--C 1.51 -0.25 0 N-CA-C 111.199 -0.76 . . . . 0.0 111.199 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 17.2 mp0 -106.81 173.99 6.08 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.953 0.406 . . . . 0.0 111.59 -173.069 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 740' ' ' GLU . . . . . 0.434 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 6.2 mm-40 -75.38 141.52 73.6 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.557 -177.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 741' ' ' PRO . . . . . 0.589 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 1.9 Cg_endo -84.72 123.52 2.88 Favored 'Trans proline' 0 N--CA 1.455 -0.744 0 C-N-CA 123.108 2.539 . . . . 0.0 112.415 176.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 742' ' ' THR . . . . . 0.497 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.0 OUTLIER -111.95 138.26 21.62 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.468 177.564 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 743' ' ' PRO . . . . . 0.497 ' HD2' HG22 ' A' ' 742' ' ' THR . 40.5 Cg_endo -67.12 -6.65 16.63 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 123.166 2.578 . . . . 0.0 113.916 -175.236 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -109.13 1.12 20.16 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.8 0.333 . . . . 0.0 110.895 178.044 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 82.7 m-20 -117.01 157.51 25.69 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-N 116.279 -0.419 . . . . 0.0 109.979 -175.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 746' ' ' VAL . . . . . 0.423 HG21 HD11 ' A' ' 795' ' ' LEU . 0.8 OUTLIER -123.6 149.08 27.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 120.915 0.388 . . . . 0.0 111.156 -177.809 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 747' ' ' LEU . . . . . 0.469 HD23 ' O ' ' A' ' 710' ' ' TRP . 0.0 OUTLIER -105.82 112.56 25.68 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.877 176.191 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 748' ' ' ILE . . . . . 0.418 HG21 HD13 ' A' ' 722' ' ' LEU . 17.9 mt -98.88 114.19 35.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 176.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 34.8 p -115.01 148.99 38.14 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.685 0.279 . . . . 0.0 111.253 -174.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 750' ' ' ASP . . . . . 0.643 ' HB3' HG13 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -98.82 123.28 42.97 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 171.303 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 751' ' ' GLU . . . . . 0.478 ' HB3' ' H ' ' A' ' 752' ' ' VAL . 10.2 mm-40 57.89 -156.48 0.32 Allowed 'General case' 0 C--O 1.236 0.361 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.356 -175.419 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 752' ' ' VAL . . . . . 0.67 HG22 ' H ' ' A' ' 771' ' ' GLY . 4.9 t -87.55 141.06 14.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 121.103 0.478 . . . . 0.0 111.422 -174.251 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 15.6 m -125.29 160.54 30.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.908 177.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -84.66 56.56 3.92 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.948 0.404 . . . . 0.0 110.9 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.72 176.3 12.14 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.415 179.304 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.53 -39.24 2.03 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.411 -179.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 757' ' ' TRP . . . . . 0.589 ' CH2' ' HA ' ' A' ' 741' ' ' PRO . 76.0 t-105 70.46 158.88 0.19 Allowed 'General case' 0 CA--C 1.537 0.462 0 O-C-N 123.702 0.626 . . . . 0.0 111.576 177.701 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -134.15 -85.45 0.42 Allowed 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 172.175 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 759' ' ' GLY . . . . . . . . . . . . . . . 50.25 -136.44 26.03 Favored Glycine 0 C--N 1.334 0.452 0 CA-C-N 116.394 -0.366 . . . . 0.0 112.946 176.289 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 30.7 ttm-85 -85.29 -50.58 7.23 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.241 0.543 . . . . 0.0 109.587 172.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -166.54 158.85 13.8 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.028 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 762' ' ' VAL . . . . . 0.494 ' HB ' ' CD1' ' A' ' 757' ' ' TRP . 2.4 p -120.41 128.09 75.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 174.334 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 763' ' ' VAL . . . . . 0.732 HG11 HD21 ' A' ' 791' ' ' LEU . 11.9 t -112.06 104.71 17.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 121.085 0.469 . . . . 0.0 110.273 -178.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 764' ' ' THR . . . . . . . . . . . . . 36.7 m -98.38 125.25 43.45 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.043 -179.088 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 765' ' ' PHE . . . . . 0.441 ' CE2' HG23 ' A' ' 785' ' ' VAL . 14.8 m-85 -83.12 112.99 20.32 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.661 175.275 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -95.1 133.03 39.36 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.161 -178.172 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 767' ' ' ARG . . . . . 0.513 ' HA ' ' HD2' ' A' ' 767' ' ' ARG . 13.6 mmm-85 -118.55 -48.37 2.5 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.731 0.301 . . . . 0.0 110.233 178.153 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.41 -19.13 1.25 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.941 -178.04 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -138.09 144.3 40.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.921 0.391 . . . . 0.0 111.013 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 16.2 mt -124.25 87.59 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.573 -178.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 771' ' ' GLY . . . . . 0.67 ' H ' HG22 ' A' ' 752' ' ' VAL . . . -85.7 -33.88 14.93 Favored Glycine 0 N--CA 1.45 -0.378 0 N-CA-C 111.207 -0.757 . . . . 0.0 111.207 175.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 772' ' ' ILE . . . . . 0.439 ' HA ' ' HD3' ' A' ' 773' ' ' PRO . 0.9 OUTLIER -98.5 116.17 65.54 Favored Pre-proline 0 C--N 1.322 -0.596 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 173.118 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 773' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 772' ' ' ILE . 6.0 Cg_exo -77.51 -177.98 4.25 Favored 'Trans proline' 0 N--CA 1.461 -0.439 0 C-N-CA 123.101 2.534 . . . . 0.0 113.41 -174.432 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . 0.524 ' H ' HD23 ' A' ' 774' ' ' LEU . 1.7 pt? -88.06 -161.2 0.7 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.464 179.374 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 775' ' ' GLU . . . . . 0.502 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 9.8 mp0 -65.37 62.95 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 113.632 0.975 . . . . 0.0 113.632 -176.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 776' ' ' LYS . . . . . 0.427 ' HD3' ' CB ' ' A' ' 773' ' ' PRO . 0.1 OUTLIER -108.42 0.85 21.3 Favored 'General case' 0 C--N 1.309 -1.171 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 168.963 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 777' ' ' ALA . . . . . 0.685 ' HB1' ' HD2' ' A' ' 778' ' ' PRO . . . -132.17 164.55 42.41 Favored Pre-proline 0 N--CA 1.447 -0.601 0 CA-C-N 113.833 -1.53 . . . . 0.0 108.435 177.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 778' ' ' PRO . . . . . 0.685 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 14.0 Cg_endo -55.91 -17.96 20.59 Favored 'Trans proline' 0 CA--C 1.534 0.476 0 C-N-CA 123.087 2.525 . . . . 0.0 114.577 -173.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . -158.54 34.57 0.5 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 119.71 -1.234 . . . . 0.0 113.397 -177.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 780' ' ' GLU . . . . . 0.54 ' HB2' ' HB3' ' A' ' 777' ' ' ALA . 0.1 OUTLIER -97.99 122.66 41.38 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.95 0.375 . . . . 0.0 110.043 178.622 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 16.4 m95 -131.46 146.71 52.37 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.521 -178.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 4.8 m -139.18 153.89 24.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.553 176.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 783' ' ' HIS . . . . . 0.41 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.9 OUTLIER -155.66 127.5 7.46 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.979 0.419 . . . . 0.0 110.688 173.056 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -95.0 99.93 11.86 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.633 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 785' ' ' VAL . . . . . 0.45 ' HB ' ' HD3' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -166.96 -173.57 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.931 179.629 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -124.39 48.19 1.98 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.904 0.383 . . . . 0.0 110.658 175.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 787' ' ' ALA . . . . . 0.406 ' N ' ' HD3' ' A' ' 788' ' ' PRO . . . 54.05 66.17 4.63 Favored Pre-proline 0 N--CA 1.467 0.386 0 CA-C-N 115.248 -0.887 . . . . 0.0 112.547 178.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 788' ' ' PRO . . . . . 0.775 ' HD2' ' OE1' ' A' ' 790' ' ' GLU . 17.0 Cg_exo -68.75 -61.75 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.655 2.236 . . . . 0.0 111.673 175.653 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 789' ' ' HIS . . . . . 0.501 ' HB3' ' O ' ' A' ' 788' ' ' PRO . 0.1 OUTLIER 175.79 10.47 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 O-C-N 123.32 0.388 . . . . 0.0 111.881 178.235 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 790' ' ' GLU . . . . . 0.775 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -93.77 -41.95 9.4 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.812 0.339 . . . . 0.0 110.6 -175.724 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 791' ' ' LEU . . . . . 0.732 HD21 HG11 ' A' ' 763' ' ' VAL . 0.2 OUTLIER -62.86 -49.17 83.29 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.667 -179.976 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 792' ' ' PRO . . . . . 0.524 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 10.7 Cg_endo -56.12 -30.94 81.35 Favored 'Trans proline' 0 C--N 1.354 0.864 0 C-N-CA 121.8 1.667 . . . . 0.0 112.042 175.402 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -72.91 -44.72 60.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.772 178.097 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -61.68 -38.18 86.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.181 177.05 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 795' ' ' LEU . . . . . 0.423 HD11 HG21 ' A' ' 746' ' ' VAL . 0.4 OUTLIER -66.68 -42.65 86.19 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.886 -179.774 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -63.85 -38.34 90.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.117 0.484 . . . . 0.0 110.481 176.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.17 -44.6 87.98 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.74 178.239 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -69.05 -22.15 25.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.525 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.741 -176.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -85.3 0.35 52.29 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.03 0.443 . . . . 0.0 110.126 176.33 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 6.6 mt . . . . . 0 N--CA 1.462 0.14 0 CA-C-N 114.847 -1.069 . . . . 0.0 112.521 171.861 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 32.5 t70 . . . . . 0 C--O 1.232 0.152 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -116.68 120.36 38.37 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.834 178.27 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 826' ' ' MET . . . . . 0.482 ' O ' HG22 ' A' ' 869' ' ' ILE . 18.9 ttm -95.13 118.58 32.17 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.349 0.595 . . . . 0.0 112.193 -172.163 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 827' ' ' ILE . . . . . 0.98 ' HB ' HD21 ' A' ' 844' ' ' LEU . 2.5 mm -115.9 135.82 54.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.779 177.404 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 828' ' ' LEU . . . . . 0.467 HD23 HG13 ' A' ' 872' ' ' VAL . 2.7 tp -117.28 128.99 55.61 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.111 0.481 . . . . 0.0 111.094 -177.698 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 829' ' ' VAL . . . . . 0.675 HG12 HD11 ' A' ' 873' ' ' LEU . 0.0 OUTLIER -110.1 110.38 31.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.269 179.511 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 830' ' ' VAL . . . . . 0.709 HG13 ' HB3' ' A' ' 854' ' ' ALA . 0.0 OUTLIER -113.07 101.63 12.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.594 -179.261 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 831' ' ' ASP . . . . . 0.711 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 5.7 t70 -104.76 157.18 17.38 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 110.089 -0.337 . . . . 0.0 110.089 178.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -90.06 -21.42 22.33 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.053 177.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 833' ' ' HIS . . . . . 0.404 ' HA ' ' HD3' ' A' ' 834' ' ' PRO . 25.7 m170 -111.79 123.04 35.57 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.592 -178.42 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 834' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 833' ' ' HIS . 66.3 Cg_exo -52.25 -44.72 44.3 Favored 'Trans proline' 0 C--O 1.237 0.446 0 C-N-CA 123.666 2.911 . . . . 0.0 114.191 -173.499 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -71.87 -40.14 68.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.637 0.256 . . . . 0.0 111.082 -176.119 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 836' ' ' ASN . . . . . 0.423 ' CG ' ' HE3' ' A' ' 925' ' ' LYS . 5.1 t30 -68.31 -37.04 80.21 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 178.134 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 837' ' ' ARG . . . . . 0.711 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 4.3 ttp85 -54.12 -44.09 71.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.736 176.2 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 838' ' ' ARG . . . . . 0.454 ' HD2' ' O ' ' A' ' 838' ' ' ARG . 0.0 OUTLIER -65.26 -37.66 87.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.217 178.676 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 839' ' ' LEU . . . . . 0.441 ' HG ' ' NE2' ' A' ' 843' ' ' GLN . 9.2 tp -61.1 -49.8 75.84 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.645 -176.588 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 840' ' ' LEU . . . . . 0.524 HD11 ' HB2' ' A' ' 831' ' ' ASP . 0.0 OUTLIER -70.32 -35.57 73.73 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.778 179.564 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -62.79 -39.51 94.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.109 0.48 . . . . 0.0 110.772 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -70.23 -42.62 72.0 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.562 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 843' ' ' GLN . . . . . 0.94 ' HG2' HD12 ' A' ' 929' ' ' LEU . 20.8 mt-30 -55.98 -49.51 73.4 Favored 'General case' 0 C--O 1.23 0.078 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.363 176.321 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 844' ' ' LEU . . . . . 0.98 HD21 ' HB ' ' A' ' 827' ' ' ILE . 0.2 OUTLIER -59.65 -40.38 87.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.018 178.329 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -68.07 -24.05 74.56 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 121.069 -0.586 . . . . 0.0 112.502 179.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 5.4 m -86.31 -25.94 25.18 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.911 0.386 . . . . 0.0 110.591 178.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 847' ' ' LEU . . . . . 0.577 HD21 ' HA ' ' A' ' 933' ' ' LYS . 0.2 OUTLIER -67.54 -31.76 72.07 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.87 179.209 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 96.76 52.04 1.58 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.473 178.444 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 54.0 m-85 -133.65 174.56 10.31 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 178.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.4 107.89 13.57 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 175.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -97.57 129.85 44.67 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.618 -174.268 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 852' ' ' LYS . . . . . 0.468 ' HE2' ' SD ' ' A' ' 826' ' ' MET . 1.5 mptt -125.11 122.7 37.9 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 171.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 853' ' ' THR . . . . . 0.533 HG23 HG23 ' A' ' 829' ' ' VAL . 0.2 OUTLIER -110.6 144.28 39.72 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.911 0.386 . . . . 0.0 111.905 -175.083 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 854' ' ' ALA . . . . . 0.709 ' HB3' HG13 ' A' ' 830' ' ' VAL . . . -148.51 151.25 34.81 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.705 174.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 855' ' ' ASN . . . . . 0.474 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 1.1 t30 -130.69 74.56 1.6 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.318 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 856' ' ' ASP . . . . . 0.624 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 24.2 t0 171.26 146.65 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.34 0 O-C-N 123.595 0.559 . . . . 0.0 110.467 -178.554 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -75.3 -35.16 49.14 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.622 -0.799 . . . . 0.0 111.278 175.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 858' ' ' VAL . . . . . 0.407 ' H ' HG23 ' A' ' 858' ' ' VAL . 0.6 OUTLIER -68.65 -34.58 65.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 120.95 0.405 . . . . 0.0 110.415 178.077 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 859' ' ' ASP . . . . . 0.624 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 1.2 t70 -71.1 -30.11 66.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.455 179.36 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 860' ' ' ALA . . . . . 0.641 ' HB2' HG11 ' A' ' 830' ' ' VAL . . . -64.5 -39.15 93.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.337 176.169 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 861' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.79 -40.23 83.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.181 175.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -59.53 -52.95 63.38 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.952 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 7.6 p -65.06 -31.36 53.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.04 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 864' ' ' LEU . . . . . 0.732 HD21 HD11 ' A' ' 897' ' ' LEU . 0.2 OUTLIER -65.48 -32.9 74.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.905 0.383 . . . . 0.0 111.319 179.167 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 865' ' ' SER . . . . . 0.427 ' HB3' HD11 ' A' ' 893' ' ' LEU . 0.1 OUTLIER -88.59 -16.83 31.49 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.924 0.392 . . . . 0.0 111.04 -178.198 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.03 -27.81 15.43 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.794 -177.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -146.02 158.2 43.87 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.691 0.281 . . . . 0.0 110.811 -175.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -90.31 -28.27 18.87 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 176.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 869' ' ' ILE . . . . . 0.482 HG22 ' O ' ' A' ' 826' ' ' MET . 2.3 mt 56.93 -136.52 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.528 0.135 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 -177.537 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 870' ' ' ASP . . . . . 0.429 ' H ' HG22 ' A' ' 869' ' ' ILE . 0.3 OUTLIER -157.95 -52.42 0.07 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.11 0.481 . . . . 0.0 109.824 169.309 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 871' ' ' ILE . . . . . . . . . . . . . 7.4 mm -122.4 124.0 69.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.726 179.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 872' ' ' VAL . . . . . 0.491 ' O ' ' HA ' ' A' ' 899' ' ' VAL . 38.4 t -118.27 129.28 74.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.316 178.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 873' ' ' LEU . . . . . 0.675 HD11 HG12 ' A' ' 829' ' ' VAL . 0.7 OUTLIER -131.76 135.23 46.64 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 177.152 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 874' ' ' SER . . . . . 0.505 ' HA ' ' O ' ' A' ' 830' ' ' VAL . 0.9 OUTLIER -123.69 126.63 46.89 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.686 -177.459 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 875' ' ' ASP . . . . . 0.481 ' HA ' ' O ' ' A' ' 902' ' ' VAL . 40.5 t0 -111.21 120.14 41.28 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.41 -178.291 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 4.1 t -121.39 131.93 71.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.031 -176.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 877' ' ' ASN . . . . . 0.43 ' HB2' ' HE2' ' A' ' 925' ' ' LYS . 1.8 t-20 -121.96 53.02 1.23 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.073 0.464 . . . . 0.0 110.863 179.049 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.323 -0.569 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.13 179.232 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.723 0 N-CA-C 110.397 -1.081 . . . . 0.0 110.397 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.2 -28.28 68.64 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 176.626 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 885' ' ' ARG . . . . . 0.474 ' O ' ' HB2' ' A' ' 889' ' ' ARG . 0.0 OUTLIER -63.82 -31.11 72.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.285 173.939 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 886' ' ' LEU . . . . . 0.453 ' O ' ' HB ' ' A' ' 890' ' ' ILE . 0.0 OUTLIER -68.32 -45.58 72.58 Favored 'General case' 0 C--O 1.226 -0.172 0 CA-C-N 116.662 -0.244 . . . . 0.0 110.523 -177.532 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.59 -43.82 92.61 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.114 0.483 . . . . 0.0 110.814 179.544 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 2.9 tm0? -63.96 -51.46 64.25 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.89 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 889' ' ' ARG . . . . . 0.474 ' HB2' ' O ' ' A' ' 885' ' ' ARG . 0.2 OUTLIER -72.51 -28.17 62.71 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.776 -0.647 . . . . 0.0 112.124 -174.611 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 890' ' ' ILE . . . . . 0.453 ' HB ' ' O ' ' A' ' 886' ' ' LEU . 0.8 OUTLIER -71.65 -38.59 67.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.707 179.273 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 891' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.18 -24.88 54.76 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.121 0.486 . . . . 0.0 109.749 176.559 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -77.3 -31.89 55.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.459 179.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 893' ' ' LEU . . . . . 0.427 HD11 ' HB3' ' A' ' 865' ' ' SER . 1.6 tp -73.57 -49.36 26.73 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.345 -179.728 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 133.93 63.61 0.07 OUTLIER Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.297 -0.954 . . . . 0.0 112.161 -179.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 895' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.38 110.22 17.33 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.94 -0.392 . . . . 0.0 109.94 175.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -115.92 34.04 5.18 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.292 0.568 . . . . 0.0 110.996 -178.852 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 897' ' ' LEU . . . . . 0.732 HD11 HD21 ' A' ' 864' ' ' LEU . 0.2 OUTLIER -141.52 148.93 52.36 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.925 -178.283 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -69.66 130.12 18.9 Favored 'Trans proline' 0 C--O 1.24 0.599 0 C-N-CA 122.647 2.232 . . . . 0.0 113.03 -177.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 899' ' ' VAL . . . . . 0.7 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 8.0 t -112.05 129.45 67.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.586 176.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 900' ' ' ILE . . . . . 0.428 ' CG2' ' HG ' ' A' ' 923' ' ' LEU . 3.0 mp -99.2 111.93 30.07 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 175.805 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 901' ' ' GLY . . . . . 0.43 ' HA3' ' SD ' ' A' ' 919' ' ' MET . . . -95.07 101.13 2.67 Favored Glycine 0 N--CA 1.442 -0.938 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.035 -177.433 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 902' ' ' VAL . . . . . 1.017 ' HB ' ' HB2' ' A' ' 923' ' ' LEU . 0.1 OUTLIER -96.21 128.17 47.65 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 178.898 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 903' ' ' THR . . . . . 0.478 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.2 OUTLIER -135.51 169.12 18.0 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.321 -176.492 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 904' ' ' ALA . . . . . 0.576 ' HB2' ' HB2' ' A' ' 925' ' ' LYS . . . -142.81 104.73 4.38 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.678 0.275 . . . . 0.0 111.307 177.354 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 58.3 74.01 0.45 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.175 -0.921 . . . . 0.0 113.217 172.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 906' ' ' ALA . . . . . 0.618 ' HB3' ' HG3' ' A' ' 909' ' ' GLU . . . -117.76 -2.06 11.45 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 169.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 2.3 tp 71.76 -56.1 0.65 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 114.87 -1.059 . . . . 0.0 112.746 175.579 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 908' ' ' ALA . . . . . 0.588 ' O ' ' HB2' ' A' ' 912' ' ' GLN . . . -92.14 12.58 21.69 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -172.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 909' ' ' GLU . . . . . 0.618 ' HG3' ' HB3' ' A' ' 906' ' ' ALA . 0.5 OUTLIER -63.36 -36.19 82.89 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.583 0.23 . . . . 0.0 111.338 -175.192 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 910' ' ' GLU . . . . . 0.404 ' H ' ' HG3' ' A' ' 910' ' ' GLU . 0.0 OUTLIER -59.73 -61.89 2.28 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.209 -177.341 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.64 -29.31 66.75 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.088 -178.051 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 912' ' ' GLN . . . . . 0.588 ' HB2' ' O ' ' A' ' 908' ' ' ALA . 1.1 mt-30 -62.94 -45.04 94.33 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 177.55 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.61 -38.6 81.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.597 179.52 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 90.7 m -62.84 -35.25 79.31 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.956 176.002 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.47 -51.86 21.48 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.652 -179.051 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 916' ' ' GLU . . . . . 0.508 ' H ' ' HG3' ' A' ' 916' ' ' GLU . 0.0 OUTLIER -72.91 -50.31 24.45 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.672 -0.24 . . . . 0.0 111.292 -175.899 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 49.96 39.21 18.18 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.87 -174.512 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -99.11 -31.45 6.22 Favored Glycine 0 N--CA 1.445 -0.701 0 C-N-CA 120.845 -0.693 . . . . 0.0 111.975 -177.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 919' ' ' MET . . . . . 0.7 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 2.6 mtm -78.58 -94.0 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 110.533 -0.173 . . . . 0.0 110.533 179.325 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 920' ' ' ASP . . . . . 0.572 ' HB2' ' O ' ' A' ' 919' ' ' MET . 11.5 t70 157.47 -81.88 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.39 1.076 . . . . 0.0 108.871 179.479 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -97.48 173.04 7.37 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.752 -178.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 922' ' ' CYS . . . . . 0.424 ' O ' HD23 ' A' ' 923' ' ' LEU . 0.0 OUTLIER -144.18 136.76 26.86 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.943 0.401 . . . . 0.0 111.208 -178.248 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 923' ' ' LEU . . . . . 1.017 ' HB2' ' HB ' ' A' ' 902' ' ' VAL . 60.6 mt -127.25 -175.72 3.52 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.612 178.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 924' ' ' SER . . . . . 0.478 ' HA ' ' O ' ' A' ' 903' ' ' THR . 0.2 OUTLIER -126.31 144.17 50.9 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.362 178.3 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 925' ' ' LYS . . . . . 0.576 ' HB2' ' HB2' ' A' ' 904' ' ' ALA . 2.3 tttp -53.82 -42.96 95.44 Favored Pre-proline 0 CA--C 1.54 0.564 0 O-C-N 123.538 0.524 . . . . 0.0 112.305 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -66.91 69.99 0.52 Allowed 'Trans proline' 0 C--N 1.36 1.168 0 C-N-CA 122.067 1.845 . . . . 0.0 111.807 171.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 3.0 p -115.48 158.1 15.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.72 -177.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -109.03 161.97 14.67 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.255 177.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 929' ' ' LEU . . . . . 0.94 HD12 ' HG2' ' A' ' 843' ' ' GLN . 1.2 tt -61.77 -29.52 70.19 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.925 0.393 . . . . 0.0 110.295 176.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 930' ' ' ASP . . . . . 0.561 ' O ' ' HG2' ' A' ' 934' ' ' GLN . 17.1 t0 -62.59 -46.24 89.22 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.246 179.375 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 55.2 t -71.73 -42.23 70.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.784 -176.285 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 932' ' ' ILE . . . . . 0.512 HG22 ' HA ' ' A' ' 929' ' ' LEU . 0.0 OUTLIER -64.95 -38.74 83.55 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.038 177.956 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 933' ' ' LYS . . . . . 0.577 ' HA ' HD21 ' A' ' 847' ' ' LEU . 2.0 tmmt? -62.7 -46.13 89.58 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.328 176.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 934' ' ' GLN . . . . . 0.561 ' HG2' ' O ' ' A' ' 930' ' ' ASP . 14.1 mm100 -57.05 -51.13 70.51 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.906 179.145 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 5.1 m -63.13 -42.45 99.5 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.464 -178.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 936' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.02 -35.85 82.07 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.712 178.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 90.2 m -68.32 -45.28 73.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.098 178.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 9.4 tp -61.83 -42.87 99.57 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.166 0.508 . . . . 0.0 110.506 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -72.67 -31.85 65.39 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.935 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -62.12 -41.15 97.95 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.807 178.037 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 941' ' ' GLU . . . . . 0.552 ' HG3' ' N ' ' A' ' 942' ' ' ARG . 0.0 OUTLIER -66.51 -35.43 80.23 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.342 178.139 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 942' ' ' ARG . . . . . 0.552 ' N ' ' HG3' ' A' ' 941' ' ' GLU . 5.0 mmt85 -66.1 -48.65 70.24 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.024 0.44 . . . . 0.0 110.89 178.37 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 25.4 m -74.17 -33.23 34.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.531 -174.263 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 944' ' ' ARG . . . . . 0.507 ' HG3' ' N ' ' A' ' 945' ' ' LYS . 0.0 OUTLIER -69.92 -34.59 73.69 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 121.187 -0.205 . . . . 0.0 110.696 -179.819 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 945' ' ' LYS . . . . . 0.507 ' N ' ' HG3' ' A' ' 944' ' ' ARG . 12.8 ptpt -79.16 -31.74 44.08 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 121.158 -0.217 . . . . 0.0 111.347 -178.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 946' ' ' SER . . . . . 0.401 ' N ' ' HG3' ' A' ' 945' ' ' LYS . 7.7 m -74.42 -36.82 63.45 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.98 0.419 . . . . 0.0 110.508 179.489 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 947' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 947' ' ' ARG . 1.7 ttm105 -78.51 -19.51 52.82 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.722 175.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 27.1 t70 . . . . . 0 N--CA 1.463 0.214 0 CA-C-N 115.036 -0.984 . . . . 0.0 111.118 177.976 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 705' ' ' SER . . . . . 0.628 ' HA ' ' O ' ' A' ' 730' ' ' GLY . 0.9 OUTLIER . . . . . 0 CA--C 1.529 0.152 0 CA-C-O 121.186 0.517 . . . . 0.0 111.439 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . -171.83 -28.45 0.02 OUTLIER Glycine 0 N--CA 1.446 -0.681 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.614 -178.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 707' ' ' LYS . . . . . 0.501 ' HE2' ' CE2' ' A' ' 799' ' ' TYR . 0.0 OUTLIER -63.41 148.99 46.99 Favored 'General case' 0 C--N 1.334 -0.095 0 N-CA-C 109.862 -0.421 . . . . 0.0 109.862 176.595 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 708' ' ' ARG . . . . . 0.463 ' H ' ' HE3' ' A' ' 707' ' ' LYS . 4.7 mtt180 -116.53 146.86 42.32 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.125 0.488 . . . . 0.0 111.322 -177.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 709' ' ' CYS . . . . . 0.506 ' HB2' HD22 ' A' ' 726' ' ' LEU . 42.9 t -126.89 138.0 53.24 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.138 174.163 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 710' ' ' TRP . . . . . 0.63 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 38.9 m95 -105.49 130.83 53.48 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 120.783 0.325 . . . . 0.0 110.336 -177.335 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 711' ' ' LEU . . . . . 0.545 HD22 HG22 ' A' ' 733' ' ' VAL . 0.6 OUTLIER -136.37 137.73 40.85 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.217 0.532 . . . . 0.0 111.429 -178.412 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -126.91 53.45 1.7 Allowed 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.322 176.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 713' ' ' VAL . . . . . 0.987 ' HA ' ' HB2' ' A' ' 750' ' ' ASP . 15.8 t -109.13 132.76 56.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.807 -175.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.57 -11.81 16.21 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.583 -177.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -74.22 112.9 10.83 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 170.357 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 716' ' ' ALA . . . . . 0.609 ' O ' ' HB2' ' A' ' 720' ' ' GLN . . . -63.05 -44.75 94.96 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 122.73 0.412 . . . . 0.0 111.542 -172.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.3 -39.04 89.08 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.002 0.43 . . . . 0.0 110.709 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 718' ' ' LEU . . . . . 0.518 ' O ' ' HG ' ' A' ' 722' ' ' LEU . 2.3 tt -69.0 -51.17 42.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.596 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 719' ' ' CYS . . . . . 0.434 ' HB3' ' HB ' ' A' ' 713' ' ' VAL . 15.0 p -65.12 -42.03 94.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.548 -176.624 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 720' ' ' GLN . . . . . 0.726 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -60.95 -39.38 89.3 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.288 179.483 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.12 -53.7 55.3 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.96 0.409 . . . . 0.0 110.836 -179.623 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 722' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 718' ' ' LEU . 0.0 OUTLIER -67.4 -48.25 67.9 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.304 -178.314 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 723' ' ' GLU . . . . . 0.726 ' HG2' ' HA ' ' A' ' 720' ' ' GLN . 3.1 pt-20 -59.51 -41.13 89.2 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.669 -174.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 724' ' ' THR . . . . . 0.671 ' HA ' ' HG2' ' A' ' 727' ' ' GLN . 10.0 m -70.35 -36.6 74.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.688 0.28 . . . . 0.0 111.277 -179.1 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 25.1 m -66.92 -34.08 76.98 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.478 0.18 . . . . 0.0 111.336 -179.116 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 726' ' ' LEU . . . . . 0.671 HD11 HD12 ' A' ' 795' ' ' LEU . 1.1 mp -81.48 -41.67 21.4 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 121.17 -0.212 . . . . 0.0 111.301 178.161 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 727' ' ' GLN . . . . . 0.671 ' HG2' ' HA ' ' A' ' 724' ' ' THR . 0.0 OUTLIER -65.07 -21.76 66.86 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.219 0.533 . . . . 0.0 109.906 177.19 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 728' ' ' ARG . . . . . 0.468 ' HB2' ' O ' ' A' ' 724' ' ' THR . 20.2 ttp85 -60.48 -26.69 66.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.841 175.056 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -107.21 4.32 26.55 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.144 -179.588 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 730' ' ' GLY . . . . . 0.628 ' O ' ' HA ' ' A' ' 705' ' ' SER . . . 99.44 -5.82 58.97 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 121.122 -0.561 . . . . 0.0 112.436 177.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 731' ' ' ILE . . . . . 0.589 HG21 HD23 ' A' ' 726' ' ' LEU . 17.1 mt -75.6 113.75 14.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.116 0.484 . . . . 0.0 110.487 -177.053 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 732' ' ' VAL . . . . . . . . . . . . . 10.5 m -76.33 133.69 30.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.83 -177.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 733' ' ' VAL . . . . . 0.545 HG22 HD22 ' A' ' 711' ' ' LEU . 0.3 OUTLIER -97.6 138.86 21.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.351 179.42 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 4.7 m -133.98 135.31 43.38 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.254 179.082 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.33 118.82 9.22 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.425 177.016 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 736' ' ' TYR . . . . . 0.63 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 50.8 t80 -82.48 95.01 7.57 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.255 0.55 . . . . 0.0 110.556 -179.294 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.24 -70.82 0.78 Allowed 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.404 175.803 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -130.22 91.29 0.3 Allowed Glycine 0 N--CA 1.445 -0.75 0 N-CA-C 110.788 -0.925 . . . . 0.0 110.788 175.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.13 164.25 34.46 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.78 0.324 . . . . 0.0 111.002 -176.37 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 740' ' ' GLU . . . . . 0.523 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 1.9 mt-10 -79.28 138.49 55.92 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.771 -179.066 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 741' ' ' PRO . . . . . 0.523 ' HD3' ' HA ' ' A' ' 740' ' ' GLU . 5.0 Cg_endo -87.46 126.63 2.28 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 123.282 2.655 . . . . 0.0 112.246 177.013 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 742' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -104.65 134.62 19.57 Favored Pre-proline 0 C--N 1.323 -0.571 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.009 177.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 743' ' ' PRO . . . . . 1.044 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 18.7 Cg_endo -61.91 -16.88 52.4 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 123.084 2.523 . . . . 0.0 112.98 -179.564 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 56.8 mp0 -105.33 11.79 32.41 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.844 0.354 . . . . 0.0 110.839 178.044 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -111.53 159.86 17.72 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.465 -177.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 3.6 p -124.08 141.44 44.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.236 -174.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 747' ' ' LEU . . . . . 0.671 ' HB3' HG23 ' A' ' 762' ' ' VAL . 0.5 OUTLIER -117.56 141.43 48.38 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.944 179.33 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -121.75 120.92 63.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 N-CA-C 108.631 -0.878 . . . . 0.0 108.631 169.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 749' ' ' THR . . . . . 0.427 HG23 HD22 ' A' ' 747' ' ' LEU . 0.0 OUTLIER -119.27 150.42 40.13 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -169.575 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 750' ' ' ASP . . . . . 0.987 ' HB2' ' HA ' ' A' ' 713' ' ' VAL . 10.1 t0 -108.84 111.55 23.33 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.479 179.472 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 751' ' ' GLU . . . . . 0.972 ' HG2' HH21 ' A' ' 767' ' ' ARG . 17.1 mm-40 58.75 -151.9 0.41 Allowed 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 123.517 0.727 . . . . 0.0 111.248 -177.69 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 752' ' ' VAL . . . . . 0.552 HG22 ' H ' ' A' ' 771' ' ' GLY . 2.6 t -85.74 129.73 37.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 121.061 0.458 . . . . 0.0 111.741 -174.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 753' ' ' VAL . . . . . 0.403 HG21 HG22 ' A' ' 749' ' ' THR . 3.4 t -120.7 159.59 22.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.19 -0.671 . . . . 0.0 109.19 177.597 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 1.4 m -79.78 37.93 0.37 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.974 0.416 . . . . 0.0 110.934 178.103 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 3.8 mttt -159.31 -174.65 4.8 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 178.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 756' ' ' LYS . . . . . 0.627 ' O ' ' HB2' ' A' ' 757' ' ' TRP . 0.0 OUTLIER -140.03 -67.6 0.43 Allowed 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 172.627 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 757' ' ' TRP . . . . . 0.627 ' HB2' ' O ' ' A' ' 756' ' ' LYS . 0.7 OUTLIER 157.68 164.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 114.303 -1.317 . . . . 0.0 109.519 -175.265 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.69 49.97 1.14 Allowed 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 173.362 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 759' ' ' GLY . . . . . 1.044 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -150.14 -144.6 3.96 Favored Glycine 0 N--CA 1.442 -0.954 0 C-N-CA 120.403 -0.904 . . . . 0.0 113.654 -173.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 4.9 ttt85 -63.42 -61.51 2.29 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.22 -0.49 . . . . 0.0 111.652 -173.483 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -162.4 146.35 11.86 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.859 0.362 . . . . 0.0 111.068 -178.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 762' ' ' VAL . . . . . 0.671 HG23 ' HB3' ' A' ' 747' ' ' LEU . 4.0 p -126.57 122.96 62.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.738 174.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 763' ' ' VAL . . . . . 0.574 HG11 HD21 ' A' ' 791' ' ' LEU . 16.6 t -102.08 95.56 4.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.824 179.668 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 764' ' ' THR . . . . . 0.822 HG21 HG13 ' A' ' 772' ' ' ILE . 91.5 m -92.14 122.53 34.72 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.618 -179.38 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 765' ' ' PHE . . . . . 0.875 ' HZ ' ' HG ' ' A' ' 791' ' ' LEU . 3.9 m-30 -99.39 101.65 12.98 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.098 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -123.5 133.53 54.0 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.21 -177.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 767' ' ' ARG . . . . . 0.972 HH21 ' HG2' ' A' ' 751' ' ' GLU . 0.0 OUTLIER -140.19 -35.08 0.52 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.944 -179.048 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -84.98 -52.53 5.92 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 178.195 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -125.15 124.91 42.81 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.57 172.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 2.1 mt -115.39 85.34 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.161 0.505 . . . . 0.0 110.538 -177.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 771' ' ' GLY . . . . . 0.552 ' H ' HG22 ' A' ' 752' ' ' VAL . . . -92.35 -6.54 64.42 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.858 -0.686 . . . . 0.0 111.815 178.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 772' ' ' ILE . . . . . 0.822 HG13 HG21 ' A' ' 764' ' ' THR . 3.0 mm -103.52 131.3 22.19 Favored Pre-proline 0 C--N 1.323 -0.583 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.431 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 773' ' ' PRO . . . . . 0.562 ' O ' ' HB3' ' A' ' 774' ' ' LEU . 31.6 Cg_exo -60.57 -94.04 0.0 OUTLIER 'Trans proline' 0 CA--C 1.532 0.391 0 C-N-CA 123.188 2.592 . . . . 0.0 113.075 -176.725 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . 0.678 ' HA ' ' HB ' ' A' ' 782' ' ' VAL . 0.4 OUTLIER 167.4 -163.68 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.19 0.596 . . . . 0.0 109.913 -178.98 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 775' ' ' GLU . . . . . 0.605 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 1.4 mp0 -62.94 69.47 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.743 0.782 . . . . 0.0 112.423 175.084 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 776' ' ' LYS . . . . . 0.404 ' HE3' ' CD2' ' A' ' 774' ' ' LEU . 18.3 ptpt -132.61 -1.03 3.49 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 114.796 -1.093 . . . . 0.0 108.872 171.208 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 777' ' ' ALA . . . . . 0.457 ' HB1' ' HD2' ' A' ' 778' ' ' PRO . . . -131.62 158.36 75.58 Favored Pre-proline 0 N--CA 1.449 -0.494 0 CA-C-N 114.94 -1.027 . . . . 0.0 109.25 179.557 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 778' ' ' PRO . . . . . 0.457 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 23.0 Cg_endo -61.64 99.93 0.18 Allowed 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.58 2.187 . . . . 0.0 112.714 -178.529 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 94.23 15.62 47.09 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.883 -0.675 . . . . 0.0 113.408 175.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 780' ' ' GLU . . . . . 0.605 ' O ' ' HG3' ' A' ' 775' ' ' GLU . 2.7 tt0 -100.07 121.78 41.92 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 117.541 0.67 . . . . 0.0 110.322 179.251 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 781' ' ' TRP . . . . . 0.545 ' CZ3' HD11 ' A' ' 794' ' ' LEU . 12.0 m95 -129.33 124.23 33.77 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 176.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . 0.678 ' HB ' ' HA ' ' A' ' 774' ' ' LEU . 1.8 t -141.13 136.34 33.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 C-N-CA 120.696 -0.402 . . . . 0.0 111.711 -176.131 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 783' ' ' HIS . . . . . 0.444 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 1.0 OUTLIER -176.17 174.81 1.98 Allowed 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.913 168.432 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 784' ' ' SER . . . . . 0.726 ' HB3' ' HB3' ' A' ' 767' ' ' ARG . 0.7 OUTLIER -98.42 100.47 11.74 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.968 177.1 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 785' ' ' VAL . . . . . 0.755 HG12 ' H ' ' A' ' 787' ' ' ALA . 39.8 t -138.47 140.38 39.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -178.703 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -90.23 12.57 17.66 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.76 0.314 . . . . 0.0 111.138 -179.016 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 787' ' ' ALA . . . . . 0.755 ' H ' HG12 ' A' ' 785' ' ' VAL . . . 53.82 57.64 13.18 Favored Pre-proline 0 N--CA 1.467 0.381 0 CA-C-N 115.481 -0.781 . . . . 0.0 112.279 -178.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 788' ' ' PRO . . . . . 0.525 ' HD3' ' N ' ' A' ' 787' ' ' ALA . 24.2 Cg_exo -65.23 -57.83 0.24 Allowed 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 122.509 2.139 . . . . 0.0 112.375 178.22 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -160.73 -22.49 0.06 Allowed 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 179.041 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 790' ' ' GLU . . . . . 0.417 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 2.7 pm0 -73.09 -33.53 65.66 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 111.684 0.253 . . . . 0.0 111.684 -175.152 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 791' ' ' LEU . . . . . 0.875 ' HG ' ' HZ ' ' A' ' 765' ' ' PHE . 0.4 OUTLIER -71.07 -52.53 9.32 Favored Pre-proline 0 C--N 1.327 -0.382 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.761 -178.673 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 792' ' ' PRO . . . . . 0.443 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 9.5 Cg_endo -56.68 -30.77 85.17 Favored 'Trans proline' 0 C--N 1.356 0.949 0 C-N-CA 121.521 1.481 . . . . 0.0 111.831 175.228 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -69.7 -42.24 74.32 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.657 175.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 794' ' ' LEU . . . . . 0.545 HD11 ' CZ3' ' A' ' 781' ' ' TRP . 0.7 OUTLIER -60.44 -42.57 96.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.66 177.997 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 795' ' ' LEU . . . . . 0.671 HD12 HD11 ' A' ' 726' ' ' LEU . 0.3 OUTLIER -64.68 -35.36 80.77 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.988 0.423 . . . . 0.0 110.693 -179.338 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -63.67 -38.43 91.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.626 177.116 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 797' ' ' ARG . . . . . 0.509 ' HG3' ' N ' ' A' ' 798' ' ' ILE . 0.0 OUTLIER -71.55 -33.06 68.8 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.106 176.593 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 798' ' ' ILE . . . . . 0.509 ' N ' ' HG3' ' A' ' 797' ' ' ARG . 0.9 OUTLIER -61.45 -35.53 67.24 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.445 -175.739 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 799' ' ' TYR . . . . . 0.501 ' CE2' ' HE2' ' A' ' 707' ' ' LYS . 0.2 OUTLIER -104.62 28.04 7.39 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 119.829 -0.749 . . . . 0.0 112.076 176.114 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.235 0.295 0 CA-C-N 115.291 -0.868 . . . . 0.0 112.993 170.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 3.1 t0 . . . . . 0 C--O 1.232 0.167 0 CA-C-O 121.211 0.529 . . . . 0.0 111.249 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 3.0 tpt -112.99 92.7 4.1 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.142 0.496 . . . . 0.0 110.252 176.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 826' ' ' MET . . . . . . . . . . . . . 8.7 ptp -114.27 129.89 56.64 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.938 -179.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 827' ' ' ILE . . . . . 0.503 ' O ' ' HA ' ' A' ' 851' ' ' CYS . 1.0 OUTLIER -126.39 137.76 56.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.998 -178.584 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 828' ' ' LEU . . . . . 0.698 HD22 HD13 ' A' ' 869' ' ' ILE . 0.2 OUTLIER -107.68 143.61 35.93 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.782 0.325 . . . . 0.0 110.632 -178.504 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 829' ' ' VAL . . . . . 0.562 ' HA ' ' HB2' ' A' ' 873' ' ' LEU . 0.1 OUTLIER -128.04 119.67 51.72 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 121.315 0.579 . . . . 0.0 110.231 -179.345 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 830' ' ' VAL . . . . . 0.774 HG22 ' HB3' ' A' ' 854' ' ' ALA . 69.0 t -122.6 107.89 20.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 115.285 -0.871 . . . . 0.0 109.333 176.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 831' ' ' ASP . . . . . 0.545 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -118.22 153.26 34.19 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.155 0.502 . . . . 0.0 111.177 -177.611 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 832' ' ' ASP . . . . . 0.44 ' HB2' ' HA ' ' A' ' 876' ' ' VAL . 6.8 t70 -68.94 -42.4 76.78 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.778 -1.101 . . . . 0.0 112.293 -177.289 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 833' ' ' HIS . . . . . 0.489 ' HA ' ' HD2' ' A' ' 834' ' ' PRO . 0.5 OUTLIER -126.41 105.06 24.52 Favored Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 110.299 -0.259 . . . . 0.0 110.299 -173.776 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 834' ' ' PRO . . . . . 0.489 ' HD2' ' HA ' ' A' ' 833' ' ' HIS . 1.4 Cg_endo -40.75 -25.12 0.18 Allowed 'Trans proline' 0 C--N 1.353 0.803 1 C-N-CA 125.892 4.395 . . . . 0.0 116.553 -164.38 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 835' ' ' ILE . . . . . 0.443 ' O ' ' HG3' ' A' ' 838' ' ' ARG . 0.0 OUTLIER -61.01 -39.95 83.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 117.985 0.357 . . . . 0.0 111.173 -179.206 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 836' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -74.5 -41.6 60.41 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 837' ' ' ARG . . . . . 0.545 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 12.9 ttp180 -52.83 -49.93 64.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.25 177.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 838' ' ' ARG . . . . . 0.443 ' HG3' ' O ' ' A' ' 835' ' ' ILE . 0.0 OUTLIER -68.56 -34.61 76.13 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.94 -178.139 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 839' ' ' LEU . . . . . 0.435 HD22 ' HA ' ' A' ' 839' ' ' LEU . 0.6 OUTLIER -69.91 -49.15 54.88 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.077 -176.104 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 840' ' ' LEU . . . . . 0.479 HD11 ' CG2' ' A' ' 829' ' ' VAL . 2.6 pp -74.26 -31.44 62.55 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.405 -178.199 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -68.93 -35.21 76.53 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.941 0.401 . . . . 0.0 110.398 177.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 842' ' ' ASP . . . . . 0.404 ' HB2' ' O ' ' A' ' 838' ' ' ARG . 0.3 OUTLIER -63.5 -36.66 84.49 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.885 176.064 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 843' ' ' GLN . . . . . 0.734 ' HG3' HD23 ' A' ' 929' ' ' LEU . 2.5 mm-40 -68.44 -39.79 81.36 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.494 -0.775 . . . . 0.0 109.991 176.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 844' ' ' LEU . . . . . 0.585 ' HA ' HD12 ' A' ' 847' ' ' LEU . 0.3 OUTLIER -59.15 -43.46 92.06 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.273 176.579 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -61.92 -35.13 90.92 Favored Glycine 0 N--CA 1.451 -0.316 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.003 176.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 846' ' ' SER . . . . . 0.626 ' HA ' ' O ' ' A' ' 705' ' ' SER . 29.3 m -71.47 -17.26 62.37 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.792 0.33 . . . . 0.0 111.167 178.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 847' ' ' LEU . . . . . 0.585 HD12 ' HA ' ' A' ' 844' ' ' LEU . 44.3 mt -83.22 -18.39 39.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.374 175.312 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 88.97 30.02 15.99 Favored Glycine 0 C--N 1.33 0.213 0 C-N-CA 121.042 -0.599 . . . . 0.0 112.924 177.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 849' ' ' TYR . . . . . 0.424 ' HB2' HD23 ' A' ' 844' ' ' LEU . 27.1 m-85 -119.31 160.19 22.71 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 179.149 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.82 109.51 19.33 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.196 0.522 . . . . 0.0 111.085 -177.614 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 851' ' ' CYS . . . . . 0.503 ' HA ' ' O ' ' A' ' 827' ' ' ILE . 0.0 OUTLIER -93.39 151.79 19.53 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.996 179.97 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.92 109.94 13.63 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.517 173.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 853' ' ' THR . . . . . 0.428 HG22 ' CG ' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -94.43 124.07 38.23 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -171.189 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 854' ' ' ALA . . . . . 0.774 ' HB3' HG22 ' A' ' 830' ' ' VAL . . . -137.65 155.58 48.99 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.479 175.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -134.39 75.35 1.58 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 856' ' ' ASP . . . . . 0.62 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 26.8 t70 170.6 143.84 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.681 179.627 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -70.63 -37.42 67.82 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 121.038 -0.601 . . . . 0.0 113.148 -177.114 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -73.71 -31.54 32.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.846 0.355 . . . . 0.0 110.217 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 859' ' ' ASP . . . . . 0.62 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 1.0 OUTLIER -58.99 -29.21 67.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.764 177.275 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 860' ' ' ALA . . . . . 0.4 ' O ' ' HB2' ' A' ' 864' ' ' LEU . . . -63.76 -42.47 97.82 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.961 0.41 . . . . 0.0 110.495 177.018 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 861' ' ' LEU . . . . . 0.533 HD22 ' HA ' ' A' ' 861' ' ' LEU . 0.2 OUTLIER -71.14 -33.52 70.16 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.999 178.17 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -63.98 -52.23 60.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.602 179.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 9.4 p -69.14 -32.69 55.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.023 -177.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 864' ' ' LEU . . . . . 0.783 HD21 HD11 ' A' ' 897' ' ' LEU . 0.2 OUTLIER -61.3 -39.02 88.92 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.051 0.453 . . . . 0.0 110.571 177.984 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 11.0 m -82.14 -20.89 37.04 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.986 -178.49 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.8 -46.34 17.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.451 -179.607 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -150.5 138.92 20.46 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 177.729 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 18.3 m80 -86.7 88.66 7.72 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.301 0.572 . . . . 0.0 111.773 -172.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 869' ' ' ILE . . . . . 0.698 HD13 HD22 ' A' ' 828' ' ' LEU . 0.8 OUTLIER -69.48 154.74 8.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.301 173.22 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.03 -34.37 15.15 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -169.692 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 871' ' ' ILE . . . . . . . . . . . . . 2.2 mt -130.37 136.01 59.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 O-C-N 122.208 -0.308 . . . . 0.0 110.721 -179.165 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 872' ' ' VAL . . . . . 0.852 ' HB ' ' HB ' ' A' ' 899' ' ' VAL . 2.2 t -103.38 126.2 57.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.425 -178.092 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 873' ' ' LEU . . . . . 0.562 ' HB2' ' HA ' ' A' ' 829' ' ' VAL . 13.0 mt -104.03 99.82 9.57 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 170.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -106.05 96.95 6.84 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.581 0.229 . . . . 0.0 110.645 -178.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 875' ' ' ASP . . . . . 0.527 ' HA ' ' HB ' ' A' ' 902' ' ' VAL . 10.2 t0 -109.26 110.69 21.94 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.395 -177.245 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 876' ' ' VAL . . . . . 0.44 ' HA ' ' HB2' ' A' ' 832' ' ' ASP . 0.2 OUTLIER -108.01 155.19 8.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.22 0.533 . . . . 0.0 111.538 -175.884 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -115.63 -65.75 1.16 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.476 176.031 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 2.5 ttm . . . . . 0 CA--C 1.538 0.491 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 177.062 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 0.332 0 N-CA-C 114.005 0.362 . . . . 0.0 114.005 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 884' ' ' TYR . . . . . 0.448 ' H ' ' H ' ' A' ' 885' ' ' ARG . 0.6 OUTLIER -168.06 -8.58 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.842 0.353 . . . . 0.0 110.6 178.512 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 885' ' ' ARG . . . . . 0.448 ' H ' ' H ' ' A' ' 884' ' ' TYR . 5.8 tmm_? -63.51 -44.15 95.13 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.311 -176.141 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 886' ' ' LEU . . . . . 0.636 HD13 ' H ' ' A' ' 887' ' ' THR . 0.0 OUTLIER -68.72 -29.25 67.64 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.149 -177.796 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 887' ' ' THR . . . . . 0.636 ' H ' HD13 ' A' ' 886' ' ' LEU . 0.2 OUTLIER -72.33 -43.58 63.91 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 120.942 0.401 . . . . 0.0 110.409 176.863 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 33.1 mm-40 -59.53 -40.78 88.27 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.343 177.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.68 -34.78 62.74 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.355 -178.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 890' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -73.32 -36.72 49.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 120.9 -0.32 . . . . 0.0 110.904 -179.712 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 891' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -75.57 -25.26 56.91 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.969 0.414 . . . . 0.0 110.097 176.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -71.01 -45.41 63.99 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.209 175.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 4.4 tp -68.08 -45.81 72.77 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.571 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 125.49 66.41 0.18 Allowed Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.155 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 895' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 895' ' ' LEU . 0.0 OUTLIER -55.52 121.6 9.41 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.18 0.514 . . . . 0.0 110.204 176.599 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -123.12 17.8 9.97 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.323 0.582 . . . . 0.0 111.021 -176.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 897' ' ' LEU . . . . . 0.783 HD11 HD21 ' A' ' 864' ' ' LEU . 0.0 OUTLIER -144.03 138.54 15.09 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.203 -177.003 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 898' ' ' PRO . . . . . 0.472 ' HD3' ' HA ' ' A' ' 897' ' ' LEU . 33.1 Cg_exo -61.43 140.78 89.59 Favored 'Trans proline' 0 C--O 1.237 0.427 0 C-N-CA 122.709 2.273 . . . . 0.0 112.191 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 899' ' ' VAL . . . . . 0.877 HG13 ' HA ' ' A' ' 919' ' ' MET . 0.2 OUTLIER -128.88 138.42 54.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.655 0.74 . . . . 0.0 110.94 -178.425 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 900' ' ' ILE . . . . . 0.608 HG23 ' HB2' ' A' ' 921' ' ' SER . 4.1 mt -91.15 114.29 28.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 115.33 -0.85 . . . . 0.0 109.905 177.675 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 901' ' ' GLY . . . . . 0.518 ' O ' ' HA ' ' A' ' 922' ' ' CYS . . . -84.52 106.66 2.94 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.266 -179.201 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 902' ' ' VAL . . . . . 0.527 ' HB ' ' HA ' ' A' ' 875' ' ' ASP . 1.1 t -110.07 140.04 30.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 903' ' ' THR . . . . . 0.417 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.0 OUTLIER -150.82 150.03 30.44 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 110.267 -0.271 . . . . 0.0 110.267 176.542 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 904' ' ' ALA . . . . . 0.527 ' HB2' ' HD2' ' A' ' 925' ' ' LYS . . . -69.79 114.54 8.08 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 169.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -54.7 106.45 0.21 Allowed 'General case' 0 CA--C 1.513 -0.453 0 CA-C-O 121.539 0.685 . . . . 0.0 110.64 -174.427 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 906' ' ' ALA . . . . . 0.573 ' O ' ' HB2' ' A' ' 907' ' ' LEU . . . -120.8 -81.64 0.64 Allowed 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 114.851 -1.068 . . . . 0.0 110.109 -175.464 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 907' ' ' LEU . . . . . 0.573 ' HB2' ' O ' ' A' ' 906' ' ' ALA . 0.4 OUTLIER 160.24 137.87 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.475 -1.239 . . . . 0.0 108.496 -176.692 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . 74.69 -50.72 0.67 Allowed 'General case' 0 N--CA 1.467 0.391 0 O-C-N 123.788 0.68 . . . . 0.0 111.977 175.483 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.98 -38.8 92.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.119 0.485 . . . . 0.0 111.027 179.7 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 910' ' ' GLU . . . . . 0.458 ' H ' ' HG3' ' A' ' 910' ' ' GLU . 0.5 OUTLIER -67.15 -29.12 68.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.449 0.642 . . . . 0.0 109.496 175.581 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 1.4 ttpm? -77.69 -15.94 58.83 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.315 178.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -75.59 -37.53 59.8 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 173.266 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.49 -40.46 87.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.672 172.582 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 70.8 m -71.54 -26.5 62.67 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.156 176.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.6 -44.6 70.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.643 -179.809 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -77.85 -48.11 17.25 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.059 178.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.8 25.92 3.23 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.066 0.546 . . . . 0.0 111.776 -175.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -98.62 24.02 33.82 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.156 -178.017 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 919' ' ' MET . . . . . 0.877 ' HA ' HG13 ' A' ' 899' ' ' VAL . 1.5 mpt? -112.44 -86.19 0.56 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 110.162 -0.31 . . . . 0.0 110.162 -179.396 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 920' ' ' ASP . . . . . 0.595 ' HB2' ' O ' ' A' ' 919' ' ' MET . 8.4 t70 160.38 -73.17 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.449 0 O-C-N 124.614 1.196 . . . . 0.0 109.357 175.549 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . 0.608 ' HB2' HG23 ' A' ' 900' ' ' ILE . 0.1 OUTLIER -90.77 172.97 8.27 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.077 -173.993 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 922' ' ' CYS . . . . . 0.518 ' HA ' ' O ' ' A' ' 901' ' ' GLY . 0.1 OUTLIER -149.73 121.33 8.01 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.485 177.794 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 923' ' ' LEU . . . . . 0.402 HD12 HG13 ' A' ' 902' ' ' VAL . 0.0 OUTLIER -143.7 173.04 12.02 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.894 0.378 . . . . 0.0 110.31 175.138 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 924' ' ' SER . . . . . 0.417 ' HA ' ' O ' ' A' ' 903' ' ' THR . 1.8 m -94.52 153.29 17.97 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.436 179.255 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 925' ' ' LYS . . . . . 0.527 ' HD2' ' HB2' ' A' ' 904' ' ' ALA . 25.8 tttp -46.93 -48.99 51.42 Favored Pre-proline 0 CA--C 1.538 0.519 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -178.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 926' ' ' PRO . . . . . 0.421 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 50.2 Cg_endo -69.67 72.52 1.39 Allowed 'Trans proline' 0 C--N 1.355 0.901 0 C-N-CA 121.634 1.556 . . . . 0.0 112.815 177.257 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 34.2 t -79.62 119.19 28.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.428 177.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 928' ' ' THR . . . . . 0.466 ' O ' HG22 ' A' ' 932' ' ' ILE . 0.0 OUTLIER -72.42 156.55 38.94 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.228 179.655 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 929' ' ' LEU . . . . . 0.734 HD23 ' HG3' ' A' ' 843' ' ' GLN . 1.4 tm? -56.57 -46.05 80.97 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.631 -176.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -67.43 -33.09 74.44 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.372 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 54.0 t -70.08 -49.23 57.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.876 -177.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 932' ' ' ILE . . . . . 0.466 HG22 ' O ' ' A' ' 928' ' ' THR . 0.8 OUTLIER -61.1 -39.59 82.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 178.861 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 2.4 tmmt? -61.93 -48.79 78.85 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.894 178.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 -66.16 -48.22 71.48 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.487 -177.081 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 4.3 m -61.85 -44.16 97.38 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.165 -178.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 936' ' ' LEU . . . . . 0.462 ' HB2' ' O ' ' A' ' 932' ' ' ILE . 0.7 OUTLIER -64.59 -41.73 96.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.513 179.527 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 86.4 m -62.36 -44.43 96.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.977 0.418 . . . . 0.0 110.819 178.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -64.98 -44.32 89.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.406 -177.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 939' ' ' TYR . . . . . 0.418 ' HA ' ' HB3' ' A' ' 942' ' ' ARG . 19.5 m-85 -76.64 -28.57 56.09 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.414 -177.458 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -66.71 -41.51 87.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.899 0.381 . . . . 0.0 110.179 175.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 941' ' ' GLU . . . . . 0.523 ' HA ' ' HB2' ' A' ' 944' ' ' ARG . 7.4 pt-20 -75.55 -22.1 57.34 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.347 177.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 942' ' ' ARG . . . . . 0.418 ' HB3' ' HA ' ' A' ' 939' ' ' TYR . 0.0 OUTLIER -66.28 -48.01 71.78 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.259 175.604 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 12.7 m -74.41 -30.93 26.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.892 0.377 . . . . 0.0 110.342 178.05 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 944' ' ' ARG . . . . . 0.523 ' HB2' ' HA ' ' A' ' 941' ' ' GLU . 0.8 OUTLIER -65.83 -31.94 73.19 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.002 177.928 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -87.73 -15.35 37.31 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.692 0.282 . . . . 0.0 110.623 177.11 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 53.2 m -72.52 -45.27 60.11 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.904 0.383 . . . . 0.0 110.053 174.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 2.9 ttp85 -78.07 -31.68 50.37 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 174.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 36.5 t70 . . . . . 0 C--O 1.233 0.235 0 CA-C-N 114.751 -1.113 . . . . 0.0 111.272 179.029 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 705' ' ' SER . . . . . 0.584 ' HA ' ' HA3' ' A' ' 730' ' ' GLY . 4.6 m . . . . . 0 N--CA 1.451 -0.392 0 CA-C-O 121.449 0.642 . . . . 0.0 109.444 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . -145.42 43.94 0.9 Allowed Glycine 0 N--CA 1.447 -0.596 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.617 -176.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 707' ' ' LYS . . . . . 0.559 ' HE3' ' HD1' ' A' ' 799' ' ' TYR . 1.2 mmtt -133.99 143.92 48.43 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 178.201 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 708' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.06 152.82 20.53 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.246 0.546 . . . . 0.0 110.993 -177.566 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 709' ' ' CYS . . . . . 0.501 ' SG ' HD13 ' A' ' 726' ' ' LEU . 0.1 OUTLIER -131.59 112.36 12.54 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.766 175.482 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 710' ' ' TRP . . . . . 0.64 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 84.5 m95 -92.51 121.12 33.66 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.431 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 711' ' ' LEU . . . . . 0.518 HD12 ' SG ' ' A' ' 719' ' ' CYS . 2.4 pt? -128.77 131.15 47.81 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.528 0.68 . . . . 0.0 111.297 -177.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -127.43 66.34 1.31 Allowed 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.876 177.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 713' ' ' VAL . . . . . 0.815 HG13 ' HB3' ' A' ' 750' ' ' ASP . 45.9 t -113.85 130.09 68.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.109 -179.015 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 714' ' ' ARG . . . . . 0.485 ' HD2' ' OD2' ' A' ' 750' ' ' ASP . 20.6 mtt180 -81.37 -13.42 58.35 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.209 -177.536 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 715' ' ' ASN . . . . . 0.643 ' H ' HG12 ' A' ' 713' ' ' VAL . 0.6 OUTLIER -87.4 122.2 30.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.411 178.098 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -70.59 -35.65 73.14 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.74 -176.199 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.18 -54.41 47.23 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.115 0.483 . . . . 0.0 110.244 177.502 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 718' ' ' LEU . . . . . 0.494 HD21 ' CE1' ' A' ' 765' ' ' PHE . 0.8 OUTLIER -61.99 -49.38 76.29 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.763 -179.499 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 719' ' ' CYS . . . . . 0.759 ' SG ' ' HB ' ' A' ' 713' ' ' VAL . 0.7 OUTLIER -59.31 -53.08 62.3 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.205 -177.287 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 720' ' ' GLN . . . . . 0.478 ' O ' ' HG3' ' A' ' 723' ' ' GLU . 48.0 tt0 -65.28 -44.34 88.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.798 -174.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -56.52 -48.81 76.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.822 0.344 . . . . 0.0 110.954 -176.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 76.3 mt -68.35 -48.12 65.65 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.09 -178.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 723' ' ' GLU . . . . . 0.724 ' HB2' HG21 ' A' ' 733' ' ' VAL . 0.0 OUTLIER -62.15 -42.73 99.53 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 111.705 0.261 . . . . 0.0 111.705 -174.092 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 724' ' ' THR . . . . . . . . . . . . . 27.8 m -69.08 -37.52 78.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.837 0.351 . . . . 0.0 111.022 -179.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 23.8 m -67.76 -37.88 82.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.804 0.335 . . . . 0.0 111.151 178.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 726' ' ' LEU . . . . . 0.785 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 18.4 mt -75.15 -38.57 60.9 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.998 0.428 . . . . 0.0 111.101 -178.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -74.47 -4.3 35.91 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.148 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.78 -44.11 94.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.277 -0.42 . . . . 0.0 109.95 174.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -80.67 -68.76 0.65 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.068 175.604 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 730' ' ' GLY . . . . . 0.584 ' HA3' ' HA ' ' A' ' 705' ' ' SER . . . 172.28 26.07 0.02 OUTLIER Glycine 0 N--CA 1.442 -0.919 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.942 176.051 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 731' ' ' ILE . . . . . 0.785 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 13.5 mm -84.09 91.49 2.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 177.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 732' ' ' VAL . . . . . . . . . . . . . 1.8 p -67.46 120.71 15.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.601 0.715 . . . . 0.0 111.173 -176.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 733' ' ' VAL . . . . . 0.724 HG21 ' HB2' ' A' ' 723' ' ' GLU . 4.3 m -91.32 147.63 5.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.087 -178.028 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 734' ' ' THR . . . . . 0.445 ' HB ' ' CZ3' ' A' ' 710' ' ' TRP . 0.1 OUTLIER -143.61 138.44 29.02 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.767 178.309 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.25 110.91 1.17 Allowed 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.788 176.46 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 736' ' ' TYR . . . . . 0.64 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 46.2 t80 -80.52 93.17 6.0 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.371 0.605 . . . . 0.0 110.175 178.158 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -97.21 -30.85 12.75 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.763 177.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 162.64 56.78 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 111.019 -0.832 . . . . 0.0 111.019 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 739' ' ' GLN . . . . . 0.492 ' HB3' ' H ' ' A' ' 740' ' ' GLU . 15.2 mp0 -101.99 -144.95 0.35 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.91 0.386 . . . . 0.0 111.728 -172.425 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 740' ' ' GLU . . . . . 0.492 ' H ' ' HB3' ' A' ' 739' ' ' GLN . 2.3 pt-20 -106.02 125.11 33.92 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.117 -173.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 741' ' ' PRO . . . . . 0.556 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 73.4 Cg_endo -78.5 123.34 5.92 Favored 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 122.471 2.114 . . . . 0.0 112.267 175.487 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 742' ' ' THR . . . . . 0.605 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.2 OUTLIER -118.84 141.8 30.72 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.589 178.506 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 743' ' ' PRO . . . . . 0.605 ' HD2' HG22 ' A' ' 742' ' ' THR . 34.7 Cg_endo -65.55 -1.38 4.72 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 123.314 2.676 . . . . 0.0 113.032 179.036 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -103.34 -8.48 20.24 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.245 0.545 . . . . 0.0 110.4 177.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -112.75 153.1 28.3 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.744 -171.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 746' ' ' VAL . . . . . 0.48 ' HA ' ' O ' ' A' ' 761' ' ' ALA . 8.3 m -116.94 147.92 20.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.817 178.353 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 747' ' ' LEU . . . . . 0.434 HD23 ' HA ' ' A' ' 747' ' ' LEU . 0.0 OUTLIER -107.86 104.61 14.12 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.372 179.933 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -99.49 111.89 30.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 177.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 14.0 p -124.09 156.22 36.98 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.896 0.379 . . . . 0.0 111.418 -175.326 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 750' ' ' ASP . . . . . 0.815 ' HB3' HG13 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -109.16 130.77 55.48 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 168.464 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 751' ' ' GLU . . . . . 0.43 ' HG3' ' N ' ' A' ' 752' ' ' VAL . 4.4 tp10 72.86 153.25 0.13 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.188 -167.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 752' ' ' VAL . . . . . 0.847 HG22 ' HB ' ' A' ' 772' ' ' ILE . 1.4 t -70.82 123.5 25.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.63 -178.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 11.1 m -101.32 155.09 4.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.563 -179.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -83.24 75.15 9.97 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.061 178.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -154.24 127.3 8.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.066 0.46 . . . . 0.0 111.568 -175.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.96 81.2 4.59 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 169.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 757' ' ' TRP . . . . . 0.556 ' CH2' ' HA ' ' A' ' 741' ' ' PRO . 70.7 t-105 -68.24 100.64 1.06 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.759 -177.649 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.39 49.15 0.99 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.38 0.61 . . . . 0.0 109.805 178.659 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 759' ' ' GLY . . . . . 0.45 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -104.13 -131.34 7.15 Favored Glycine 0 N--CA 1.444 -0.768 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.396 178.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 2.9 ttm-85 -79.83 -50.41 10.56 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.102 177.128 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 761' ' ' ALA . . . . . 0.48 ' O ' ' HA ' ' A' ' 746' ' ' VAL . . . -166.93 157.87 12.07 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.256 179.065 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 762' ' ' VAL . . . . . 0.544 HG13 ' HA ' ' A' ' 780' ' ' GLU . 1.4 p -133.91 122.8 43.16 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 176.604 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 763' ' ' VAL . . . . . 0.489 HG11 HD21 ' A' ' 791' ' ' LEU . 41.8 t -114.71 115.11 48.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.291 -0.413 . . . . 0.0 109.904 -178.284 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 764' ' ' THR . . . . . 0.586 HG22 ' HB2' ' A' ' 766' ' ' CYS . 34.2 m -112.2 119.09 37.17 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.246 0.546 . . . . 0.0 111.321 -178.321 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 765' ' ' PHE . . . . . 0.612 ' HA ' ' O ' ' A' ' 783' ' ' HIS . 91.3 m-85 -84.06 98.0 9.62 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.372 175.163 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 766' ' ' CYS . . . . . 0.586 ' HB2' HG22 ' A' ' 764' ' ' THR . 1.7 t -140.04 141.35 36.27 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -172.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 767' ' ' ARG . . . . . 0.505 ' HE ' ' HB3' ' A' ' 767' ' ' ARG . 0.0 OUTLIER -104.29 -31.03 9.76 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.026 174.654 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 768' ' ' ARG . . . . . 0.407 HH11 ' HD2' ' A' ' 768' ' ' ARG . 0.0 OUTLIER -83.92 -50.86 7.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.194 177.401 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . 0.572 ' HA ' ' CG2' ' A' ' 752' ' ' VAL . 12.3 p-80 46.93 88.22 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.331 1.052 . . . . 0.0 113.037 177.484 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 6.1 mt -78.05 -74.21 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.919 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 771' ' ' GLY . . . . . 0.679 ' H ' HG11 ' A' ' 752' ' ' VAL . . . -111.85 7.91 27.62 Favored Glycine 0 C--N 1.332 0.317 0 C-N-CA 120.485 -0.864 . . . . 0.0 114.375 -170.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 772' ' ' ILE . . . . . 0.847 ' HB ' HG22 ' A' ' 752' ' ' VAL . 43.2 mm -105.0 115.58 62.16 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 117.647 0.724 . . . . 0.0 110.397 176.307 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 773' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -90.63 -170.41 0.38 Allowed 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 123.769 2.98 . . . . 0.0 112.465 176.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . 0.459 ' HA ' HG22 ' A' ' 782' ' ' VAL . 1.0 OUTLIER -95.32 -158.22 0.63 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.509 178.041 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 775' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 0.3 OUTLIER -66.49 61.92 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -179.085 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -121.56 22.15 10.71 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 167.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 777' ' ' ALA . . . . . 0.851 ' HB1' ' HD2' ' A' ' 778' ' ' PRO . . . -148.47 176.31 2.3 Favored Pre-proline 0 N--CA 1.451 -0.399 0 CA-C-N 113.611 -1.632 . . . . 0.0 108.794 -175.39 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 778' ' ' PRO . . . . . 0.851 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 51.8 Cg_endo -68.65 61.96 1.2 Allowed 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 122.702 2.268 . . . . 0.0 114.176 -178.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 102.02 22.26 10.2 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.611 -0.804 . . . . 0.0 113.764 173.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 780' ' ' GLU . . . . . 0.584 ' HB2' ' HB3' ' A' ' 777' ' ' ALA . 0.3 OUTLIER -79.57 125.28 29.39 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 117.111 0.456 . . . . 0.0 110.564 178.213 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 20.3 m95 -130.12 115.62 17.32 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.65 0.262 . . . . 0.0 110.429 179.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . 0.459 HG22 ' HA ' ' A' ' 774' ' ' LEU . 0.1 OUTLIER -103.04 136.02 37.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 110.176 -0.305 . . . . 0.0 110.176 175.263 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 783' ' ' HIS . . . . . 0.612 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.2 OUTLIER -152.1 132.93 14.11 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.725 0.298 . . . . 0.0 110.827 179.202 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -99.44 100.24 11.26 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.982 0.42 . . . . 0.0 110.176 174.121 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -164.56 178.92 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.764 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -111.51 28.95 8.27 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.94 0.4 . . . . 0.0 110.187 175.106 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 57.82 70.54 1.26 Allowed Pre-proline 0 N--CA 1.465 0.285 0 CA-C-N 115.32 -0.855 . . . . 0.0 111.278 -178.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 788' ' ' PRO . . . . . 0.458 ' HB2' ' H ' ' A' ' 789' ' ' HIS . 5.3 Cg_exo -77.09 -96.34 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.724 2.283 . . . . 0.0 112.438 -178.34 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 789' ' ' HIS . . . . . 0.458 ' H ' ' HB2' ' A' ' 788' ' ' PRO . 0.2 OUTLIER -124.11 2.94 8.62 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.964 0.411 . . . . 0.0 111.717 -178.319 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 790' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -104.38 -46.66 4.33 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.669 -175.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 791' ' ' LEU . . . . . 0.588 ' HG ' ' CZ ' ' A' ' 765' ' ' PHE . 0.4 OUTLIER -62.91 -51.23 72.73 Favored Pre-proline 0 C--N 1.327 -0.382 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -178.803 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 792' ' ' PRO . . . . . 0.427 ' HD3' ' HB3' ' A' ' 791' ' ' LEU . 24.5 Cg_exo -60.95 -30.59 90.22 Favored 'Trans proline' 0 C--N 1.354 0.836 0 C-N-CA 121.445 1.43 . . . . 0.0 111.626 179.747 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -68.98 -45.49 70.5 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.413 176.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 794' ' ' LEU . . . . . 0.444 HD22 ' HA ' ' A' ' 794' ' ' LEU . 0.2 OUTLIER -63.78 -36.58 84.36 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.687 179.437 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 795' ' ' LEU . . . . . 0.443 HD22 ' HA ' ' A' ' 795' ' ' LEU . 0.4 OUTLIER -63.56 -47.61 80.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.771 179.622 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -66.14 -33.6 76.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.105 179.196 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 1.5 ttt-85 -71.05 -37.12 72.53 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.889 179.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -69.53 -31.45 49.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.827 -178.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 799' ' ' TYR . . . . . 0.559 ' HD1' ' HE3' ' A' ' 707' ' ' LYS . 17.3 m-85 -85.39 -0.43 54.82 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.578 178.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 47.7 mt . . . . . 0 N--CA 1.463 0.216 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.337 178.438 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.16 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 825' ' ' MET . . . . . 0.543 ' O ' ' HB2' ' A' ' 850' ' ' GLN . 0.1 OUTLIER -127.83 106.66 9.27 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.979 -176.767 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 826' ' ' MET . . . . . 0.489 ' H ' ' HG2' ' A' ' 826' ' ' MET . 0.0 OUTLIER -97.84 108.86 21.66 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.301 0.572 . . . . 0.0 111.3 -177.042 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 827' ' ' ILE . . . . . 0.49 HG23 ' HB ' ' A' ' 871' ' ' ILE . 9.6 mm -107.52 136.13 43.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.312 175.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 828' ' ' LEU . . . . . 0.607 HD23 HG13 ' A' ' 872' ' ' VAL . 46.2 tp -106.17 122.61 46.56 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.994 0.425 . . . . 0.0 110.541 -176.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 829' ' ' VAL . . . . . 0.632 ' HB ' ' HD2' ' A' ' 837' ' ' ARG . 0.8 OUTLIER -113.38 111.55 36.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.19 -179.361 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 830' ' ' VAL . . . . . 0.621 HG22 ' HB3' ' A' ' 854' ' ' ALA . 12.7 t -117.37 129.27 74.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.335 -179.435 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 831' ' ' ASP . . . . . 0.752 ' HB2' ' NE ' ' A' ' 837' ' ' ARG . 9.1 t0 -134.61 142.54 46.94 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 173.028 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 832' ' ' ASP . . . . . 0.425 ' HB2' ' HB2' ' A' ' 878' ' ' MET . 4.8 p-10 -65.98 -15.1 62.71 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.132 0.492 . . . . 0.0 110.432 174.108 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 833' ' ' HIS . . . . . 0.408 ' HA ' ' HD2' ' A' ' 834' ' ' PRO . 22.1 m170 -117.41 104.99 49.21 Favored Pre-proline 0 C--O 1.234 0.268 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.486 171.246 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 834' ' ' PRO . . . . . 0.408 ' HD2' ' HA ' ' A' ' 833' ' ' HIS . 19.7 Cg_endo -57.67 -35.77 98.7 Favored 'Trans proline' 0 CA--C 1.532 0.392 0 C-N-CA 123.184 2.589 . . . . 0.0 113.799 -173.388 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 835' ' ' ILE . . . . . 0.519 ' O ' ' HG3' ' A' ' 838' ' ' ARG . 0.0 OUTLIER -59.55 -44.38 93.0 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-O 121.006 0.432 . . . . 0.0 111.199 -177.737 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 836' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -65.41 -40.09 92.95 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.248 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 837' ' ' ARG . . . . . 0.752 ' NE ' ' HB2' ' A' ' 831' ' ' ASP . 0.0 OUTLIER -64.97 -46.99 79.21 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.675 -177.028 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 838' ' ' ARG . . . . . 0.519 ' HG3' ' O ' ' A' ' 835' ' ' ILE . 0.3 OUTLIER -65.87 -29.13 69.53 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.839 0.352 . . . . 0.0 110.962 -179.28 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 8.5 mt -66.41 -52.56 45.31 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.944 -179.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 840' ' ' LEU . . . . . 0.462 HD11 ' HD3' ' A' ' 837' ' ' ARG . 1.2 pp -72.68 -26.66 61.7 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.588 179.247 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -65.58 -33.28 75.55 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.008 0.433 . . . . 0.0 110.202 174.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -63.14 -43.5 98.2 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.045 175.53 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 843' ' ' GLN . . . . . . . . . . . . . 45.2 mm-40 -64.29 -39.73 94.52 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.387 176.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 844' ' ' LEU . . . . . 0.598 HD13 ' HB2' ' A' ' 849' ' ' TYR . 0.0 OUTLIER -61.15 -34.96 75.86 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.578 176.575 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -62.41 -39.0 97.22 Favored Glycine 0 N--CA 1.445 -0.72 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.003 176.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -70.32 -23.25 62.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.92 0.391 . . . . 0.0 110.985 176.514 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 847' ' ' LEU . . . . . 0.411 ' HA ' HD23 ' A' ' 847' ' ' LEU . 5.4 mt -78.81 -21.47 47.69 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.885 0.374 . . . . 0.0 111.127 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 102.21 12.15 34.55 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.662 -0.78 . . . . 0.0 113.545 174.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 849' ' ' TYR . . . . . 0.598 ' HB2' HD13 ' A' ' 844' ' ' LEU . 66.6 m-85 -104.68 138.4 41.04 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.958 0.379 . . . . 0.0 109.986 178.658 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 850' ' ' GLN . . . . . 0.543 ' HB2' ' O ' ' A' ' 825' ' ' MET . 4.7 mp0 -73.03 121.08 19.57 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 179.275 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 851' ' ' CYS . . . . . 0.471 ' SG ' ' HB3' ' A' ' 844' ' ' LEU . 0.0 OUTLIER -108.13 126.83 53.23 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 120.988 0.423 . . . . 0.0 111.607 -173.884 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 852' ' ' LYS . . . . . 0.422 ' O ' HD12 ' A' ' 828' ' ' LEU . 0.0 OUTLIER -106.36 111.76 24.48 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 174.797 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 853' ' ' THR . . . . . 0.468 ' HA ' HG23 ' A' ' 829' ' ' VAL . 0.9 OUTLIER -91.18 124.58 35.5 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 120.93 0.395 . . . . 0.0 111.451 -174.632 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 854' ' ' ALA . . . . . 0.621 ' HB3' HG22 ' A' ' 830' ' ' VAL . . . -130.11 142.28 50.61 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.961 -179.681 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 855' ' ' ASN . . . . . 0.56 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 20.2 t30 -124.22 74.99 1.34 Allowed 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 177.026 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 856' ' ' ASP . . . . . 0.743 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 12.0 t70 166.14 147.37 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.036 177.043 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -71.9 -41.91 54.13 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.566 178.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 2.0 t -73.7 -34.7 41.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.077 0.465 . . . . 0.0 110.598 -178.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 859' ' ' ASP . . . . . 0.743 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 1.1 t0 -64.27 -27.74 69.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.939 -178.867 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -62.14 -38.39 88.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.139 0.495 . . . . 0.0 110.352 176.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 861' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.14 -33.01 63.39 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.93 176.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -60.56 -53.76 53.64 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.858 178.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 10.7 p -66.01 -32.21 57.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.769 0.318 . . . . 0.0 110.945 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 864' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.99 -40.46 97.82 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.565 176.578 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 7.4 m -74.31 -27.28 60.64 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.862 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 866' ' ' LYS . . . . . 0.536 ' HA ' ' HD2' ' A' ' 866' ' ' LYS . 1.3 tptm -69.79 -55.85 8.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.716 179.532 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 867' ' ' ASN . . . . . 0.482 ' HB3' ' H ' ' A' ' 868' ' ' HIS . 6.0 t30 -119.15 -105.5 0.39 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.905 178.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 868' ' ' HIS . . . . . 0.482 ' H ' ' HB3' ' A' ' 867' ' ' ASN . 0.1 OUTLIER 178.93 155.54 0.45 Allowed 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 178.571 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 869' ' ' ILE . . . . . 0.452 HG12 ' HB2' ' A' ' 828' ' ' LEU . 0.7 OUTLIER -143.25 147.98 19.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 -179.794 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.69 -49.98 5.13 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.694 0.283 . . . . 0.0 111.356 -178.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 871' ' ' ILE . . . . . 0.49 ' HB ' HG23 ' A' ' 827' ' ' ILE . 18.7 mm -111.54 123.98 67.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.272 -178.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 872' ' ' VAL . . . . . 0.607 HG13 HD23 ' A' ' 828' ' ' LEU . 1.8 t -109.52 125.92 66.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.217 -179.086 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 873' ' ' LEU . . . . . 0.698 HD11 HD12 ' A' ' 936' ' ' LEU . 47.3 mt -111.49 100.83 9.32 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 173.456 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 5.7 m -105.77 101.49 11.0 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.939 0.4 . . . . 0.0 111.22 -176.206 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 875' ' ' ASP . . . . . 0.673 ' OD1' ' HG2' ' A' ' 925' ' ' LYS . 0.6 OUTLIER -92.62 106.6 18.55 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.383 -179.517 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -115.45 111.99 37.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.314 0.578 . . . . 0.0 112.134 -172.25 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -119.65 -44.59 2.54 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.664 172.044 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 878' ' ' MET . . . . . 0.425 ' HB2' ' HB2' ' A' ' 832' ' ' ASP . 4.4 tpp . . . . . 0 CA--C 1.537 0.443 0 CA-C-N 115.559 -0.746 . . . . 0.0 112.699 -178.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 0.273 0 N-CA-C 112.047 -0.421 . . . . 0.0 112.047 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -137.22 -40.91 0.58 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -68.47 -47.33 67.39 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.677 -179.017 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 886' ' ' LEU . . . . . 0.647 ' HG ' ' N ' ' A' ' 887' ' ' THR . 0.0 OUTLIER -65.55 -43.55 89.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.646 -0.252 . . . . 0.0 110.384 -179.495 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 887' ' ' THR . . . . . 0.647 ' N ' ' HG ' ' A' ' 886' ' ' LEU . 0.0 OUTLIER -62.52 -44.89 95.25 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.218 0.532 . . . . 0.0 110.662 -179.483 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 888' ' ' GLN . . . . . 0.79 ' HA ' ' HD3' ' A' ' 891' ' ' ARG . 15.9 tt0 -63.47 -41.31 98.61 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.624 177.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -67.27 -41.66 85.13 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.192 0.441 . . . . 0.0 112.192 -175.185 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 890' ' ' ILE . . . . . 0.614 HG13 ' O ' ' A' ' 886' ' ' LEU . 22.2 mt -68.54 -42.63 83.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.881 -179.478 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 891' ' ' ARG . . . . . 0.79 ' HD3' ' HA ' ' A' ' 888' ' ' GLN . 0.7 OUTLIER -68.92 -23.93 64.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.032 0.444 . . . . 0.0 110.216 177.262 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 -71.18 -42.14 69.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.367 176.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 893' ' ' LEU . . . . . 0.493 ' HA ' HD22 ' A' ' 893' ' ' LEU . 0.2 OUTLIER -71.26 -32.8 69.14 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.183 179.071 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 115.66 87.5 1.41 Allowed Glycine 0 N--CA 1.441 -1.017 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.747 178.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 895' ' ' LEU . . . . . 0.524 HD12 HG22 ' A' ' 890' ' ' ILE . 0.3 OUTLIER -63.74 109.27 1.66 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.125 0.488 . . . . 0.0 110.602 177.781 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -120.77 16.95 11.9 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.805 0.812 . . . . 0.0 109.469 176.284 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 897' ' ' LEU . . . . . 0.463 HD12 HG21 ' A' ' 872' ' ' VAL . 0.0 OUTLIER -139.06 123.88 11.63 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 114.801 -1.09 . . . . 0.0 109.283 -176.665 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 898' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 897' ' ' LEU . 35.5 Cg_exo -59.28 121.41 9.86 Favored 'Trans proline' 0 C--O 1.238 0.494 0 C-N-CA 122.888 2.392 . . . . 0.0 112.305 -177.69 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 899' ' ' VAL . . . . . 0.558 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 26.5 t -98.36 108.68 22.45 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 CA-C-O 121.257 0.551 . . . . 0.0 110.639 -179.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 900' ' ' ILE . . . . . 0.421 HG23 ' HB2' ' A' ' 921' ' ' SER . 2.5 mt -84.41 92.42 3.11 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 175.445 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 901' ' ' GLY . . . . . 0.711 ' HA3' ' SD ' ' A' ' 919' ' ' MET . . . -83.4 122.41 5.77 Favored Glycine 0 N--CA 1.441 -1.026 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.075 -176.093 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 902' ' ' VAL . . . . . 0.682 ' HB ' ' HB2' ' A' ' 923' ' ' LEU . 0.2 OUTLIER -111.57 117.09 54.28 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 178.459 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 903' ' ' THR . . . . . 0.651 ' HB ' ' HB2' ' A' ' 906' ' ' ALA . 0.0 OUTLIER -107.64 148.88 28.77 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.917 -172.271 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 904' ' ' ALA . . . . . 0.66 ' HB2' ' HG3' ' A' ' 925' ' ' LYS . . . -90.51 134.51 34.31 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.494 175.538 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 53.69 43.26 31.34 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.298 179.627 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 906' ' ' ALA . . . . . 0.651 ' HB2' ' HB ' ' A' ' 903' ' ' THR . . . -92.25 93.76 8.82 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.059 177.245 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -52.33 -49.11 64.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.254 -178.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -127.06 88.56 2.83 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.103 176.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 909' ' ' GLU . . . . . 0.7 ' HB3' ' HB2' ' A' ' 922' ' ' CYS . 10.7 mt-10 -57.85 -34.97 70.28 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.179 -176.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 910' ' ' GLU . . . . . 0.529 ' H ' ' HG3' ' A' ' 910' ' ' GLU . 0.0 OUTLIER -58.78 -57.03 14.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.998 178.638 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 8.0 tttt -65.52 -27.93 68.82 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.197 179.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -62.91 -44.96 94.67 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 176.022 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 913' ' ' ARG . . . . . 0.508 ' O ' ' HD2' ' A' ' 913' ' ' ARG . 0.0 OUTLIER -65.63 -37.9 87.86 Favored 'General case' 0 C--O 1.225 -0.201 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.053 175.999 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 19.0 m -58.66 -37.16 75.39 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.871 0.367 . . . . 0.0 110.937 177.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.84 -51.23 42.69 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.755 -178.206 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 916' ' ' GLU . . . . . 0.446 ' OE2' ' HD3' ' A' ' 913' ' ' ARG . 0.0 OUTLIER -77.11 -42.64 37.18 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 111.627 0.232 . . . . 0.0 111.627 -175.219 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 1.4 m 53.06 52.15 14.35 Favored 'General case' 0 C--O 1.235 0.32 0 O-C-N 123.464 0.478 . . . . 0.0 112.149 -178.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -139.66 -32.8 0.17 Allowed Glycine 0 CA--C 1.523 0.578 0 C-N-CA 120.51 -0.853 . . . . 0.0 113.745 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 919' ' ' MET . . . . . 0.711 ' SD ' ' HA3' ' A' ' 901' ' ' GLY . 20.2 mtt -76.58 -93.54 0.03 OUTLIER 'General case' 0 C--O 1.238 0.488 0 CA-C-N 117.311 0.556 . . . . 0.0 112.171 -174.311 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 920' ' ' ASP . . . . . 0.52 ' HB2' ' O ' ' A' ' 919' ' ' MET . 45.0 t0 162.29 -73.16 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.191 0.996 . . . . 0.0 109.643 176.705 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . 0.421 ' HB2' HG23 ' A' ' 900' ' ' ILE . 0.0 OUTLIER -105.91 172.02 7.03 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.054 -179.765 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 922' ' ' CYS . . . . . 0.7 ' HB2' ' HB3' ' A' ' 909' ' ' GLU . 0.8 OUTLIER -140.42 136.78 33.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.292 0.568 . . . . 0.0 111.881 -178.278 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 923' ' ' LEU . . . . . 0.682 ' HB2' ' HB ' ' A' ' 902' ' ' VAL . 0.3 OUTLIER -133.73 178.21 7.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.192 177.158 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -104.18 143.1 33.39 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.268 178.594 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 925' ' ' LYS . . . . . 0.673 ' HG2' ' OD1' ' A' ' 875' ' ' ASP . 0.0 OUTLIER -48.63 -43.5 63.11 Favored Pre-proline 0 N--CA 1.475 0.823 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -176.034 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 926' ' ' PRO . . . . . 0.514 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 37.7 Cg_endo -66.71 68.44 0.51 Allowed 'Trans proline' 0 C--N 1.356 0.929 0 C-N-CA 121.885 1.723 . . . . 0.0 112.998 175.441 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 927' ' ' VAL . . . . . 0.704 HG13 ' HB ' ' A' ' 931' ' ' VAL . 42.3 t -87.8 110.67 21.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.038 0.447 . . . . 0.0 110.425 177.225 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.36 167.49 20.16 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.29 176.074 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 929' ' ' LEU . . . . . 0.438 ' HA ' HG23 ' A' ' 932' ' ' ILE . 0.7 OUTLIER -54.62 -38.66 67.09 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.69 0.281 . . . . 0.0 111.604 -177.975 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -68.72 -23.35 64.34 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.854 0.359 . . . . 0.0 110.747 -177.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 931' ' ' VAL . . . . . 0.704 ' HB ' HG13 ' A' ' 927' ' ' VAL . 18.4 t -78.13 -41.57 26.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.418 179.062 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 932' ' ' ILE . . . . . 0.438 HG23 ' HA ' ' A' ' 929' ' ' LEU . 0.0 OUTLIER -66.64 -37.16 78.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 177.277 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -60.7 -49.05 79.08 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.439 -179.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 934' ' ' GLN . . . . . 0.453 ' HG3' ' H ' ' A' ' 935' ' ' THR . 0.3 OUTLIER -71.74 -48.96 43.45 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -175.941 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 935' ' ' THR . . . . . 0.453 ' H ' ' HG3' ' A' ' 934' ' ' GLN . 1.6 m -66.73 -43.4 84.32 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 111.828 0.307 . . . . 0.0 111.828 -174.363 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 936' ' ' LEU . . . . . 0.698 HD12 HD11 ' A' ' 873' ' ' LEU . 0.3 OUTLIER -66.23 -49.92 65.6 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.636 0.255 . . . . 0.0 110.812 -179.577 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 95.0 m -62.2 -46.06 90.61 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.25 -178.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 938' ' ' LEU . . . . . 0.466 ' O ' ' HB3' ' A' ' 942' ' ' ARG . 29.3 tp -62.82 -47.77 81.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.182 -178.46 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -69.26 -40.73 77.67 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.613 -0.267 . . . . 0.0 111.171 -177.097 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -66.36 -40.98 90.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.737 0.303 . . . . 0.0 111.006 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 941' ' ' GLU . . . . . 0.584 ' O ' ' HG3' ' A' ' 944' ' ' ARG . 0.0 OUTLIER -69.99 -33.8 72.51 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.87 0.366 . . . . 0.0 110.216 178.473 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 942' ' ' ARG . . . . . 0.466 ' HB3' ' O ' ' A' ' 938' ' ' LEU . 0.0 OUTLIER -66.84 -37.7 84.98 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.446 -178.511 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 943' ' ' VAL . . . . . 0.461 ' N ' ' HG3' ' A' ' 942' ' ' ARG . 17.1 m -78.08 -33.8 18.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.646 -0.422 . . . . 0.0 110.954 -177.496 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 944' ' ' ARG . . . . . 0.584 ' HG3' ' O ' ' A' ' 941' ' ' GLU . 0.2 OUTLIER -73.56 -21.63 60.3 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.32 177.42 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 16.0 mmtp -67.32 -52.4 40.79 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-O 121.33 0.586 . . . . 0.0 109.885 171.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 50.3 m -63.5 -44.32 94.67 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.123 -0.944 . . . . 0.0 111.428 -177.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -68.38 -60.94 2.07 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.77 -0.196 . . . . 0.0 110.51 178.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 6.7 t70 . . . . . 0 N--CA 1.472 0.647 0 C-N-CA 123.724 0.81 . . . . 0.0 112.79 175.624 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 705' ' ' SER . . . . . 0.474 ' HA ' ' C ' ' A' ' 730' ' ' GLY . 0.8 OUTLIER . . . . . 0 N--CA 1.455 -0.203 0 CA-C-O 120.63 0.252 . . . . 0.0 111.012 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 108.51 -36.13 4.54 Favored Glycine 0 CA--C 1.52 0.355 0 C-N-CA 120.384 -0.912 . . . . 0.0 114.037 171.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 707' ' ' LYS . . . . . 0.403 ' NZ ' ' HB3' ' A' ' 744' ' ' GLU . 7.2 mmmt -75.4 155.61 36.23 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 117.011 0.406 . . . . 0.0 111.624 -174.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 708' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -97.63 149.32 22.38 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.875 178.585 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -134.88 131.7 37.65 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 177.454 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 710' ' ' TRP . . . . . 0.471 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 70.4 m95 -105.06 124.72 50.01 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.901 0.382 . . . . 0.0 110.679 -177.715 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 711' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -120.51 138.97 53.55 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.198 0.523 . . . . 0.0 111.046 -179.257 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -124.6 67.39 1.09 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.125 176.002 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 713' ' ' VAL . . . . . 0.754 HG13 ' HB3' ' A' ' 750' ' ' ASP . 41.4 t -122.39 122.44 66.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.277 -177.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 714' ' ' ARG . . . . . 0.48 ' HB2' HH11 ' A' ' 714' ' ' ARG . 0.1 OUTLIER -86.74 -25.29 24.79 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 176.271 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -67.63 104.53 1.63 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.274 178.271 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 716' ' ' ALA . . . . . 0.652 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -60.45 -43.25 97.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.065 -0.516 . . . . 0.0 112.0 -173.071 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.02 -39.64 95.36 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.193 0.521 . . . . 0.0 110.524 179.538 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.04 -49.57 27.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.155 -178.032 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 719' ' ' CYS . . . . . 0.739 ' HB3' ' HB ' ' A' ' 713' ' ' VAL . 28.4 p -64.79 -40.59 95.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.556 -177.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 720' ' ' GLN . . . . . 0.554 ' HB2' ' O ' ' A' ' 716' ' ' ALA . 0.0 OUTLIER -63.23 -40.39 97.31 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.382 -179.543 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -57.68 -48.76 78.63 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.958 0.409 . . . . 0.0 110.47 178.842 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 722' ' ' LEU . . . . . 0.469 ' O ' ' HG ' ' A' ' 726' ' ' LEU . 6.4 mt -67.66 -48.19 67.34 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.58 -178.342 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 723' ' ' GLU . . . . . 0.885 ' HA ' HG11 ' A' ' 733' ' ' VAL . 0.0 OUTLIER -62.57 -43.97 97.5 Favored 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 111.579 0.214 . . . . 0.0 111.579 -174.126 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 724' ' ' THR . . . . . 0.512 ' O ' ' HB3' ' A' ' 728' ' ' ARG . 28.1 m -64.83 -39.26 93.29 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.715 0.293 . . . . 0.0 110.811 -179.613 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 44.0 m -65.38 -32.57 74.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.783 0.325 . . . . 0.0 111.388 179.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 726' ' ' LEU . . . . . 0.675 HD22 HD12 ' A' ' 731' ' ' ILE . 24.9 mt -81.95 -47.9 12.14 Favored 'General case' 0 C--N 1.322 -0.626 0 O-C-N 122.208 -0.307 . . . . 0.0 110.921 -178.418 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 727' ' ' GLN . . . . . 0.456 ' HG2' ' HA ' ' A' ' 724' ' ' THR . 3.1 pt20 -67.92 -25.08 65.3 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.527 -177.283 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 728' ' ' ARG . . . . . 0.512 ' HB3' ' O ' ' A' ' 724' ' ' THR . 0.0 OUTLIER -64.03 -31.37 72.54 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 121.114 0.483 . . . . 0.0 110.304 178.303 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -85.67 -51.01 6.75 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.378 179.047 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 730' ' ' GLY . . . . . 0.474 ' C ' ' HA ' ' A' ' 705' ' ' SER . . . 154.32 -6.29 0.33 Allowed Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.508 -0.853 . . . . 0.0 112.689 178.448 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 731' ' ' ILE . . . . . 0.675 HD12 HD22 ' A' ' 726' ' ' LEU . 0.2 OUTLIER -75.3 114.08 14.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 176.604 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 732' ' ' VAL . . . . . . . . . . . . . 2.1 p -74.58 113.96 13.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 121.719 0.771 . . . . 0.0 110.78 -176.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 733' ' ' VAL . . . . . 0.885 HG11 ' HA ' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -85.94 136.88 21.92 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.861 -179.21 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -145.36 137.7 25.79 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.483 177.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -61.47 124.86 21.81 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 173.81 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 736' ' ' TYR . . . . . 0.471 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 47.2 t80 -55.71 -47.05 77.49 Favored 'General case' 0 C--O 1.232 0.17 0 O-C-N 123.242 0.339 . . . . 0.0 110.278 -179.259 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 54.61 -108.78 0.45 Allowed 'General case' 0 CA--C 1.53 0.183 0 O-C-N 123.728 0.643 . . . . 0.0 110.431 177.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -129.62 37.67 2.13 Favored Glycine 0 N--CA 1.445 -0.743 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 176.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -84.19 -172.48 4.18 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.002 0.43 . . . . 0.0 111.31 -177.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.61 126.89 54.59 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.977 -178.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 741' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -71.61 123.46 9.46 Favored 'Trans proline' 0 N--CA 1.462 -0.345 0 C-N-CA 122.612 2.208 . . . . 0.0 111.876 175.14 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 742' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.47 134.93 19.49 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-O 120.699 0.285 . . . . 0.0 111.066 179.691 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 743' ' ' PRO . . . . . 0.514 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 57.3 Cg_endo -71.15 3.72 3.27 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 123.102 2.535 . . . . 0.0 112.464 179.419 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 744' ' ' GLU . . . . . 0.403 ' HB3' ' NZ ' ' A' ' 707' ' ' LYS . 2.2 mm-40 -109.95 -12.29 14.57 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.714 178.792 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 85.2 m-20 -114.47 165.44 12.74 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.722 -172.106 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 746' ' ' VAL . . . . . 0.617 HG21 HD21 ' A' ' 795' ' ' LEU . 18.8 m -117.1 148.43 19.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.965 -175.334 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 747' ' ' LEU . . . . . 0.515 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 0.3 OUTLIER -104.72 113.27 26.75 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.91 175.764 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 3.7 mt -97.45 113.53 32.16 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 175.19 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -114.77 164.74 13.65 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.576 -170.089 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 750' ' ' ASP . . . . . 0.754 ' HB3' HG13 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -125.62 123.35 38.81 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 168.548 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 751' ' ' GLU . . . . . 0.877 ' HG2' HH21 ' A' ' 767' ' ' ARG . 0.0 OUTLIER 61.95 176.84 0.13 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.681 -172.8 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 752' ' ' VAL . . . . . 0.527 HG23 ' HB ' ' A' ' 772' ' ' ILE . 2.6 p -69.86 131.76 33.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.402 -176.182 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 4.4 p -120.41 164.69 16.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.161 179.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.2 50.29 1.91 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.879 0.371 . . . . 0.0 111.023 -179.531 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -152.71 132.17 12.95 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.149 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 6.2 tptp -89.97 -18.76 25.44 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.886 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 757' ' ' TRP . . . . . 0.515 ' CD2' ' HB2' ' A' ' 747' ' ' LEU . 73.7 t-105 67.37 96.98 0.06 Allowed 'General case' 0 C--O 1.234 0.248 0 C-N-CA 123.237 0.615 . . . . 0.0 111.928 176.558 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 32.3 tp60 -86.84 58.15 4.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.445 0.641 . . . . 0.0 109.789 173.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 759' ' ' GLY . . . . . 0.514 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -119.25 -147.29 8.06 Favored Glycine 0 N--CA 1.443 -0.834 0 CA-C-N 115.696 -0.684 . . . . 0.0 112.016 -179.075 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 5.3 ttm180 -77.01 -59.74 2.65 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.204 0.526 . . . . 0.0 109.922 177.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -152.88 155.12 36.44 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.0 -179.154 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 2.7 p -128.07 128.53 68.94 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 177.046 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 763' ' ' VAL . . . . . 0.551 HG13 ' HB2' ' A' ' 781' ' ' TRP . 0.1 OUTLIER -118.09 102.94 13.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.48 -178.945 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 764' ' ' THR . . . . . 0.481 ' HB ' HG23 ' A' ' 782' ' ' VAL . 91.0 m -100.66 124.45 46.27 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.798 -0.637 . . . . 0.0 112.022 -174.693 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 765' ' ' PHE . . . . . 0.562 ' HA ' ' O ' ' A' ' 783' ' ' HIS . 34.5 m-85 -79.79 78.49 6.37 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.539 173.345 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 766' ' ' CYS . . . . . 0.472 ' SG ' HG21 ' A' ' 772' ' ' ILE . 0.0 OUTLIER -106.93 133.24 51.88 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.327 -172.195 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 767' ' ' ARG . . . . . 0.877 HH21 ' HG2' ' A' ' 751' ' ' GLU . 0.0 OUTLIER -111.0 -24.62 10.25 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 174.06 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -103.41 -71.33 0.73 Allowed 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.084 175.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . 0.59 ' HB2' HG22 ' A' ' 772' ' ' ILE . 0.0 OUTLIER 66.6 129.0 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 122.112 0.958 . . . . 0.0 112.377 179.735 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 770' ' ' ILE . . . . . 0.445 HD12 HG11 ' A' ' 752' ' ' VAL . 6.4 mt -128.66 -79.96 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.021 -0.991 . . . . 0.0 109.681 176.05 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -82.69 -21.2 60.19 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.932 -0.651 . . . . 0.0 111.846 177.327 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 772' ' ' ILE . . . . . 0.59 HG22 ' HB2' ' A' ' 769' ' ' HIS . 0.3 OUTLIER -67.45 141.91 95.99 Favored Pre-proline 0 C--O 1.237 0.405 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 176.395 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 773' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -91.05 -143.41 0.02 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.098 0 C-N-CA 123.156 2.57 . . . . 0.0 113.22 -174.04 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . 0.547 ' HA ' ' HB ' ' A' ' 782' ' ' VAL . 0.4 OUTLIER -176.24 -172.26 0.47 Allowed 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 -177.729 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 775' ' ' GLU . . . . . 0.552 ' HA ' ' O ' ' A' ' 780' ' ' GLU . 0.6 OUTLIER -65.81 52.73 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 113.021 0.748 . . . . 0.0 113.021 175.745 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.3 -21.55 23.11 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 169.624 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 777' ' ' ALA . . . . . 0.449 ' HB1' ' HD2' ' A' ' 778' ' ' PRO . . . -133.03 157.68 77.75 Favored Pre-proline 0 N--CA 1.449 -0.482 0 CA-C-N 114.382 -1.281 . . . . 0.0 108.443 174.82 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 778' ' ' PRO . . . . . 0.449 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 49.3 Cg_endo -68.58 -4.3 12.81 Favored 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 122.552 2.168 . . . . 0.0 114.089 -173.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . -112.58 -4.0 25.16 Favored Glycine 0 N--CA 1.453 -0.167 0 C-N-CA 120.575 -0.821 . . . . 0.0 112.358 -176.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 780' ' ' GLU . . . . . 0.552 ' O ' ' HA ' ' A' ' 775' ' ' GLU . 6.7 mt-10 -118.86 125.45 49.55 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 -179.167 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 781' ' ' TRP . . . . . 0.551 ' HB2' HG13 ' A' ' 763' ' ' VAL . 15.2 m95 -130.25 147.16 51.94 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 -177.717 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . 0.547 ' HB ' ' HA ' ' A' ' 774' ' ' LEU . 0.4 OUTLIER -142.69 145.94 22.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-O 120.848 0.356 . . . . 0.0 110.5 179.46 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 783' ' ' HIS . . . . . 0.562 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 2.1 t-160 -157.5 135.96 11.24 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.975 178.278 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -98.21 100.85 12.18 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.404 175.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 785' ' ' VAL . . . . . 0.488 ' HB ' ' HD3' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -163.21 -172.9 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 179.937 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -117.66 39.28 3.37 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.639 177.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 787' ' ' ALA . . . . . 0.424 ' N ' ' HD3' ' A' ' 788' ' ' PRO . . . 57.87 61.94 5.46 Favored Pre-proline 0 N--CA 1.463 0.213 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.632 -179.186 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 788' ' ' PRO . . . . . 0.488 ' HD3' ' HB ' ' A' ' 785' ' ' VAL . 19.3 Cg_exo -66.93 -65.51 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.433 2.089 . . . . 0.0 111.979 -177.448 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -171.63 -16.61 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 178.17 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 790' ' ' GLU . . . . . . . . . . . . . 6.3 pm0 -76.15 -35.46 59.19 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 121.006 -0.278 . . . . 0.0 111.407 -173.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 791' ' ' LEU . . . . . 0.52 HD22 ' CE2' ' A' ' 765' ' ' PHE . 0.2 OUTLIER -73.31 -50.18 6.47 Favored Pre-proline 0 CA--C 1.533 0.308 0 CA-C-O 119.489 -0.291 . . . . 0.0 111.77 -179.128 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 792' ' ' PRO . . . . . 0.477 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 11.0 Cg_endo -57.37 -32.87 95.12 Favored 'Trans proline' 0 C--N 1.357 1.024 0 C-N-CA 121.7 1.6 . . . . 0.0 112.212 175.216 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -70.93 -44.27 66.5 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.952 0.406 . . . . 0.0 110.678 177.198 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -61.9 -40.47 95.56 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.506 178.452 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 795' ' ' LEU . . . . . 0.617 HD21 HG21 ' A' ' 746' ' ' VAL . 0.0 OUTLIER -65.13 -34.7 79.01 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.119 -179.453 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -61.4 -41.73 97.6 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.255 0.55 . . . . 0.0 110.021 176.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 797' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 797' ' ' ARG . 2.7 ttt-85 -71.28 -32.37 68.59 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.734 178.614 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 2.8 mt -66.22 -45.75 89.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.826 179.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -75.17 -43.55 51.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.149 -176.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 4.9 mt . . . . . 0 C--O 1.236 0.366 0 O-C-N 123.644 0.59 . . . . 0.0 111.534 179.022 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 25.6 t0 . . . . . 0 N--CA 1.456 -0.14 0 CA-C-O 121.076 0.465 . . . . 0.0 110.884 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -107.6 135.34 49.22 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.404 175.292 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 826' ' ' MET . . . . . 0.653 ' HG3' ' HA ' ' A' ' 869' ' ' ILE . 0.4 OUTLIER -115.76 124.11 49.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.277 0.56 . . . . 0.0 111.587 -173.684 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 827' ' ' ILE . . . . . 0.4 HG23 ' HB ' ' A' ' 871' ' ' ILE . 3.1 mm -117.34 138.77 46.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.086 178.516 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 828' ' ' LEU . . . . . 0.661 ' HB2' HG21 ' A' ' 869' ' ' ILE . 0.5 OUTLIER -105.21 122.39 45.82 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.727 0.299 . . . . 0.0 110.728 179.309 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -104.31 100.82 11.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.993 176.19 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 830' ' ' VAL . . . . . 0.432 HG22 HD22 ' A' ' 828' ' ' LEU . 5.1 t -109.04 112.2 39.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.304 -179.38 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 831' ' ' ASP . . . . . 0.748 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 11.5 t0 -121.58 142.94 49.61 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 178.778 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -78.75 -21.01 48.6 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.699 -178.765 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 15.7 m80 -114.31 109.85 48.49 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.132 177.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -51.13 -38.57 60.69 Favored 'Trans proline' 0 CA--C 1.531 0.368 0 C-N-CA 123.766 2.978 . . . . 0.0 114.668 -173.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -64.19 -38.99 83.92 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-O 121.223 0.535 . . . . 0.0 110.678 -179.275 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 836' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -73.57 -37.83 65.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.613 178.41 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 837' ' ' ARG . . . . . 0.748 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 16.2 ttp180 -55.83 -44.34 77.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.448 176.579 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 7.1 ttm180 -59.18 -41.78 89.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.789 178.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 1.7 tp -58.88 -52.6 65.02 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.744 -179.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 840' ' ' LEU . . . . . 0.489 HD11 ' HA ' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -72.99 -30.44 63.8 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 120.79 -0.364 . . . . 0.0 111.597 -177.476 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -66.44 -37.55 85.43 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.097 0.475 . . . . 0.0 110.702 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -67.9 -41.04 83.33 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.301 178.042 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 843' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -62.74 -50.8 69.63 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.679 178.459 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 844' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.48 -35.78 74.75 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.993 178.038 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -62.97 -35.01 91.49 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.058 177.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 4.2 m -76.64 -26.81 55.3 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.873 0.368 . . . . 0.0 110.521 178.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 847' ' ' LEU . . . . . 0.611 HD21 ' HG2' ' A' ' 933' ' ' LYS . 3.6 mp -63.13 -33.68 75.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.013 177.503 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 97.59 26.91 9.49 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.692 -0.765 . . . . 0.0 112.918 176.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 849' ' ' TYR . . . . . 0.449 ' HE2' HD23 ' A' ' 847' ' ' LEU . 38.9 m-85 -112.09 155.77 23.32 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 176.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -69.08 118.0 11.43 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 178.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -107.3 126.19 52.12 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.16 0.505 . . . . 0.0 111.399 -173.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -111.0 140.44 45.53 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 171.633 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -118.31 144.05 46.14 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 120.559 -0.456 . . . . 0.0 111.643 -174.013 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 854' ' ' ALA . . . . . . . . . . . . . . . -149.21 150.55 32.8 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.157 178.024 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 855' ' ' ASN . . . . . 0.543 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 13.6 t-20 -133.84 74.97 1.57 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.399 175.572 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 856' ' ' ASP . . . . . 0.668 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 4.1 t70 165.53 170.44 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.118 -0.946 . . . . 0.0 108.836 -178.302 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -92.73 -47.29 3.22 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.865 -0.683 . . . . 0.0 111.922 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 858' ' ' VAL . . . . . 0.424 HG22 ' H ' ' A' ' 858' ' ' VAL . 0.0 OUTLIER -71.67 -31.1 40.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.984 0.421 . . . . 0.0 110.661 -178.955 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 859' ' ' ASP . . . . . 0.668 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 0.3 OUTLIER -64.23 -35.4 80.68 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.007 -179.53 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -68.34 -33.64 74.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.181 0.515 . . . . 0.0 110.49 178.65 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 861' ' ' LEU . . . . . 0.595 HD21 ' HG ' ' A' ' 893' ' ' LEU . 15.3 tp -73.59 -32.37 64.07 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.596 179.056 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 -62.82 -47.12 84.8 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.816 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.81 -31.27 50.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 C-N-CA 120.861 -0.336 . . . . 0.0 110.61 177.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 864' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.84 -34.84 75.19 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 120.704 0.288 . . . . 0.0 111.138 179.118 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.89 -33.41 34.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.929 0.395 . . . . 0.0 110.482 179.426 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.14 -46.15 78.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.525 179.613 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -144.39 129.33 18.45 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 176.855 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 10.0 t-80 -70.7 88.36 0.71 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.8 0.333 . . . . 0.0 111.291 -177.335 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 869' ' ' ILE . . . . . 0.661 HG21 ' HB2' ' A' ' 828' ' ' LEU . 1.4 mp -65.43 139.91 20.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.524 174.101 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 35.6 m-20 -73.91 -60.34 2.3 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.066 -172.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 871' ' ' ILE . . . . . 0.533 HD12 ' HB3' ' A' ' 939' ' ' TYR . 8.0 mm -117.43 128.61 74.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.223 -178.482 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 872' ' ' VAL . . . . . 0.401 HG22 ' HB2' ' A' ' 828' ' ' LEU . 48.1 t -115.33 125.72 72.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.34 179.324 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 873' ' ' LEU . . . . . 0.665 HD22 HD12 ' A' ' 900' ' ' ILE . 0.1 OUTLIER -109.13 121.73 45.77 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 178.956 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -106.78 96.49 6.48 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.033 178.202 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 875' ' ' ASP . . . . . 0.581 ' HA ' HG13 ' A' ' 902' ' ' VAL . 22.1 t0 -97.89 110.29 22.89 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.719 179.388 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -121.89 132.1 71.64 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.41 -173.591 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -99.52 12.2 37.09 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.773 0.797 . . . . 0.0 108.879 171.421 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 6.0 ttm . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 114.68 -1.146 . . . . 0.0 110.27 179.228 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.603 0 N-CA-C 111.368 -0.693 . . . . 0.0 111.368 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -84.43 -32.43 24.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.519 0.676 . . . . 0.0 109.425 -178.246 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.55 -32.77 63.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.796 178.019 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 4.1 tp -67.06 -51.52 53.56 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.753 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -45.26 92.79 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.213 -178.557 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 888' ' ' GLN . . . . . 0.558 ' HA ' ' HD3' ' A' ' 891' ' ' ARG . 7.7 tp-100 -56.98 -42.6 80.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.164 0.506 . . . . 0.0 110.737 178.609 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.97 -38.65 66.62 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.077 -178.613 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 890' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -69.98 -37.13 71.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.726 0.298 . . . . 0.0 111.203 -176.682 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 891' ' ' ARG . . . . . 0.558 ' HD3' ' HA ' ' A' ' 888' ' ' GLN . 1.9 ptm180 -74.15 -28.7 61.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.824 0.345 . . . . 0.0 110.613 178.005 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -78.07 -27.99 48.74 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.075 0.464 . . . . 0.0 110.752 178.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 893' ' ' LEU . . . . . 0.595 ' HG ' HD21 ' A' ' 861' ' ' LEU . 1.8 mm? -80.59 -11.34 59.66 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.239 179.448 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 86.28 56.93 2.19 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.294 178.271 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 895' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 895' ' ' LEU . 0.2 OUTLIER -57.72 135.16 56.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.111 0.481 . . . . 0.0 110.577 178.471 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -141.01 49.47 1.66 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.305 0.574 . . . . 0.0 110.637 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 897' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -157.79 151.73 19.74 Favored Pre-proline 0 C--N 1.32 -0.698 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.704 -177.274 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_exo -73.18 112.93 3.64 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 122.454 2.103 . . . . 0.0 111.496 177.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 899' ' ' VAL . . . . . 0.791 HG13 ' HA ' ' A' ' 919' ' ' MET . 0.2 OUTLIER -115.41 130.79 69.4 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 CA-C-O 121.5 0.667 . . . . 0.0 110.126 176.746 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 900' ' ' ILE . . . . . 0.665 HD12 HD22 ' A' ' 873' ' ' LEU . 21.2 mt -96.34 117.0 39.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.719 -176.145 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 901' ' ' GLY . . . . . 0.554 ' HA3' ' HD3' ' A' ' 913' ' ' ARG . . . -92.7 105.82 3.34 Favored Glycine 0 N--CA 1.444 -0.811 0 C-N-CA 120.621 -0.799 . . . . 0.0 111.989 177.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 902' ' ' VAL . . . . . 0.836 ' HB ' HD12 ' A' ' 923' ' ' LEU . 0.1 OUTLIER -113.83 126.18 71.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 177.49 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 903' ' ' THR . . . . . 0.442 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.4 OUTLIER -143.87 165.23 28.3 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.679 -0.237 . . . . 0.0 110.398 -175.026 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 904' ' ' ALA . . . . . 0.417 ' HB2' ' CB ' ' A' ' 925' ' ' LYS . . . -119.44 103.12 9.17 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.968 0.414 . . . . 0.0 111.722 -178.464 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 52.22 56.23 8.03 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.064 -0.971 . . . . 0.0 112.856 171.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 906' ' ' ALA . . . . . 0.76 ' HB3' ' HB3' ' A' ' 909' ' ' GLU . . . -95.75 46.91 1.1 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.073 0.463 . . . . 0.0 110.123 174.676 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 907' ' ' LEU . . . . . 0.492 ' HB3' ' H ' ' A' ' 908' ' ' ALA . 0.1 OUTLIER 64.94 -108.71 0.18 Allowed 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.115 -178.998 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 908' ' ' ALA . . . . . 0.492 ' H ' ' HB3' ' A' ' 907' ' ' LEU . . . -98.53 33.56 2.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.96 0.409 . . . . 0.0 110.682 -177.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 909' ' ' GLU . . . . . 0.76 ' HB3' ' HB3' ' A' ' 906' ' ' ALA . 0.0 OUTLIER -52.1 -47.15 65.39 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.42 -0.809 . . . . 0.0 112.314 -176.625 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 910' ' ' GLU . . . . . 0.68 ' HA ' ' NH1' ' A' ' 913' ' ' ARG . 1.5 pt-20 -64.82 -37.46 87.68 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.978 -176.668 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.39 -42.34 71.84 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.872 0.368 . . . . 0.0 110.269 178.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -61.81 -40.59 95.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.706 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 913' ' ' ARG . . . . . 0.87 ' HD2' ' HB2' ' A' ' 922' ' ' CYS . 3.0 mtm105 -59.81 -45.54 92.03 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.756 178.128 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 80.7 m -64.73 -44.9 88.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.6 178.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.83 -43.51 94.54 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.308 -179.535 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.52 -43.21 81.37 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.569 179.536 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 51.67 33.84 11.67 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.139 -175.687 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -106.08 24.66 25.92 Favored Glycine 0 N--CA 1.447 -0.568 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.715 178.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 919' ' ' MET . . . . . 0.791 ' HA ' HG13 ' A' ' 899' ' ' VAL . 2.1 mtt -132.2 -94.89 0.35 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 110.328 -0.249 . . . . 0.0 110.328 -177.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 920' ' ' ASP . . . . . 0.427 ' H ' ' HB3' ' A' ' 919' ' ' MET . 9.6 t70 166.36 -64.77 0.0 OUTLIER 'General case' 0 CA--C 1.518 -0.279 0 O-C-N 124.205 0.941 . . . . 0.0 109.175 175.433 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . 0.599 ' HB2' HG23 ' A' ' 900' ' ' ILE . 0.0 OUTLIER -115.08 165.81 12.5 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.799 -177.459 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 922' ' ' CYS . . . . . 0.87 ' HB2' ' HD2' ' A' ' 913' ' ' ARG . 0.0 OUTLIER -147.37 135.12 21.11 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.332 -179.683 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 923' ' ' LEU . . . . . 0.836 HD12 ' HB ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -155.98 -175.8 5.62 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 178.37 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 924' ' ' SER . . . . . 0.716 ' HB2' ' HD2' ' A' ' 926' ' ' PRO . 0.0 OUTLIER -106.29 154.68 20.41 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.916 -178.839 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 925' ' ' LYS . . . . . 0.45 ' HB3' ' HD3' ' A' ' 926' ' ' PRO . 8.4 tttp -52.92 -43.33 93.86 Favored Pre-proline 0 N--CA 1.47 0.531 0 N-CA-C 112.762 0.652 . . . . 0.0 112.762 179.4 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 926' ' ' PRO . . . . . 0.716 ' HD2' ' HB2' ' A' ' 924' ' ' SER . 23.2 Cg_exo -66.5 75.33 0.38 Allowed 'Trans proline' 0 C--N 1.357 0.997 0 C-N-CA 121.983 1.788 . . . . 0.0 111.798 172.474 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -107.09 152.98 8.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.188 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 928' ' ' THR . . . . . 0.408 ' O ' HG22 ' A' ' 932' ' ' ILE . 0.0 OUTLIER -95.06 149.56 21.13 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.913 179.854 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 929' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.93 -37.78 69.4 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.652 -179.029 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.92 -27.21 65.55 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.82 -178.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 931' ' ' VAL . . . . . 0.523 ' O ' ' HG2' ' A' ' 934' ' ' GLN . 93.2 t -75.94 -51.34 20.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.863 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 932' ' ' ILE . . . . . 0.408 HG22 ' O ' ' A' ' 928' ' ' THR . 0.0 OUTLIER -58.52 -37.06 62.4 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-O 121.056 0.455 . . . . 0.0 109.826 178.403 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 933' ' ' LYS . . . . . 0.611 ' HG2' HD21 ' A' ' 847' ' ' LEU . 0.0 OUTLIER -65.37 -47.43 76.43 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.288 -179.978 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 934' ' ' GLN . . . . . 0.554 ' O ' ' HB2' ' A' ' 938' ' ' LEU . 10.2 pt20 -63.72 -41.96 98.0 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.406 -177.049 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 1.3 m -69.44 -39.33 77.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.612 0.244 . . . . 0.0 110.732 -179.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 936' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.89 -54.8 29.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.618 179.595 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 74.6 m -60.6 -41.86 95.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.575 -179.076 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 938' ' ' LEU . . . . . 0.554 ' HB2' ' O ' ' A' ' 934' ' ' GLN . 0.1 OUTLIER -68.01 -40.16 83.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.732 0.301 . . . . 0.0 111.416 -178.156 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 939' ' ' TYR . . . . . 0.579 ' HA ' ' HB3' ' A' ' 942' ' ' ARG . 1.6 m-85 -77.19 -27.21 53.5 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.93 -0.308 . . . . 0.0 111.101 -178.087 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -64.28 -43.61 94.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.007 0.432 . . . . 0.0 110.254 174.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 941' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -73.73 -21.99 60.04 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.333 177.575 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 942' ' ' ARG . . . . . 0.579 ' HB3' ' HA ' ' A' ' 939' ' ' TYR . 0.0 OUTLIER -67.57 -47.55 69.46 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.266 177.234 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 943' ' ' VAL . . . . . 0.402 ' N ' ' HG3' ' A' ' 942' ' ' ARG . 10.1 m -74.11 -33.07 34.45 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 CA-C-O 120.946 0.403 . . . . 0.0 110.155 178.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 19.1 ttt85 -58.56 -48.1 82.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.517 176.472 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.03 -19.33 60.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.199 -179.873 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 71.4 m -71.9 -21.95 61.56 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.09 0.472 . . . . 0.0 109.903 175.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.63 -30.21 14.45 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.311 174.489 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.027 -175.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 705' ' ' SER . . . . . 0.55 ' HA ' ' O ' ' A' ' 730' ' ' GLY . 1.5 m . . . . . 0 CA--C 1.531 0.234 0 CA-C-O 121.27 0.557 . . . . 0.0 111.495 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 170.49 -23.98 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.345 -0.931 . . . . 0.0 112.597 -178.05 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 1.4 mptt -75.16 135.75 41.08 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 -179.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 708' ' ' ARG . . . . . 0.654 ' HG2' HG23 ' A' ' 732' ' ' VAL . 0.0 OUTLIER -100.24 155.13 17.94 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.054 0.454 . . . . 0.0 111.612 -174.445 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 709' ' ' CYS . . . . . 0.455 ' SG ' HD13 ' A' ' 726' ' ' LEU . 0.0 OUTLIER -136.47 127.17 27.21 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.812 176.698 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 710' ' ' TRP . . . . . 0.652 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 90.2 m95 -107.07 117.45 34.09 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 177.113 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 711' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -120.27 123.02 42.17 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.233 0.54 . . . . 0.0 111.191 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -121.27 68.92 0.9 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.368 176.595 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 713' ' ' VAL . . . . . 0.618 HG11 ' HB3' ' A' ' 718' ' ' LEU . 55.3 t -117.84 127.98 75.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.182 -178.216 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 714' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 714' ' ' ARG . 3.3 mtt85 -73.53 -35.45 65.56 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.942 0.401 . . . . 0.0 110.667 178.757 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 41.2 t-20 -63.36 112.53 2.76 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.375 177.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 716' ' ' ALA . . . . . 0.65 ' O ' ' HB2' ' A' ' 720' ' ' GLN . . . -66.71 -38.1 86.04 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.328 -175.006 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.83 -38.28 83.02 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.935 0.398 . . . . 0.0 110.092 178.662 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 718' ' ' LEU . . . . . 0.646 HD21 ' HD2' ' A' ' 765' ' ' PHE . 0.9 OUTLIER -67.95 -50.22 57.14 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.663 179.908 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 719' ' ' CYS . . . . . 0.581 ' HB3' ' HB ' ' A' ' 713' ' ' VAL . 21.8 p -67.35 -38.46 84.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.65 -177.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 720' ' ' GLN . . . . . 0.702 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -63.96 -39.14 93.46 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.176 177.574 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -57.3 -55.17 38.23 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.704 -179.588 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.87 -48.35 77.04 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.952 -179.42 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 723' ' ' GLU . . . . . 0.8 ' HA ' HG11 ' A' ' 733' ' ' VAL . 2.9 pt-20 -60.39 -43.41 96.68 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.67 -174.154 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 724' ' ' THR . . . . . 0.556 ' N ' ' HG3' ' A' ' 723' ' ' GLU . 14.6 m -71.8 -38.55 70.23 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.841 0.353 . . . . 0.0 111.166 -177.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 725' ' ' SER . . . . . 0.425 ' O ' ' HG2' ' A' ' 728' ' ' ARG . 37.5 m -69.03 -36.42 77.73 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.877 0.37 . . . . 0.0 111.299 -179.083 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 726' ' ' LEU . . . . . 0.48 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 11.1 mt -82.06 -42.86 18.66 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.869 -176.655 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 727' ' ' GLN . . . . . 0.433 ' HA ' ' O ' ' A' ' 731' ' ' ILE . 8.5 pt20 -62.43 -29.76 70.74 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.57 0.224 . . . . 0.0 111.392 -176.387 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 728' ' ' ARG . . . . . 0.425 ' HG2' ' O ' ' A' ' 725' ' ' SER . 11.7 ptt180 -69.51 -17.83 63.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.956 0.408 . . . . 0.0 111.128 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 1.4 m -99.35 -1.82 37.87 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.094 -178.123 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 730' ' ' GLY . . . . . 0.55 ' O ' ' HA ' ' A' ' 705' ' ' SER . . . 100.31 14.68 32.34 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.35 -0.929 . . . . 0.0 112.578 179.237 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 731' ' ' ILE . . . . . 0.48 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 32.0 mm -90.57 129.07 41.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 176.438 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 732' ' ' VAL . . . . . 0.654 HG23 ' HG2' ' A' ' 708' ' ' ARG . 0.2 OUTLIER -85.78 94.33 4.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 121.981 0.896 . . . . 0.0 110.428 -178.784 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 733' ' ' VAL . . . . . 0.8 HG11 ' HA ' ' A' ' 723' ' ' GLU . 0.1 OUTLIER -83.22 122.8 38.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 114.595 -1.184 . . . . 0.0 111.08 -177.398 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.66 147.91 52.39 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.717 -179.66 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 3.9 m -77.46 119.27 20.82 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.032 0.444 . . . . 0.0 110.766 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 736' ' ' TYR . . . . . 0.652 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 86.0 t80 -81.84 114.58 20.55 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.616 -178.551 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -109.33 -42.59 4.33 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.075 177.313 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 176.97 47.76 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.432 0 N-CA-C 111.208 -0.757 . . . . 0.0 111.208 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 13.3 mp0 -91.79 -176.31 4.42 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.528 -0.336 . . . . 0.0 110.863 -174.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 740' ' ' GLU . . . . . 0.504 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 0.0 OUTLIER -97.78 131.77 26.21 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.455 179.897 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 741' ' ' PRO . . . . . 0.677 ' HG2' ' HB2' ' A' ' 758' ' ' GLN . 6.5 Cg_endo -87.25 127.54 2.49 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 123.348 2.699 . . . . 0.0 113.313 -175.519 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 742' ' ' THR . . . . . 0.817 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.2 OUTLIER -90.92 148.59 38.5 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 172.392 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 743' ' ' PRO . . . . . 0.817 ' HD2' HG22 ' A' ' 742' ' ' THR . 23.8 Cg_endo -61.77 5.01 0.23 Allowed 'Trans proline' 0 N--CA 1.48 0.687 0 C-N-CA 123.208 2.605 . . . . 0.0 113.931 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 744' ' ' GLU . . . . . 0.407 ' HA ' ' HB2' ' A' ' 760' ' ' ARG . 2.1 mt-10 -118.03 -2.57 11.23 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.772 0.32 . . . . 0.0 110.424 175.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 745' ' ' ASP . . . . . 0.451 ' HB3' ' HD1' ' A' ' 710' ' ' TRP . 87.1 m-20 -89.38 149.09 23.15 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.746 -176.149 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 746' ' ' VAL . . . . . 0.529 HG11 HD11 ' A' ' 795' ' ' LEU . 2.8 p -120.51 137.25 54.92 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.3 178.458 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 747' ' ' LEU . . . . . 0.414 ' HG ' ' CZ3' ' A' ' 757' ' ' TRP . 0.0 OUTLIER -106.01 100.01 9.57 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.874 0.369 . . . . 0.0 110.903 -179.748 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 12.0 mt -93.78 106.83 18.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 173.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 749' ' ' THR . . . . . 0.654 HG21 ' HB ' ' A' ' 753' ' ' VAL . 6.0 t -128.98 160.38 32.9 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 110.113 -0.328 . . . . 0.0 110.113 -177.275 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 750' ' ' ASP . . . . . 0.584 ' HB3' HG13 ' A' ' 713' ' ' VAL . 1.5 p-10 -105.51 145.86 30.34 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.02 0.438 . . . . 0.0 111.171 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 751' ' ' GLU . . . . . 0.509 ' HA ' ' HA ' ' A' ' 766' ' ' CYS . 22.5 mm-40 63.91 -157.06 0.31 Allowed 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.366 -178.656 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 752' ' ' VAL . . . . . 0.578 HG22 ' H ' ' A' ' 771' ' ' GLY . 62.1 t -75.68 127.16 37.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 120.992 0.425 . . . . 0.0 111.287 -176.295 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 753' ' ' VAL . . . . . 0.654 ' HB ' HG21 ' A' ' 749' ' ' THR . 8.6 p -102.12 142.74 15.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.823 175.437 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -94.37 39.84 1.09 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.906 0.384 . . . . 0.0 111.236 -178.266 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.02 148.24 18.67 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.223 178.684 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 6.4 mmtm -97.2 10.51 39.26 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.826 179.092 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 757' ' ' TRP . . . . . 0.597 ' CH2' ' HB3' ' A' ' 741' ' ' PRO . 4.5 t-105 69.61 153.96 0.11 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.419 -0.81 . . . . 0.0 112.123 177.255 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 758' ' ' GLN . . . . . 0.677 ' HB2' ' HG2' ' A' ' 741' ' ' PRO . 4.9 mp0 -135.22 47.96 2.29 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.797 178.249 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 759' ' ' GLY . . . . . 0.55 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -146.1 -140.86 3.54 Favored Glycine 0 N--CA 1.443 -0.87 0 C-N-CA 120.409 -0.901 . . . . 0.0 113.1 -175.481 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 760' ' ' ARG . . . . . 0.407 ' HB2' ' HA ' ' A' ' 744' ' ' GLU . 0.2 OUTLIER -74.31 -59.97 2.48 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 111.597 0.221 . . . . 0.0 111.597 -178.226 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 761' ' ' ALA . . . . . 0.47 ' O ' ' HA ' ' A' ' 746' ' ' VAL . . . -156.99 157.85 35.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.738 -176.235 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 3.2 p -126.59 131.81 70.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.139 177.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 763' ' ' VAL . . . . . 0.577 HG11 HD11 ' A' ' 791' ' ' LEU . 92.2 t -111.37 96.66 4.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 178.487 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 764' ' ' THR . . . . . 0.763 HG21 HG13 ' A' ' 772' ' ' ILE . 0.2 OUTLIER -86.39 92.67 8.9 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.083 -178.593 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 765' ' ' PHE . . . . . 0.741 ' CZ ' ' HG ' ' A' ' 791' ' ' LEU . 0.2 OUTLIER -84.23 83.63 7.9 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.207 179.085 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 766' ' ' CYS . . . . . 0.54 ' HB2' HG12 ' A' ' 770' ' ' ILE . 0.0 OUTLIER -94.54 132.85 38.8 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 -175.049 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 5.1 mmm-85 -88.86 -56.15 3.41 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.913 -171.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.28 -34.16 2.96 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.271 -176.33 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -108.75 106.59 16.68 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.291 0.567 . . . . 0.0 110.402 -179.425 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 770' ' ' ILE . . . . . 0.54 HG12 ' HB2' ' A' ' 766' ' ' CYS . 24.2 mt -107.26 87.39 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.467 178.377 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 771' ' ' GLY . . . . . 0.578 ' H ' HG22 ' A' ' 752' ' ' VAL . . . -95.28 6.71 68.78 Favored Glycine 0 N--CA 1.454 -0.156 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.693 177.873 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 772' ' ' ILE . . . . . 0.763 HG13 HG21 ' A' ' 764' ' ' THR . 41.9 mm -104.06 141.79 23.26 Favored Pre-proline 0 C--N 1.32 -0.686 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 178.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 773' ' ' PRO . . . . . 0.668 ' O ' ' HB3' ' A' ' 774' ' ' LEU . 50.7 Cg_exo -53.39 -96.83 0.0 OUTLIER 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 123.135 2.557 . . . . 0.0 113.37 178.657 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . 0.698 ' HA ' HG13 ' A' ' 782' ' ' VAL . 0.3 OUTLIER 153.05 -161.85 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.462 1.105 . . . . 0.0 109.477 -177.365 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 775' ' ' GLU . . . . . 0.486 ' HA ' ' O ' ' A' ' 780' ' ' GLU . 0.8 OUTLIER -62.65 54.05 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.911 0.884 . . . . 0.0 113.335 177.266 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 776' ' ' LYS . . . . . 0.569 ' HD3' ' HB3' ' A' ' 773' ' ' PRO . 0.1 OUTLIER -118.75 0.41 11.44 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 170.122 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 777' ' ' ALA . . . . . 0.419 ' HB3' ' HB2' ' A' ' 780' ' ' GLU . . . -126.93 150.87 72.96 Favored Pre-proline 0 C--N 1.324 -0.526 0 CA-C-N 114.615 -1.175 . . . . 0.0 109.114 176.123 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_endo -62.14 100.32 0.21 Allowed 'Trans proline' 0 CA--C 1.529 0.232 0 C-N-CA 122.617 2.212 . . . . 0.0 112.626 -178.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 96.48 20.11 25.78 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.832 -0.699 . . . . 0.0 113.004 177.475 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 780' ' ' GLU . . . . . 0.486 ' O ' ' HA ' ' A' ' 775' ' ' GLU . 0.1 OUTLIER -109.59 125.06 52.16 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 179.808 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 35.5 m95 -142.66 106.78 4.73 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.853 -0.158 . . . . 0.0 111.152 -175.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . 0.698 HG13 ' HA ' ' A' ' 774' ' ' LEU . 3.6 m -102.19 156.43 4.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 C-N-CA 120.781 -0.367 . . . . 0.0 110.156 175.19 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 783' ' ' HIS . . . . . 0.43 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.1 OUTLIER -176.36 150.16 0.88 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.61 177.415 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 3.1 m -104.96 100.21 9.82 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.935 0.397 . . . . 0.0 110.533 173.586 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 785' ' ' VAL . . . . . 0.415 HG23 ' CE1' ' A' ' 765' ' ' PHE . 0.1 OUTLIER -159.45 164.55 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 178.239 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -103.56 40.36 1.43 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.997 179.094 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 49.39 64.09 9.18 Favored Pre-proline 0 N--CA 1.469 0.487 0 CA-C-N 115.26 -0.882 . . . . 0.0 112.705 177.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 788' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -68.59 -70.37 0.02 OUTLIER 'Trans proline' 0 CA--C 1.533 0.455 0 C-N-CA 122.254 1.969 . . . . 0.0 112.545 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 2.2 p-80 -153.32 -30.82 0.13 Allowed 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -178.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 790' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -71.18 -34.28 70.77 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 111.747 0.277 . . . . 0.0 111.747 -174.258 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 791' ' ' LEU . . . . . 0.741 ' HG ' ' CZ ' ' A' ' 765' ' ' PHE . 0.7 OUTLIER -65.46 -55.62 23.68 Favored Pre-proline 0 C--N 1.327 -0.382 0 C-N-CA 120.986 -0.286 . . . . 0.0 111.272 -178.922 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 792' ' ' PRO . . . . . 0.404 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 11.7 Cg_endo -58.55 -26.71 79.79 Favored 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 121.585 1.523 . . . . 0.0 111.871 175.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -68.09 -45.69 73.07 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.892 176.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 794' ' ' LEU . . . . . 0.506 HD22 ' HA ' ' A' ' 794' ' ' LEU . 0.2 OUTLIER -65.63 -36.89 85.0 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 176.797 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 795' ' ' LEU . . . . . 0.529 HD11 HG11 ' A' ' 746' ' ' VAL . 0.6 OUTLIER -63.04 -44.26 96.36 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.865 179.158 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -63.69 -31.73 72.99 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.148 0.499 . . . . 0.0 110.727 177.053 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.24 -47.18 65.46 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.674 178.69 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 798' ' ' ILE . . . . . 0.437 HG22 ' O ' ' A' ' 795' ' ' LEU . 0.9 OUTLIER -70.1 -16.94 20.58 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.589 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.308 -177.562 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 799' ' ' TYR . . . . . 0.43 ' HD1' ' HA ' ' A' ' 799' ' ' TYR . 2.4 m-30 -78.53 -8.32 58.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.282 175.188 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 34.1 mt . . . . . 0 C--O 1.231 0.126 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.532 177.206 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.938 0.399 . . . . 0.0 110.513 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 825' ' ' MET . . . . . 0.524 ' O ' ' HB3' ' A' ' 849' ' ' TYR . 0.5 OUTLIER -92.29 127.76 37.89 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 -178.501 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 826' ' ' MET . . . . . 0.6 ' HG3' ' HA ' ' A' ' 869' ' ' ILE . 5.0 ptp -125.61 131.02 52.76 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.121 0.486 . . . . 0.0 111.383 -176.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 827' ' ' ILE . . . . . . . . . . . . . 10.3 mm -120.71 128.91 76.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.075 176.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 828' ' ' LEU . . . . . 0.7 ' HB3' HD13 ' A' ' 869' ' ' ILE . 0.1 OUTLIER -106.36 134.75 49.01 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.259 0.552 . . . . 0.0 110.768 -178.063 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 829' ' ' VAL . . . . . 0.413 HG23 ' HA ' ' A' ' 853' ' ' THR . 0.0 OUTLIER -112.33 111.73 37.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.509 -177.373 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 830' ' ' VAL . . . . . 0.619 ' HA ' ' O ' ' A' ' 854' ' ' ALA . 48.7 t -112.17 100.59 11.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.316 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 831' ' ' ASP . . . . . 0.746 ' HB2' ' HB3' ' A' ' 875' ' ' ASP . 0.1 OUTLIER -121.26 137.55 54.64 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.935 0.398 . . . . 0.0 110.505 -178.27 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 832' ' ' ASP . . . . . 0.462 ' O ' ' HD3' ' A' ' 834' ' ' PRO . 7.2 t70 -74.24 -37.7 63.73 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.854 -176.181 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -108.49 93.1 11.04 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.28 -174.531 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 834' ' ' PRO . . . . . 0.462 ' HD3' ' O ' ' A' ' 832' ' ' ASP . 98.1 Cg_exo -45.62 -25.34 2.33 Favored 'Trans proline' 0 N--CA 1.482 0.849 0 C-N-CA 125.14 3.893 . . . . 0.0 116.374 -164.0 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 1.2 pp -58.25 -40.49 77.87 Favored 'Isoleucine or valine' 0 C--O 1.239 0.524 0 CA-C-O 121.242 0.544 . . . . 0.0 110.758 179.524 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 836' ' ' ASN . . . . . 0.529 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 2.2 t30 -74.53 -39.82 62.12 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.903 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 837' ' ' ARG . . . . . 0.557 ' HB2' ' OD2' ' A' ' 831' ' ' ASP . 6.7 ttp-105 -53.43 -39.96 64.8 Favored 'General case' 0 CA--C 1.518 -0.281 0 O-C-N 123.338 0.399 . . . . 0.0 110.542 175.856 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 838' ' ' ARG . . . . . 0.433 HH11 ' HG2' ' A' ' 838' ' ' ARG . 0.0 OUTLIER -59.39 -44.0 92.84 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 176.297 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 839' ' ' LEU . . . . . 0.432 ' N ' ' HG3' ' A' ' 838' ' ' ARG . 0.7 OUTLIER -69.04 -45.22 70.98 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.971 -0.559 . . . . 0.0 112.098 -175.279 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 840' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 836' ' ' ASN . 0.0 OUTLIER -67.59 -37.37 82.47 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.183 177.629 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -67.22 -24.25 65.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.005 0.431 . . . . 0.0 110.444 178.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.08 -57.76 8.66 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.052 176.011 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 843' ' ' GLN . . . . . 1.03 ' HG2' HD23 ' A' ' 929' ' ' LEU . 4.4 mp0 -68.1 -42.03 80.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.095 -177.654 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 844' ' ' LEU . . . . . 0.434 ' HB2' ' O ' ' A' ' 840' ' ' LEU . 0.0 OUTLIER -66.04 -32.76 74.42 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.11 0.481 . . . . 0.0 110.743 179.263 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -65.46 -38.41 94.8 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.933 -0.651 . . . . 0.0 111.874 178.766 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -70.98 -44.38 66.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.618 0.247 . . . . 0.0 111.099 179.09 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -161.23 78.65 0.58 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.065 0.459 . . . . 0.0 111.39 178.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . -147.8 32.5 1.31 Allowed Glycine 0 N--CA 1.445 -0.753 0 C-N-CA 120.673 -0.775 . . . . 0.0 111.786 176.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 849' ' ' TYR . . . . . 0.524 ' HB3' ' O ' ' A' ' 825' ' ' MET . 70.0 m-85 62.89 -156.9 0.33 Allowed 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 -178.895 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -77.24 108.81 10.62 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.866 0.365 . . . . 0.0 110.298 179.211 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -96.6 134.3 40.0 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.256 -176.228 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.43 122.44 36.69 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.069 177.095 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 853' ' ' THR . . . . . 0.433 HG22 ' HG2' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -92.94 137.25 32.53 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -175.668 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 854' ' ' ALA . . . . . 0.619 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -150.65 161.66 42.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.952 176.258 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 855' ' ' ASN . . . . . 0.452 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 16.1 p-10 -147.29 74.83 1.35 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.271 0.558 . . . . 0.0 111.647 -179.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 856' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' A' ' 855' ' ' ASN . 7.3 t0 172.86 147.9 0.05 Allowed 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 114.999 -1.0 . . . . 0.0 109.613 175.127 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -74.06 -35.31 53.88 Favored Glycine 0 N--CA 1.443 -0.861 0 C-N-CA 120.949 -0.643 . . . . 0.0 111.685 179.515 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 858' ' ' VAL . . . . . 0.427 HG22 ' OD1' ' A' ' 856' ' ' ASP . 19.4 m -73.09 -31.37 34.77 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 CA-C-O 120.899 0.38 . . . . 0.0 110.645 -179.749 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 859' ' ' ASP . . . . . 0.41 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 2.2 t70 -70.55 -38.52 74.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.051 179.003 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 860' ' ' ALA . . . . . 0.615 ' O ' ' HG ' ' A' ' 864' ' ' LEU . . . -61.33 -42.44 98.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.12 176.278 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 861' ' ' LEU . . . . . 0.47 HD23 HD12 ' A' ' 864' ' ' LEU . 1.3 mt -60.13 -41.63 93.06 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.719 177.604 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -63.88 -39.89 95.25 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.793 179.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 863' ' ' VAL . . . . . 0.586 HG11 HD13 ' A' ' 828' ' ' LEU . 0.3 OUTLIER -66.14 -33.9 66.63 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.764 -177.997 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 864' ' ' LEU . . . . . 0.615 ' HG ' ' O ' ' A' ' 860' ' ' ALA . 4.9 mt -69.85 -35.06 74.43 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.048 0.451 . . . . 0.0 110.109 176.27 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 4.1 m -81.5 -6.63 59.15 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.074 -178.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 17.2 mtpt -99.99 -45.59 5.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.729 176.009 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 867' ' ' ASN . . . . . 0.433 ' HB3' ' H ' ' A' ' 868' ' ' HIS . 22.9 t-20 -124.68 -112.16 0.3 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.518 -178.66 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 868' ' ' HIS . . . . . 0.433 ' H ' ' HB3' ' A' ' 867' ' ' ASN . 11.5 t60 -161.68 -67.27 0.06 Allowed 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 179.237 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 869' ' ' ILE . . . . . 0.7 HD13 ' HB3' ' A' ' 828' ' ' LEU . 35.7 mt 66.07 147.42 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 O-C-N 123.846 0.716 . . . . 0.0 110.468 -175.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -96.69 -36.42 10.69 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.251 -0.58 . . . . 0.0 112.421 -171.495 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 871' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -136.51 133.88 49.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.908 0.385 . . . . 0.0 110.837 -178.366 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 872' ' ' VAL . . . . . 0.581 HG13 HD21 ' A' ' 828' ' ' LEU . 12.0 t -101.81 124.83 55.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.444 177.67 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 873' ' ' LEU . . . . . 0.492 HD11 HD11 ' A' ' 936' ' ' LEU . 45.5 mt -104.85 100.06 9.68 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 174.616 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -95.52 96.31 8.98 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.626 -178.252 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 875' ' ' ASP . . . . . 0.746 ' HB3' ' HB2' ' A' ' 831' ' ' ASP . 25.0 t0 -93.19 106.91 18.81 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.988 -177.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 876' ' ' VAL . . . . . 0.581 ' HB ' HG23 ' A' ' 903' ' ' THR . 21.6 t -108.61 135.77 46.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.091 -170.662 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 877' ' ' ASN . . . . . 0.843 ' HB2' ' HE3' ' A' ' 925' ' ' LYS . 10.9 t-20 -163.6 80.37 0.44 Allowed 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.7 176.205 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.583 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.81 178.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.283 0 N-CA-C 111.58 -0.608 . . . . 0.0 111.58 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 884' ' ' TYR . . . . . 0.417 ' O ' ' HB2' ' A' ' 888' ' ' GLN . 54.6 t80 -158.99 -54.99 0.06 Allowed 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 -179.752 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 885' ' ' ARG . . . . . 0.742 ' O ' ' HB2' ' A' ' 889' ' ' ARG . 0.0 OUTLIER -58.39 -50.73 72.64 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.409 -179.486 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.43 -52.61 17.57 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.815 -176.435 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -60.87 -48.36 82.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 0.0 112.141 -174.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 888' ' ' GLN . . . . . 0.502 ' O ' ' HB2' ' A' ' 892' ' ' GLN . 3.8 mm-40 -68.68 -45.22 72.26 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.956 -0.297 . . . . 0.0 110.745 -178.124 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 889' ' ' ARG . . . . . 0.742 ' HB2' ' O ' ' A' ' 885' ' ' ARG . 0.0 OUTLIER -61.38 -48.09 82.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.595 0.236 . . . . 0.0 111.223 -177.724 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 890' ' ' ILE . . . . . 0.644 HG12 HD13 ' A' ' 895' ' ' LEU . 0.7 OUTLIER -62.71 -42.69 97.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.25 -175.94 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 891' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.45 -28.53 59.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.652 0.263 . . . . 0.0 111.04 -178.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 892' ' ' GLN . . . . . 0.502 ' HB2' ' O ' ' A' ' 888' ' ' GLN . 0.0 OUTLIER -70.15 -36.05 74.46 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.046 179.312 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -83.58 -3.58 57.81 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.889 -176.536 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 109.32 30.76 3.48 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.122 -1.037 . . . . 0.0 114.313 172.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 895' ' ' LEU . . . . . 0.644 HD13 HG12 ' A' ' 890' ' ' ILE . 0.2 OUTLIER -66.79 112.03 4.03 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 117.393 0.596 . . . . 0.0 109.524 172.837 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 8.4 t -130.16 59.67 1.63 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 122.08 0.943 . . . . 0.0 110.537 -177.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 897' ' ' LEU . . . . . 0.406 HD21 HD22 ' A' ' 864' ' ' LEU . 1.0 OUTLIER -156.07 151.73 22.18 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.655 178.454 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -58.03 116.39 3.2 Favored 'Trans proline' 0 C--O 1.235 0.327 0 C-N-CA 122.956 2.437 . . . . 0.0 113.117 -176.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 899' ' ' VAL . . . . . 0.509 HG13 ' HB ' ' A' ' 872' ' ' VAL . 16.2 t -103.38 124.91 57.89 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.634 177.037 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 900' ' ' ILE . . . . . 0.668 HG23 ' HB2' ' A' ' 921' ' ' SER . 8.7 mt -104.74 102.03 13.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 177.06 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 901' ' ' GLY . . . . . 0.489 ' O ' ' HA ' ' A' ' 922' ' ' CYS . . . -83.5 112.73 3.59 Favored Glycine 0 N--CA 1.444 -0.799 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.0 -178.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 902' ' ' VAL . . . . . 0.868 ' HB ' HD12 ' A' ' 923' ' ' LEU . 0.2 OUTLIER -104.23 114.55 44.15 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.915 0 N-CA-C 109.268 -0.642 . . . . 0.0 109.268 178.311 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 903' ' ' THR . . . . . 0.581 HG23 ' HB ' ' A' ' 876' ' ' VAL . 0.1 OUTLIER -119.86 152.76 36.84 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.546 -176.347 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -76.14 103.84 6.38 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.749 -179.213 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 57.88 79.07 0.21 Allowed 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.751 178.649 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 906' ' ' ALA . . . . . 0.497 ' HB3' ' HG3' ' A' ' 909' ' ' GLU . . . -85.16 -11.92 53.95 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.744 179.161 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 907' ' ' LEU . . . . . 0.417 ' HB2' ' O ' ' A' ' 906' ' ' ALA . 1.5 mt 73.86 -54.25 0.68 Allowed 'General case' 0 N--CA 1.471 0.599 0 O-C-N 124.048 0.842 . . . . 0.0 111.27 176.631 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -132.85 72.3 1.49 Allowed 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 177.006 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 909' ' ' GLU . . . . . 0.497 ' HG3' ' HB3' ' A' ' 906' ' ' ALA . 1.8 mp0 -46.61 -52.46 13.56 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.377 -0.828 . . . . 0.0 112.304 -176.028 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 910' ' ' GLU . . . . . 0.446 ' O ' ' HB3' ' A' ' 913' ' ' ARG . 1.0 OUTLIER -56.77 -46.44 81.49 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 120.946 0.403 . . . . 0.0 111.575 -179.136 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -66.53 -37.32 84.77 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.23 0.538 . . . . 0.0 110.692 -178.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -63.3 -31.29 72.4 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.039 177.23 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 913' ' ' ARG . . . . . 0.663 ' HB2' ' SG ' ' A' ' 922' ' ' CYS . 13.6 ttp180 -67.12 -38.88 86.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.444 177.536 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 13.3 m -63.45 -27.94 69.63 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.037 0.446 . . . . 0.0 110.32 176.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.02 -49.68 42.34 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.641 177.31 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 916' ' ' GLU . . . . . 0.445 ' HG3' ' H ' ' A' ' 916' ' ' GLU . 0.0 OUTLIER -74.18 -50.28 19.93 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 121.106 -0.237 . . . . 0.0 111.266 -176.535 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 50.38 40.95 24.03 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.802 -175.575 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -136.9 -29.38 0.3 Allowed Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.572 -0.823 . . . . 0.0 113.483 -176.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 919' ' ' MET . . . . . 0.584 ' O ' ' HB2' ' A' ' 920' ' ' ASP . 0.3 OUTLIER -84.23 -87.53 0.11 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 117.183 0.491 . . . . 0.0 110.826 -176.763 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 920' ' ' ASP . . . . . 0.584 ' HB2' ' O ' ' A' ' 919' ' ' MET . 25.6 t70 164.32 -53.15 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.533 0.733 . . . . 0.0 110.39 176.081 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . 0.668 ' HB2' HG23 ' A' ' 900' ' ' ILE . 1.0 OUTLIER -134.81 171.06 14.91 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.871 179.819 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 922' ' ' CYS . . . . . 0.663 ' SG ' ' HB2' ' A' ' 913' ' ' ARG . 0.4 OUTLIER -149.59 145.43 26.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.815 0.34 . . . . 0.0 111.372 -178.213 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 923' ' ' LEU . . . . . 0.868 HD12 ' HB ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -145.82 -176.86 5.31 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.933 175.654 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 924' ' ' SER . . . . . 0.54 ' HB3' ' HD2' ' A' ' 926' ' ' PRO . 4.1 m -103.55 144.55 31.27 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.802 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 925' ' ' LYS . . . . . 0.843 ' HE3' ' HB2' ' A' ' 877' ' ' ASN . 12.9 tttm -54.44 -45.85 99.25 Favored Pre-proline 0 CA--C 1.539 0.547 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 -179.154 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 926' ' ' PRO . . . . . 0.54 ' HD2' ' HB3' ' A' ' 924' ' ' SER . 14.8 Cg_exo -69.93 71.96 1.57 Allowed 'Trans proline' 0 C--N 1.356 0.953 0 C-N-CA 121.851 1.701 . . . . 0.0 111.923 175.157 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 10.0 p -95.04 140.75 16.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.992 -178.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -92.56 159.56 15.43 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.857 179.182 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 929' ' ' LEU . . . . . 1.03 HD23 ' HG2' ' A' ' 843' ' ' GLN . 1.3 tm? -52.69 -43.26 65.48 Favored 'General case' 0 N--CA 1.464 0.271 0 O-C-N 123.468 0.48 . . . . 0.0 111.027 179.269 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.39 -37.71 88.47 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.97 0.414 . . . . 0.0 110.659 -177.282 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 44.2 t -75.6 -47.14 34.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.147 -176.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 932' ' ' ILE . . . . . 0.419 ' O ' ' HB2' ' A' ' 936' ' ' LEU . 0.0 OUTLIER -63.59 -40.1 87.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 121.148 -0.221 . . . . 0.0 110.702 -179.329 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 1.8 tmmt? -62.96 -48.47 78.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.066 0.46 . . . . 0.0 110.33 177.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -62.34 -49.35 75.92 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.379 -177.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 4.7 m -63.87 -44.8 92.0 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.386 -177.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 936' ' ' LEU . . . . . 0.492 HD11 HD11 ' A' ' 873' ' ' LEU . 0.1 OUTLIER -63.9 -47.64 79.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.558 -179.045 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 55.0 m -63.27 -45.95 89.09 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.308 -179.458 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 938' ' ' LEU . . . . . 0.473 ' O ' ' HB2' ' A' ' 942' ' ' ARG . 0.4 OUTLIER -64.01 -43.19 96.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.254 -178.372 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -73.89 -32.57 63.64 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 121.084 -0.246 . . . . 0.0 111.082 -177.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -69.54 -45.99 67.5 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.806 0.336 . . . . 0.0 110.678 177.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 941' ' ' GLU . . . . . 0.438 ' HA ' ' HB2' ' A' ' 944' ' ' ARG . 1.7 pt-20 -70.42 -23.78 62.8 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.833 0.349 . . . . 0.0 110.463 178.524 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 942' ' ' ARG . . . . . 0.473 ' HB2' ' O ' ' A' ' 938' ' ' LEU . 0.4 OUTLIER -66.13 -48.47 70.73 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.724 178.722 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 2.8 m -72.69 -30.44 33.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.046 0.45 . . . . 0.0 110.043 178.785 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 944' ' ' ARG . . . . . 0.438 ' HB2' ' HA ' ' A' ' 941' ' ' GLU . 0.9 OUTLIER -62.68 -48.74 77.96 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.981 177.37 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -74.48 -16.13 60.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.769 0.318 . . . . 0.0 111.26 -179.562 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 63.4 m -79.29 -26.78 42.26 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.15 0.5 . . . . 0.0 109.971 174.088 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 1.6 mpp_? -82.63 -38.49 23.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.647 175.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.325 -0.495 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.856 177.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 705' ' ' SER . . . . . 0.477 ' HA ' ' O ' ' A' ' 730' ' ' GLY . 3.7 m . . . . . 0 CA--C 1.538 0.493 0 CA-C-O 121.029 0.442 . . . . 0.0 111.827 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 67.68 15.72 66.87 Favored Glycine 0 CA--C 1.52 0.346 0 CA-C-N 116.142 -0.481 . . . . 0.0 113.603 175.025 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 707' ' ' LYS . . . . . 0.536 ' HB2' HD12 ' A' ' 731' ' ' ILE . 10.0 mmmt -118.88 148.34 43.01 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 708' ' ' ARG . . . . . 0.401 ' HG2' HG13 ' A' ' 732' ' ' VAL . 0.5 OUTLIER -109.38 122.96 48.52 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.058 0.456 . . . . 0.0 110.863 -176.9 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -101.86 113.79 27.29 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 175.507 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 710' ' ' TRP . . . . . 0.456 ' O ' HD23 ' A' ' 747' ' ' LEU . 87.8 m95 -89.91 115.38 27.17 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -178.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 711' ' ' LEU . . . . . 0.497 HD11 ' HB2' ' A' ' 719' ' ' CYS . 0.0 OUTLIER -114.87 125.48 53.7 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.75 -172.158 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -126.29 43.37 3.11 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.191 177.256 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 713' ' ' VAL . . . . . 0.764 ' HA ' ' CB ' ' A' ' 750' ' ' ASP . 25.2 t -98.82 133.76 40.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.63 -0.713 . . . . 0.0 110.652 -178.053 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -98.3 -34.04 10.84 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.639 -176.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -69.96 122.52 19.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.436 178.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 716' ' ' ALA . . . . . 0.732 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -64.18 -37.59 88.02 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.087 -0.506 . . . . 0.0 112.066 -173.404 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 717' ' ' SER . . . . . 0.431 ' O ' ' HB2' ' A' ' 721' ' ' PHE . 1.7 m -63.09 -45.61 91.27 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.116 0.484 . . . . 0.0 110.24 179.126 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 718' ' ' LEU . . . . . 0.644 ' HB3' HG11 ' A' ' 713' ' ' VAL . 0.4 OUTLIER -68.93 -49.74 55.47 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.514 -0.767 . . . . 0.0 111.566 -179.534 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 719' ' ' CYS . . . . . 0.732 ' SG ' ' HA ' ' A' ' 716' ' ' ALA . 30.5 p -67.13 -51.02 59.17 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.212 -174.675 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 720' ' ' GLN . . . . . 0.419 ' HA ' ' CG ' ' A' ' 723' ' ' GLU . 4.6 tp60 -60.24 -39.23 86.0 Favored 'General case' 0 C--N 1.332 -0.163 0 O-C-N 122.997 0.185 . . . . 0.0 111.37 -178.21 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 721' ' ' PHE . . . . . 0.431 ' HB2' ' O ' ' A' ' 717' ' ' SER . 10.6 t80 -55.87 -55.8 28.19 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.021 0.438 . . . . 0.0 110.433 179.755 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 722' ' ' LEU . . . . . 0.635 HD13 HG21 ' A' ' 748' ' ' ILE . 20.5 mt -68.42 -46.54 69.62 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.427 -176.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 723' ' ' GLU . . . . . 0.419 ' CG ' ' HA ' ' A' ' 720' ' ' GLN . 0.0 OUTLIER -64.66 -44.23 91.07 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.549 0.203 . . . . 0.0 111.549 -173.892 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 724' ' ' THR . . . . . 0.64 ' O ' ' HG3' ' A' ' 728' ' ' ARG . 55.4 m -67.36 -36.76 82.04 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.769 0.318 . . . . 0.0 110.804 -179.189 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 24.5 m -70.67 -49.08 51.08 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.737 0.304 . . . . 0.0 111.467 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 726' ' ' LEU . . . . . . . . . . . . . 9.6 mt -68.6 -37.09 79.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.649 -175.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.61 -18.96 65.71 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.044 0.45 . . . . 0.0 110.88 -179.707 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 728' ' ' ARG . . . . . 0.64 ' HG3' ' O ' ' A' ' 724' ' ' THR . 8.9 mtm180 -74.69 -11.25 60.13 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.013 0.435 . . . . 0.0 110.74 178.297 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -103.7 8.02 37.34 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.045 0.45 . . . . 0.0 110.803 178.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 730' ' ' GLY . . . . . 0.477 ' O ' ' HA ' ' A' ' 705' ' ' SER . . . 89.86 13.17 61.24 Favored Glycine 0 C--N 1.329 0.169 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.784 179.006 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 731' ' ' ILE . . . . . 0.536 HD12 ' HB2' ' A' ' 707' ' ' LYS . 15.2 mm -90.35 128.94 41.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 O-C-N 122.791 -0.24 . . . . 0.0 110.475 179.686 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 732' ' ' VAL . . . . . 0.401 HG13 ' HG2' ' A' ' 708' ' ' ARG . 1.4 p -90.01 115.81 30.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.201 0.524 . . . . 0.0 110.566 -179.604 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 733' ' ' VAL . . . . . . . . . . . . . 10.1 t -86.81 137.14 21.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.195 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -141.48 137.34 32.04 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.827 0.346 . . . . 0.0 110.948 -177.845 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.72 116.6 7.82 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.632 178.548 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -85.4 80.01 9.27 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.401 0.619 . . . . 0.0 110.873 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 737' ' ' GLU . . . . . 0.462 ' H ' ' HG3' ' A' ' 737' ' ' GLU . 0.0 OUTLIER -79.01 -29.41 43.65 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.065 176.26 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 146.77 67.49 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.57 178.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 739' ' ' GLN . . . . . 0.451 ' HB2' ' H ' ' A' ' 740' ' ' GLU . 0.1 OUTLIER -112.99 -119.96 0.3 Allowed 'General case' 0 C--N 1.329 -0.312 0 O-C-N 122.879 -0.189 . . . . 0.0 110.817 179.304 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 740' ' ' GLU . . . . . 0.496 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 17.2 mm-40 -112.5 134.14 21.67 Favored Pre-proline 0 C--N 1.326 -0.432 0 CA-C-O 120.659 0.266 . . . . 0.0 111.045 -177.065 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 741' ' ' PRO . . . . . 0.496 ' HD3' ' HA ' ' A' ' 740' ' ' GLU . 4.5 Cg_endo -88.0 125.81 1.98 Allowed 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 123.434 2.756 . . . . 0.0 111.98 175.607 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 742' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -95.71 125.17 50.14 Favored Pre-proline 0 N--CA 1.449 -0.525 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.377 176.777 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 743' ' ' PRO . . . . . 0.675 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 34.0 Cg_endo -64.28 -9.41 19.79 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.834 2.356 . . . . 0.0 112.465 -179.314 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -104.85 -6.96 19.74 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.055 -179.902 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -117.13 167.28 11.32 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.519 -173.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 746' ' ' VAL . . . . . 0.652 HG21 HD11 ' A' ' 795' ' ' LEU . 33.0 m -118.91 148.21 21.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.352 0.596 . . . . 0.0 112.417 -171.454 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 747' ' ' LEU . . . . . 0.456 HD23 ' O ' ' A' ' 710' ' ' TRP . 0.3 OUTLIER -107.89 115.14 29.59 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.481 175.141 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 748' ' ' ILE . . . . . 0.635 HG21 HD13 ' A' ' 722' ' ' LEU . 19.3 mt -98.86 107.55 20.67 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 172.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 749' ' ' THR . . . . . 0.501 HG21 ' HB ' ' A' ' 753' ' ' VAL . 0.0 OUTLIER -102.68 160.55 14.48 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.319 -0.855 . . . . 0.0 112.192 -170.388 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 750' ' ' ASP . . . . . 0.764 ' CB ' ' HA ' ' A' ' 713' ' ' VAL . 36.7 t0 -124.14 121.61 35.59 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 171.426 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 64.84 -165.77 0.23 Allowed 'General case' 0 C--N 1.327 -0.385 0 O-C-N 123.785 0.678 . . . . 0.0 110.715 -174.288 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 752' ' ' VAL . . . . . 0.929 HG21 ' HB ' ' A' ' 770' ' ' ILE . 42.0 t -82.46 122.4 37.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.06 0.457 . . . . 0.0 111.317 -175.164 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 753' ' ' VAL . . . . . 0.501 ' HB ' HG21 ' A' ' 749' ' ' THR . 8.7 p -93.21 -7.16 10.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.269 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 54.72 51.24 14.17 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.388 -178.666 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.72 167.87 28.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.713 178.196 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -101.77 -29.47 11.86 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 123.108 0.255 . . . . 0.0 110.987 -179.686 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 757' ' ' TRP . . . . . 0.526 ' CD1' ' HB ' ' A' ' 762' ' ' VAL . 68.9 t-105 65.03 94.01 0.06 Allowed 'General case' 0 N--CA 1.464 0.271 0 O-C-N 123.794 0.684 . . . . 0.0 111.007 -179.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.81 64.58 8.13 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.255 0.55 . . . . 0.0 110.326 177.447 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 759' ' ' GLY . . . . . 0.675 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -123.44 -151.82 8.33 Favored Glycine 0 N--CA 1.446 -0.644 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.457 178.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.14 -51.01 19.49 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.993 0.425 . . . . 0.0 110.051 178.563 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -162.39 151.17 15.03 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.377 178.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 762' ' ' VAL . . . . . 0.526 ' HB ' ' CD1' ' A' ' 757' ' ' TRP . 2.7 p -128.15 117.04 44.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.606 176.754 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 1.6 t -109.49 104.19 16.69 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.693 -178.2 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 764' ' ' THR . . . . . 0.622 ' HB ' HG12 ' A' ' 782' ' ' VAL . 90.4 m -95.43 121.44 37.12 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.951 -175.132 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 765' ' ' PHE . . . . . 0.852 ' HE1' HG23 ' A' ' 785' ' ' VAL . 5.6 m-85 -91.13 89.3 7.31 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.334 173.629 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -110.61 133.54 53.22 Favored 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.57 -175.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.79 61.06 4.08 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.98 0.419 . . . . 0.0 110.053 179.565 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 768' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 768' ' ' ARG . 3.3 mtm180 57.39 29.9 17.69 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.868 178.648 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -96.17 118.66 33.19 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.114 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 770' ' ' ILE . . . . . 0.929 ' HB ' HG21 ' A' ' 752' ' ' VAL . 53.6 mt 71.31 -70.01 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 O-C-N 123.76 0.662 . . . . 0.0 111.477 178.123 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . 126.73 96.93 0.99 Allowed Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 120.504 -0.855 . . . . 0.0 113.248 178.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 772' ' ' ILE . . . . . 0.736 HG12 HG22 ' A' ' 752' ' ' VAL . 39.2 mm -104.42 129.28 25.33 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 171.49 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 773' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -75.12 170.91 19.35 Favored 'Trans proline' 0 CA--C 1.53 0.279 0 C-N-CA 122.578 2.186 . . . . 0.0 113.184 -178.311 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . 0.578 ' O ' ' HB3' ' A' ' 780' ' ' GLU . 0.7 OUTLIER -101.93 -148.88 0.38 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.459 -178.706 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 775' ' ' GLU . . . . . 0.495 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 1.7 mp0 -65.38 60.56 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -179.688 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -102.01 -16.06 16.59 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 170.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -132.26 149.25 72.67 Favored Pre-proline 0 N--CA 1.449 -0.514 0 CA-C-N 114.188 -1.369 . . . . 0.0 108.423 175.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -60.67 100.41 0.16 Allowed 'Trans proline' 0 C--O 1.232 0.206 0 C-N-CA 122.572 2.181 . . . . 0.0 112.956 -176.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 123.05 -17.28 8.09 Favored Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.693 -0.765 . . . . 0.0 113.109 175.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 780' ' ' GLU . . . . . 0.578 ' HB3' ' O ' ' A' ' 774' ' ' LEU . 1.1 tt0 -81.07 126.29 31.26 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 117.13 0.465 . . . . 0.0 111.418 -175.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 32.3 m95 -138.68 143.07 39.0 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 176.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . 0.622 HG12 ' HB ' ' A' ' 764' ' ' THR . 1.2 m -143.93 155.35 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-O 121.121 0.486 . . . . 0.0 111.633 178.015 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 783' ' ' HIS . . . . . 0.485 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 1.4 t-160 -161.52 139.98 9.54 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.565 174.167 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -105.4 99.36 8.97 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 175.623 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 785' ' ' VAL . . . . . 0.852 HG23 ' HE1' ' A' ' 765' ' ' PHE . 0.0 OUTLIER -171.29 -160.98 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.953 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 786' ' ' ALA . . . . . 0.447 ' H ' ' HB ' ' A' ' 785' ' ' VAL . . . -133.33 68.15 1.51 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.796 -0.184 . . . . 0.0 110.659 177.713 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 50.2 67.95 3.9 Favored Pre-proline 0 N--CA 1.468 0.447 0 CA-C-N 115.878 -0.601 . . . . 0.0 112.011 178.095 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 788' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -87.36 46.77 1.41 Allowed 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 122.595 2.197 . . . . 0.0 112.947 -174.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 71.21 -32.26 0.24 Allowed 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.415 0.686 . . . . 0.0 112.85 175.726 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 790' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -71.19 -37.92 72.13 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -175.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 791' ' ' LEU . . . . . 0.715 HD22 ' HE2' ' A' ' 765' ' ' PHE . 0.2 OUTLIER -71.12 -48.3 13.58 Favored Pre-proline 0 C--N 1.327 -0.372 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -176.362 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 792' ' ' PRO . . . . . 0.466 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 2.9 Cg_endo -53.65 -33.08 67.75 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 121.373 1.382 . . . . 0.0 112.119 173.855 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -66.79 -44.65 80.74 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 120.909 0.385 . . . . 0.0 110.464 175.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -59.75 -44.36 93.86 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.292 177.155 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 795' ' ' LEU . . . . . 0.652 HD11 HG21 ' A' ' 746' ' ' VAL . 0.2 OUTLIER -59.84 -47.36 86.04 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.096 -179.282 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -62.13 -45.06 95.14 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.097 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.02 -24.63 62.4 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.352 -178.008 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -77.62 -28.65 15.96 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 CA-C-O 120.732 0.301 . . . . 0.0 111.116 -179.135 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 799' ' ' TYR . . . . . 0.462 ' HD1' ' HA ' ' A' ' 799' ' ' TYR . 0.2 OUTLIER -81.45 -16.96 50.42 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.445 178.488 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 1.8 mt . . . . . 0 C--O 1.235 0.292 0 CA-C-N 115.426 -0.807 . . . . 0.0 111.92 174.894 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 31.8 t70 . . . . . 0 N--CA 1.461 0.094 0 CA-C-O 120.779 0.324 . . . . 0.0 111.576 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.32 103.53 12.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.743 0.306 . . . . 0.0 111.049 -176.462 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 826' ' ' MET . . . . . 0.43 ' SD ' ' HA ' ' A' ' 869' ' ' ILE . 0.0 OUTLIER -100.55 117.08 33.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.495 178.949 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 827' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -113.66 120.14 62.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.93 178.811 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 828' ' ' LEU . . . . . 0.808 ' HB3' HG22 ' A' ' 872' ' ' VAL . 2.2 tm? -95.55 129.72 42.64 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 -179.03 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 829' ' ' VAL . . . . . 0.611 ' HB ' ' CZ ' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -123.44 124.22 69.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 120.725 0.298 . . . . 0.0 110.667 179.329 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 830' ' ' VAL . . . . . 0.553 HG13 ' HA ' ' A' ' 874' ' ' SER . 2.2 p -122.25 105.29 16.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.993 0.425 . . . . 0.0 111.338 -176.799 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 831' ' ' ASP . . . . . 0.693 ' HA ' ' O ' ' A' ' 875' ' ' ASP . 4.7 t0 -110.11 155.42 21.93 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.276 0.56 . . . . 0.0 111.415 -175.541 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -93.24 -21.45 19.61 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.031 -0.986 . . . . 0.0 109.496 175.184 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 10.9 m170 -110.75 118.1 49.21 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.837 -179.025 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -61.2 -40.5 49.86 Favored 'Trans proline' 0 C--O 1.234 0.313 0 C-N-CA 122.892 2.394 . . . . 0.0 112.66 -178.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -61.04 -40.92 87.26 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.421 178.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 836' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -66.46 -46.1 77.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.638 178.282 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 837' ' ' ARG . . . . . 0.697 HH21 HD11 ' A' ' 840' ' ' LEU . 0.0 OUTLIER -52.06 -53.3 43.86 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.653 179.926 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 838' ' ' ARG . . . . . 0.487 ' HG3' ' N ' ' A' ' 839' ' ' LEU . 0.0 OUTLIER -64.24 -42.46 96.52 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.728 0.299 . . . . 0.0 111.37 -175.728 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 839' ' ' LEU . . . . . 0.487 ' N ' ' HG3' ' A' ' 838' ' ' ARG . 0.2 OUTLIER -76.3 -49.02 18.06 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -171.347 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 840' ' ' LEU . . . . . 0.697 HD11 HH21 ' A' ' 837' ' ' ARG . 1.7 pp -75.15 -30.04 60.64 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.387 -0.525 . . . . 0.0 111.168 -176.624 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -71.87 -25.26 61.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.822 0.344 . . . . 0.0 110.24 175.493 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -63.59 -44.66 93.37 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 172.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 843' ' ' GLN . . . . . 0.452 ' HG2' HD23 ' A' ' 929' ' ' LEU . 1.4 mt-30 -62.7 -38.3 89.88 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.286 176.397 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 844' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.81 -34.91 76.78 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.229 0.538 . . . . 0.0 110.416 175.12 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -68.45 -31.77 74.44 Favored Glycine 0 N--CA 1.446 -0.644 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.993 176.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -68.65 -24.85 64.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.939 0.4 . . . . 0.0 110.413 177.088 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 847' ' ' LEU . . . . . 0.513 HD22 HD22 ' A' ' 936' ' ' LEU . 0.2 OUTLIER -68.29 -38.38 81.61 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.442 174.995 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 92.0 55.66 1.71 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.742 -0.742 . . . . 0.0 113.094 175.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 849' ' ' TYR . . . . . 0.402 ' HE2' HD23 ' A' ' 847' ' ' LEU . 92.8 m-85 -136.14 164.18 28.62 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 177.396 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 850' ' ' GLN . . . . . 0.406 ' O ' ' HA ' ' A' ' 826' ' ' MET . 0.0 OUTLIER -80.65 108.34 14.22 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 -179.45 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -112.16 148.37 34.15 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.634 -176.122 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 852' ' ' LYS . . . . . 0.405 ' HB3' HD23 ' A' ' 828' ' ' LEU . 0.0 OUTLIER -121.51 116.83 25.41 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 175.007 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 32.8 p -92.68 128.62 38.61 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.836 -178.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 854' ' ' ALA . . . . . 0.507 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -137.35 132.35 33.45 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.367 176.796 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -112.21 73.7 0.83 Allowed 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 172.235 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 856' ' ' ASP . . . . . 0.645 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 2.1 t0 -173.56 126.82 0.41 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.074 -0.966 . . . . 0.0 109.689 -170.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -71.86 -61.87 3.61 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.197 -177.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 858' ' ' VAL . . . . . 0.449 HG22 ' H ' ' A' ' 858' ' ' VAL . 0.0 OUTLIER -59.23 -31.51 46.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 111.933 0.346 . . . . 0.0 111.933 -178.43 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 859' ' ' ASP . . . . . 0.645 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 0.2 OUTLIER -68.91 -20.85 64.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.578 0.227 . . . . 0.0 111.364 -178.049 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 860' ' ' ALA . . . . . 0.457 ' O ' ' HB2' ' A' ' 864' ' ' LEU . . . -64.77 -36.27 83.78 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.975 0.417 . . . . 0.0 110.078 176.165 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 861' ' ' LEU . . . . . . . . . . . . . 1.3 mt -71.56 -37.22 71.1 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.706 175.582 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 36.4 t-20 -56.18 -53.16 60.46 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 114.98 -1.009 . . . . 0.0 111.034 179.636 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 8.3 p -72.79 -32.71 41.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.49 -178.054 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 864' ' ' LEU . . . . . 0.457 ' HB2' ' O ' ' A' ' 860' ' ' ALA . 0.2 OUTLIER -62.71 -45.87 90.75 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.024 0.44 . . . . 0.0 110.857 -179.956 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 1.4 m -80.2 -20.05 45.61 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.015 -178.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -74.09 -52.14 13.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.072 0.463 . . . . 0.0 110.58 178.104 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -109.84 -88.22 0.5 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.02 -179.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 868' ' ' HIS . . . . . 0.506 ' O ' ' HB ' ' A' ' 869' ' ' ILE . 0.2 OUTLIER 172.73 -64.87 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 O-C-N 123.267 0.355 . . . . 0.0 110.662 -179.409 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 869' ' ' ILE . . . . . 0.776 HG12 ' HB2' ' A' ' 828' ' ' LEU . 1.7 mp 71.89 142.66 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 O-C-N 123.783 0.677 . . . . 0.0 110.496 -175.368 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -87.01 -42.66 12.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.883 0.373 . . . . 0.0 111.323 -176.118 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 871' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -141.07 136.16 33.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.158 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 872' ' ' VAL . . . . . 0.808 HG22 ' HB3' ' A' ' 828' ' ' LEU . 3.2 t -115.1 131.57 66.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.725 -178.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 873' ' ' LEU . . . . . 0.489 HD12 HG13 ' A' ' 829' ' ' VAL . 1.9 mt -113.35 118.84 35.69 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 173.635 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 874' ' ' SER . . . . . 0.553 ' HA ' HG13 ' A' ' 830' ' ' VAL . 72.1 p -105.56 97.02 6.91 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.046 0.45 . . . . 0.0 110.282 -178.726 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 875' ' ' ASP . . . . . 0.693 ' O ' ' HA ' ' A' ' 831' ' ' ASP . 0.0 OUTLIER -87.9 105.8 17.67 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.841 -179.317 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 876' ' ' VAL . . . . . 0.673 HG22 ' H ' ' A' ' 878' ' ' MET . 5.1 p -127.19 143.11 41.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-O 121.226 0.536 . . . . 0.0 111.14 -176.203 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -98.12 -0.41 44.43 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.599 179.205 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 878' ' ' MET . . . . . 0.673 ' H ' HG22 ' A' ' 876' ' ' VAL . 2.2 tpp . . . . . 0 C--N 1.326 -0.442 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.516 -179.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.232 0 CA-C-O 120.482 -0.066 . . . . 0.0 113.039 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 1.7 p90 -63.52 -22.11 66.71 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.982 0.42 . . . . 0.0 111.541 -174.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 885' ' ' ARG . . . . . 0.435 ' H ' ' HG3' ' A' ' 885' ' ' ARG . 0.2 OUTLIER -66.27 -31.8 72.83 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.865 0.364 . . . . 0.0 110.139 176.594 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -69.39 -49.59 53.89 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 178.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.57 -39.62 94.26 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.072 0.463 . . . . 0.0 110.935 179.797 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 888' ' ' GLN . . . . . 0.788 ' HA ' ' HD3' ' A' ' 891' ' ' ARG . 1.4 tp-100 -61.01 -45.51 94.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.972 175.23 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.34 -42.95 96.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.777 179.564 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 890' ' ' ILE . . . . . 0.507 HG22 ' HB3' ' A' ' 895' ' ' LEU . 11.4 mm -58.69 -52.3 61.59 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.024 179.657 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 891' ' ' ARG . . . . . 0.788 ' HD3' ' HA ' ' A' ' 888' ' ' GLN . 0.4 OUTLIER -68.38 -30.09 68.94 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.42 -178.153 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -74.23 -34.85 63.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.594 -177.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.16 -46.73 32.29 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.838 177.608 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 133.23 89.01 0.38 Allowed Glycine 0 N--CA 1.443 -0.89 0 C-N-CA 120.638 -0.792 . . . . 0.0 112.42 179.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 895' ' ' LEU . . . . . 0.507 ' HB3' HG22 ' A' ' 890' ' ' ILE . 0.0 OUTLIER -77.93 150.26 34.06 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.041 0.448 . . . . 0.0 110.783 177.918 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -135.54 13.74 3.46 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.985 -178.569 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 897' ' ' LEU . . . . . 0.721 HD11 HG23 ' A' ' 872' ' ' VAL . 1.7 pt? -149.03 154.41 39.48 Favored Pre-proline 0 C--N 1.32 -0.706 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.409 -173.609 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 898' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 897' ' ' LEU . 18.4 Cg_exo -67.2 122.57 9.87 Favored 'Trans proline' 0 C--O 1.238 0.517 0 C-N-CA 122.873 2.382 . . . . 0.0 112.153 178.346 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 899' ' ' VAL . . . . . 0.828 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 18.9 t -103.19 108.3 24.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 121.266 0.555 . . . . 0.0 110.451 178.048 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 900' ' ' ILE . . . . . 0.481 ' O ' ' HA ' ' A' ' 873' ' ' LEU . 8.1 mt -96.15 102.84 14.0 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.717 178.355 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -89.94 124.71 7.55 Favored Glycine 0 N--CA 1.44 -1.049 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.475 -176.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 902' ' ' VAL . . . . . 0.635 ' HB ' HD12 ' A' ' 923' ' ' LEU . 0.1 OUTLIER -103.33 106.84 20.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 174.438 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 903' ' ' THR . . . . . 0.424 HG22 HG12 ' A' ' 876' ' ' VAL . 17.8 p -108.53 144.63 35.94 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.063 -173.447 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 904' ' ' ALA . . . . . 0.494 ' HA ' ' HB2' ' A' ' 925' ' ' LYS . . . -74.59 103.26 4.83 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.789 -0.364 . . . . 0.0 110.586 177.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 42.34 73.33 0.14 Allowed 'General case' 0 N--CA 1.468 0.44 0 O-C-N 124.225 0.953 . . . . 0.0 112.854 176.428 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -81.2 -14.08 57.92 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.244 177.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 51.8 mt 74.29 -60.44 0.52 Allowed 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.501 179.135 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -107.64 54.97 0.65 Allowed 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 175.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -44.71 -46.74 10.52 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.506 -0.77 . . . . 0.0 112.287 -177.09 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 910' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -44.97 95.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.809 0.338 . . . . 0.0 111.413 -177.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.82 -38.26 79.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.012 0.434 . . . . 0.0 110.462 -178.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 912' ' ' GLN . . . . . 0.648 ' O ' ' HG2' ' A' ' 916' ' ' GLU . 1.7 tt0 -60.81 -45.91 92.59 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.0 176.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -57.76 -35.27 70.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.305 178.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 61.7 m -68.72 -35.64 77.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.475 177.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 915' ' ' LEU . . . . . 0.488 ' HA ' HD22 ' A' ' 915' ' ' LEU . 0.3 OUTLIER -70.17 -32.69 70.75 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.055 0.455 . . . . 0.0 110.424 177.769 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 916' ' ' GLU . . . . . 0.648 ' HG2' ' O ' ' A' ' 912' ' ' GLN . 53.3 mm-40 -67.9 -38.72 83.32 Favored 'General case' 0 C--O 1.226 -0.178 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.651 176.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 50.06 24.66 1.45 Allowed 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.379 0.671 . . . . 0.0 112.755 176.55 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 918' ' ' GLY . . . . . 0.46 ' HA3' ' HB3' ' A' ' 891' ' ' ARG . . . -147.49 25.94 1.52 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.143 -177.502 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 919' ' ' MET . . . . . 0.828 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 2.1 mtt -118.18 -116.89 0.32 Allowed 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.614 0.245 . . . . 0.0 110.671 -175.234 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 920' ' ' ASP . . . . . 0.519 ' H ' ' HB3' ' A' ' 919' ' ' MET . 3.6 t70 175.56 -59.36 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.261 177.017 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 37.6 m -136.6 157.81 45.91 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.876 178.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 922' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -132.12 142.58 49.55 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.688 0.28 . . . . 0.0 111.031 -177.343 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 923' ' ' LEU . . . . . 0.635 HD12 ' HB ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -145.14 170.35 16.4 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 174.362 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 17.3 m -93.33 153.87 18.3 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 120.636 0.255 . . . . 0.0 111.13 -178.173 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 925' ' ' LYS . . . . . 0.588 ' HE3' ' HB3' ' A' ' 875' ' ' ASP . 0.0 OUTLIER -50.02 -49.2 76.34 Favored Pre-proline 0 CA--C 1.538 0.513 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 -178.64 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 926' ' ' PRO . . . . . 0.498 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 16.0 Cg_endo -58.15 103.03 0.14 Allowed 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 121.984 1.789 . . . . 0.0 111.714 174.558 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -125.73 154.72 34.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.709 -175.169 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 928' ' ' THR . . . . . 0.44 ' H ' HG12 ' A' ' 931' ' ' VAL . 0.8 OUTLIER -115.03 161.32 18.51 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.129 177.676 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 929' ' ' LEU . . . . . 0.452 HD23 ' HG2' ' A' ' 843' ' ' GLN . 0.6 OUTLIER -61.74 -42.24 98.71 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.849 0.357 . . . . 0.0 110.418 178.877 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -60.21 -50.01 75.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.275 -179.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 931' ' ' VAL . . . . . 0.44 HG12 ' H ' ' A' ' 928' ' ' THR . 1.4 p -71.65 -30.46 38.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-O 120.516 0.198 . . . . 0.0 111.254 -177.592 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 932' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -70.48 -38.42 73.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 177.723 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 933' ' ' LYS . . . . . 0.511 ' HA ' HD21 ' A' ' 847' ' ' LEU . 1.5 tmtm? -67.82 -42.16 81.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.02 176.163 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -48.96 79.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.929 179.383 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 11.9 m -63.72 -43.95 95.02 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.333 -179.239 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 936' ' ' LEU . . . . . 0.513 HD22 HD22 ' A' ' 847' ' ' LEU . 0.0 OUTLIER -62.22 -56.83 14.76 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.773 179.995 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 25.5 m -59.04 -48.23 82.35 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.708 -178.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.02 -45.97 86.04 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.353 -175.283 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 939' ' ' TYR . . . . . 0.451 ' HA ' ' HB3' ' A' ' 942' ' ' ARG . 0.6 OUTLIER -80.81 -31.48 35.59 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.696 -0.402 . . . . 0.0 111.524 -176.647 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -61.26 -43.75 98.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.94 0.4 . . . . 0.0 110.451 176.407 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 941' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.45 -34.59 70.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.341 177.736 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 942' ' ' ARG . . . . . 0.451 ' HB3' ' HA ' ' A' ' 939' ' ' TYR . 6.8 ttt85 -65.08 -48.06 75.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.979 -177.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 26.9 m -71.27 -30.76 41.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.799 0.333 . . . . 0.0 110.558 -178.412 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 19.5 mtp85 -71.38 -37.5 71.58 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.819 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.15 -23.95 35.31 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.683 0.278 . . . . 0.0 111.135 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 57.1 m -76.24 -28.54 57.18 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.192 0.52 . . . . 0.0 110.281 175.576 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 1.7 mtp180 -84.94 -19.52 32.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.571 173.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 27.7 t0 . . . . . 0 CA--C 1.521 -0.165 0 CA-C-N 114.587 -1.188 . . . . 0.0 110.843 -177.759 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 705' ' ' SER . . . . . 0.505 ' HA ' ' HA3' ' A' ' 730' ' ' GLY . 2.6 m . . . . . 0 CA--C 1.533 0.325 0 CA-C-O 121.135 0.493 . . . . 0.0 111.846 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 100.1 -23.09 37.29 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.872 -0.68 . . . . 0.0 113.098 174.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 17.4 mmtt -82.3 153.0 26.06 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 122.803 -0.234 . . . . 0.0 110.438 -179.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 708' ' ' ARG . . . . . 0.487 ' HG2' HG13 ' A' ' 732' ' ' VAL . 0.0 OUTLIER -103.38 159.42 15.58 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.871 0.367 . . . . 0.0 110.863 -176.828 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 709' ' ' CYS . . . . . 0.495 ' HB2' HG22 ' A' ' 731' ' ' ILE . 0.0 OUTLIER -142.44 119.54 11.4 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.635 175.049 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 710' ' ' TRP . . . . . . . . . . . . . 86.5 m95 -98.21 123.57 42.35 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.894 0.378 . . . . 0.0 110.047 -179.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 711' ' ' LEU . . . . . 0.507 ' O ' ' HG ' ' A' ' 711' ' ' LEU . 0.6 OUTLIER -119.99 123.33 43.22 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 121.527 0.679 . . . . 0.0 110.899 -179.164 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -105.82 32.73 4.16 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.111 175.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 713' ' ' VAL . . . . . 0.766 HG13 ' HB2' ' A' ' 750' ' ' ASP . 4.0 t -79.53 102.28 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.894 179.173 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 714' ' ' ARG . . . . . 0.537 ' H ' ' HB3' ' A' ' 750' ' ' ASP . 2.9 mtp180 -73.35 -18.28 61.2 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.682 -178.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -77.36 111.1 12.67 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.591 -0.732 . . . . 0.0 109.789 176.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 716' ' ' ALA . . . . . 0.572 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -63.61 -37.85 88.9 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.769 0.285 . . . . 0.0 111.769 -173.579 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.89 -47.31 75.27 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.008 0.432 . . . . 0.0 110.372 179.64 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 718' ' ' LEU . . . . . 0.49 HD11 ' HA ' ' A' ' 786' ' ' ALA . 0.2 OUTLIER -69.22 -43.54 73.88 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.198 179.229 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 719' ' ' CYS . . . . . 0.572 ' SG ' ' HA ' ' A' ' 716' ' ' ALA . 2.5 p -65.5 -46.54 79.28 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.094 -176.263 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 720' ' ' GLN . . . . . 0.407 ' N ' ' SG ' ' A' ' 719' ' ' CYS . 2.0 tt0 -61.66 -43.32 99.07 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 121.041 -0.263 . . . . 0.0 110.692 -179.73 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -59.53 -57.65 12.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.029 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 9.5 mt -56.73 -46.1 81.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.078 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 723' ' ' GLU . . . . . 0.546 ' HA ' HG11 ' A' ' 733' ' ' VAL . 0.0 OUTLIER -59.85 -40.42 88.48 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.861 -177.264 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 724' ' ' THR . . . . . 0.418 ' HA ' ' HG2' ' A' ' 727' ' ' GLN . 9.6 m -67.55 -43.28 81.07 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.793 0.33 . . . . 0.0 111.071 -179.223 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 48.7 m -64.2 -32.92 74.69 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.657 -179.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 726' ' ' LEU . . . . . . . . . . . . . 3.5 mt -82.15 -45.79 14.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.576 -178.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 727' ' ' GLN . . . . . 0.437 HE21 ' HG3' ' A' ' 723' ' ' GLU . 14.8 pt20 -64.95 -22.23 66.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.698 0.285 . . . . 0.0 111.343 -177.43 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 1.7 ptt-85 -65.61 -21.88 66.62 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.109 0.481 . . . . 0.0 110.629 177.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 3.2 m -100.98 16.13 26.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.15 0.5 . . . . 0.0 110.727 178.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 730' ' ' GLY . . . . . 0.505 ' HA3' ' HA ' ' A' ' 705' ' ' SER . . . 83.74 14.88 71.93 Favored Glycine 0 N--CA 1.449 -0.451 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.921 176.333 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 731' ' ' ILE . . . . . 0.495 HG22 ' HB2' ' A' ' 709' ' ' CYS . 8.0 mm -95.37 105.28 16.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-O 120.841 0.353 . . . . 0.0 110.114 179.491 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 732' ' ' VAL . . . . . 0.487 HG13 ' HG2' ' A' ' 708' ' ' ARG . 1.1 p -69.07 110.14 2.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.684 0.754 . . . . 0.0 110.555 -177.061 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 733' ' ' VAL . . . . . 0.546 HG11 ' HA ' ' A' ' 723' ' ' GLU . 0.1 OUTLIER -87.47 134.63 27.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.755 -178.138 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -138.72 139.15 38.27 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.555 -178.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 1.9 m -69.12 123.49 21.24 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.641 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 33.1 t80 -84.66 101.75 12.41 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.886 -178.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.2 -50.46 4.13 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.841 176.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -169.6 42.9 0.21 Allowed Glycine 0 N--CA 1.447 -0.592 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.352 178.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 13.9 mp0 -86.39 175.1 8.58 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.731 0.301 . . . . 0.0 110.871 -177.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.38 146.16 50.04 Favored Pre-proline 0 C--N 1.325 -0.496 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.001 -176.508 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 741' ' ' PRO . . . . . 0.535 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 85.3 Cg_endo -83.82 146.91 11.92 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 122.809 2.339 . . . . 0.0 112.731 178.365 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 742' ' ' THR . . . . . 0.694 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.2 OUTLIER -133.18 141.91 42.49 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.407 178.538 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 743' ' ' PRO . . . . . 0.694 ' HD2' HG22 ' A' ' 742' ' ' THR . 38.2 Cg_endo -66.57 -9.23 23.53 Favored 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 123.025 2.483 . . . . 0.0 113.447 -178.649 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -107.21 -3.55 19.69 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.963 0.411 . . . . 0.0 110.456 176.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -102.36 144.12 31.25 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.847 -174.221 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 3.4 p -114.9 139.49 40.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.44 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 747' ' ' LEU . . . . . 0.504 HD12 ' HB2' ' A' ' 757' ' ' TRP . 0.1 OUTLIER -104.17 110.7 23.0 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.28 177.893 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -97.26 107.53 20.12 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 176.388 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 749' ' ' THR . . . . . 0.401 HG21 HG11 ' A' ' 753' ' ' VAL . 17.6 p -104.56 148.57 26.35 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.001 0.429 . . . . 0.0 111.735 -172.715 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 750' ' ' ASP . . . . . 0.766 ' HB2' HG13 ' A' ' 713' ' ' VAL . 2.9 t70 -96.52 108.78 21.41 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 170.389 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 751' ' ' GLU . . . . . 0.476 ' HB3' ' H ' ' A' ' 752' ' ' VAL . 18.2 mm-40 62.93 -147.3 0.36 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.238 -174.757 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 752' ' ' VAL . . . . . 0.476 ' H ' ' HB3' ' A' ' 751' ' ' GLU . 2.1 t -79.86 133.78 28.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.758 -174.367 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 753' ' ' VAL . . . . . 0.401 HG11 HG21 ' A' ' 749' ' ' THR . 11.3 p -117.97 141.32 37.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.417 178.291 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.67 53.31 2.72 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.225 -178.804 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -157.85 131.76 8.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.422 -179.193 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 756' ' ' LYS . . . . . 0.487 ' HA ' ' HD2' ' A' ' 756' ' ' LYS . 0.1 OUTLIER -91.01 81.9 5.61 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.229 0.537 . . . . 0.0 110.114 177.869 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 757' ' ' TRP . . . . . 0.535 ' CH2' ' HA ' ' A' ' 741' ' ' PRO . 64.3 t-105 -65.24 124.57 22.53 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.604 178.304 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -131.49 62.56 1.62 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.206 0.527 . . . . 0.0 110.227 176.394 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 759' ' ' GLY . . . . . . . . . . . . . . . -109.8 -118.98 4.07 Favored Glycine 0 N--CA 1.444 -0.783 0 C-N-CA 120.786 -0.721 . . . . 0.0 111.565 178.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -78.45 -49.66 13.05 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.078 0.466 . . . . 0.0 110.102 177.145 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -168.16 164.64 13.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.533 179.425 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 2.5 p -141.1 126.66 19.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.453 175.195 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 763' ' ' VAL . . . . . 0.408 HG11 HD13 ' A' ' 791' ' ' LEU . 3.6 t -119.52 114.7 45.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.631 -176.308 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 764' ' ' THR . . . . . . . . . . . . . 23.7 m -95.45 113.29 24.93 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.226 -179.114 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 765' ' ' PHE . . . . . 0.443 ' HA ' ' O ' ' A' ' 783' ' ' HIS . 30.4 m-85 -84.85 109.3 18.0 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 174.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 766' ' ' CYS . . . . . 0.564 ' O ' ' HA ' ' A' ' 784' ' ' SER . 0.0 OUTLIER -96.48 153.9 17.58 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.911 -174.075 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 11.9 ptt85 -140.39 -37.98 0.45 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.123 176.231 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.26 34.52 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -179.313 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . 0.438 ' HB2' ' CD ' ' A' ' 751' ' ' GLU . 0.1 OUTLIER -135.65 -71.41 0.47 Allowed 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 110.089 -0.337 . . . . 0.0 110.089 174.016 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 3.9 mt 64.09 101.19 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.403 176.264 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 771' ' ' GLY . . . . . 0.452 ' N ' HG22 ' A' ' 752' ' ' VAL . . . -125.13 -4.92 6.95 Favored Glycine 0 N--CA 1.451 -0.306 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.014 176.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 772' ' ' ILE . . . . . 0.434 HG23 ' HD2' ' A' ' 773' ' ' PRO . 1.1 mp -104.33 146.45 32.62 Favored Pre-proline 0 C--N 1.325 -0.461 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 178.266 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 773' ' ' PRO . . . . . 0.519 ' HB2' ' H ' ' A' ' 774' ' ' LEU . 32.8 Cg_exo -60.01 -100.77 0.0 OUTLIER 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.932 2.421 . . . . 0.0 112.627 179.387 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . 0.877 ' HA ' HG13 ' A' ' 782' ' ' VAL . 0.4 OUTLIER 172.49 -167.52 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -179.582 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 775' ' ' GLU . . . . . 0.671 ' HG3' ' HA ' ' A' ' 781' ' ' TRP . 1.5 mp0 -61.42 69.24 0.01 OUTLIER 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.824 0.821 . . . . 0.0 112.393 173.455 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.04 6.02 2.36 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 114.573 -1.194 . . . . 0.0 108.771 173.441 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 777' ' ' ALA . . . . . 0.626 ' HB3' ' HB2' ' A' ' 780' ' ' GLU . . . -127.72 162.49 48.97 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-N 114.745 -1.116 . . . . 0.0 109.409 -179.625 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 778' ' ' PRO . . . . . 0.557 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 55.6 Cg_endo -68.99 66.67 1.31 Allowed 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 122.977 2.451 . . . . 0.0 113.474 -177.196 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 118.48 31.23 1.54 Allowed Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.631 178.038 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 780' ' ' GLU . . . . . 0.626 ' HB2' ' HB3' ' A' ' 777' ' ' ALA . 1.4 tt0 -115.29 129.04 56.5 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 178.445 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 781' ' ' TRP . . . . . 0.671 ' HA ' ' HG3' ' A' ' 775' ' ' GLU . 26.6 m95 -134.3 144.58 48.4 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 -179.356 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . 0.877 HG13 ' HA ' ' A' ' 774' ' ' LEU . 10.7 m -134.55 151.76 32.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 120.834 0.35 . . . . 0.0 110.63 172.613 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 783' ' ' HIS . . . . . 0.443 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.3 OUTLIER -162.98 121.88 2.12 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.664 176.362 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 784' ' ' SER . . . . . 0.564 ' HA ' ' O ' ' A' ' 766' ' ' CYS . 0.3 OUTLIER -88.65 100.91 13.47 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.582 177.274 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 785' ' ' VAL . . . . . 0.893 HG13 ' H ' ' A' ' 787' ' ' ALA . 2.0 p 178.55 170.34 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.158 -0.473 . . . . 0.0 109.893 -173.501 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 786' ' ' ALA . . . . . 0.49 ' HA ' HD11 ' A' ' 718' ' ' LEU . . . -103.59 32.23 3.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.575 0.226 . . . . 0.0 111.265 179.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 787' ' ' ALA . . . . . 0.893 ' H ' HG13 ' A' ' 785' ' ' VAL . . . 57.2 70.45 1.36 Allowed Pre-proline 0 N--CA 1.468 0.43 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.145 177.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 788' ' ' PRO . . . . . 0.615 ' HD2' ' OE1' ' A' ' 790' ' ' GLU . 24.2 Cg_exo -63.29 -50.15 3.9 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.727 2.284 . . . . 0.0 112.534 -178.213 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 6.5 p-80 -177.12 -29.5 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -178.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 790' ' ' GLU . . . . . 0.615 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -74.22 -50.38 19.37 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 111.833 0.308 . . . . 0.0 111.833 -171.105 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 791' ' ' LEU . . . . . 0.487 ' N ' ' HD2' ' A' ' 792' ' ' PRO . 0.2 OUTLIER -65.4 -47.47 69.44 Favored Pre-proline 0 CA--C 1.538 0.503 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -176.81 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 792' ' ' PRO . . . . . 0.487 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 9.2 Cg_endo -58.35 -32.01 95.15 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 121.254 1.302 . . . . 0.0 112.03 174.013 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -70.45 -37.0 74.26 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 120.83 0.347 . . . . 0.0 110.749 177.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 794' ' ' LEU . . . . . 0.413 HD13 ' HG2' ' A' ' 797' ' ' ARG . 0.1 OUTLIER -61.51 -42.26 98.55 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.021 176.016 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 795' ' ' LEU . . . . . 0.438 HD22 ' HA ' ' A' ' 795' ' ' LEU . 0.1 OUTLIER -59.66 -42.56 93.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.395 178.354 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -64.76 -37.64 88.27 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.002 178.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 797' ' ' ARG . . . . . 0.413 ' HG2' HD13 ' A' ' 794' ' ' LEU . 0.0 OUTLIER -70.3 -26.5 63.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.393 179.075 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -69.12 -36.45 73.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.35 0.595 . . . . 0.0 109.915 177.137 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -77.34 -18.53 57.35 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.195 177.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 800' ' ' LEU . . . . . 0.506 ' HA ' HD12 ' A' ' 800' ' ' LEU . 2.9 tp . . . . . 0 N--CA 1.465 0.296 0 C-N-CA 124.244 1.018 . . . . 0.0 112.904 175.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 12.1 t0 . . . . . 0 N--CA 1.453 -0.315 0 CA-C-O 121.084 0.469 . . . . 0.0 110.353 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 17.5 ttm -109.8 108.25 18.51 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.734 178.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 826' ' ' MET . . . . . 0.404 ' O ' HG23 ' A' ' 869' ' ' ILE . 0.5 OUTLIER -95.72 108.79 21.13 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.19 0.519 . . . . 0.0 110.139 -179.346 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 827' ' ' ILE . . . . . . . . . . . . . 1.6 mt -110.32 125.65 67.57 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.299 179.112 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 828' ' ' LEU . . . . . 0.519 HD23 ' HB3' ' A' ' 852' ' ' LYS . 1.7 tm? -94.9 123.09 38.17 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.859 -178.126 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -117.93 118.03 56.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.05 0.452 . . . . 0.0 110.651 179.704 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 830' ' ' VAL . . . . . 0.817 HG23 ' HA ' ' A' ' 874' ' ' SER . 0.0 OUTLIER -119.52 84.92 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.498 178.497 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 831' ' ' ASP . . . . . 0.918 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 27.1 t0 -95.28 120.62 35.82 Favored 'General case' 0 CA--C 1.515 -0.39 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 -179.685 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 832' ' ' ASP . . . . . 0.474 ' OD2' ' HB2' ' A' ' 877' ' ' ASN . 0.0 OUTLIER -52.69 -27.49 17.68 Favored 'General case' 0 CA--C 1.537 0.466 0 O-C-N 123.482 0.489 . . . . 0.0 112.187 -177.582 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 833' ' ' HIS . . . . . 0.441 ' HA ' ' HD2' ' A' ' 834' ' ' PRO . 0.5 OUTLIER -98.43 109.56 53.09 Favored Pre-proline 0 C--N 1.325 -0.471 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 -177.99 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 834' ' ' PRO . . . . . 0.441 ' HD2' ' HA ' ' A' ' 833' ' ' HIS . 9.5 Cg_endo -51.59 -44.18 45.77 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 123.443 2.762 . . . . 0.0 113.445 -175.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 835' ' ' ILE . . . . . 0.47 ' HA ' HD13 ' A' ' 835' ' ' ILE . 0.2 OUTLIER -68.32 -39.17 80.56 Favored 'Isoleucine or valine' 0 C--O 1.237 0.415 0 CA-C-O 120.754 0.311 . . . . 0.0 110.972 -177.222 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 836' ' ' ASN . . . . . 0.565 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 1.5 t30 -73.55 -39.83 64.42 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 179.618 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 837' ' ' ARG . . . . . 0.918 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 1.5 ttt180 -53.85 -42.62 68.74 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.171 176.473 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.56 -43.52 89.6 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.839 178.841 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.38 -48.17 71.0 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.143 -172.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 840' ' ' LEU . . . . . 0.565 ' HG ' ' O ' ' A' ' 836' ' ' ASN . 0.3 OUTLIER -74.38 -27.27 60.58 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.502 -0.479 . . . . 0.0 111.016 -179.072 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -68.88 -29.9 68.29 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.138 0.494 . . . . 0.0 109.848 175.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -64.77 -42.55 95.02 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.729 174.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 843' ' ' GLN . . . . . 0.584 ' HG2' HD23 ' A' ' 929' ' ' LEU . 41.5 mt-30 -62.75 -45.49 92.47 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.267 175.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 844' ' ' LEU . . . . . 0.613 HD12 HD11 ' A' ' 932' ' ' ILE . 0.1 OUTLIER -58.24 -46.16 86.43 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.244 179.008 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -64.15 -39.75 97.43 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 121.09 -0.576 . . . . 0.0 112.365 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 5.8 m -67.26 -23.44 65.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.884 0.373 . . . . 0.0 110.959 179.101 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 81.4 mt -75.13 -21.43 58.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.927 0.394 . . . . 0.0 110.455 177.445 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 106.62 3.7 37.28 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.618 177.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 849' ' ' TYR . . . . . 0.584 ' HB2' HD23 ' A' ' 844' ' ' LEU . 39.2 m-85 -95.55 140.4 30.45 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.936 0.398 . . . . 0.0 110.753 -178.305 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 5.3 mp0 -76.43 115.66 16.38 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.066 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 851' ' ' CYS . . . . . 0.471 ' HB3' HD22 ' A' ' 844' ' ' LEU . 0.0 OUTLIER -107.97 135.51 49.23 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.774 -175.32 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 852' ' ' LYS . . . . . 0.519 ' HB3' HD23 ' A' ' 828' ' ' LEU . 0.0 OUTLIER -107.17 110.74 22.89 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 173.463 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 853' ' ' THR . . . . . 0.616 HG22 ' HG3' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -90.69 121.55 32.69 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.991 -0.55 . . . . 0.0 112.479 -171.563 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 854' ' ' ALA . . . . . 0.462 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -147.97 171.27 16.07 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.062 174.688 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 13.9 p-10 -144.95 75.8 1.46 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.754 0.788 . . . . 0.0 111.258 178.142 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 856' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -171.41 136.1 0.98 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.49 177.323 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -66.69 -41.44 93.83 Favored Glycine 0 N--CA 1.448 -0.512 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.895 -178.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 858' ' ' VAL . . . . . 0.404 ' H ' HG23 ' A' ' 858' ' ' VAL . 1.5 t -74.29 -36.24 42.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.645 0.26 . . . . 0.0 111.285 -177.418 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -63.18 -23.95 67.66 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.847 0.356 . . . . 0.0 111.196 -179.194 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -61.82 -35.61 78.73 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.151 0.5 . . . . 0.0 110.347 176.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 861' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.05 -35.8 61.87 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.478 177.074 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -63.01 -49.32 75.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.528 179.106 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 6.5 p -66.13 -31.3 53.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.941 178.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 864' ' ' LEU . . . . . 0.662 ' HG ' HD11 ' A' ' 895' ' ' LEU . 0.7 OUTLIER -59.55 -40.77 88.37 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.061 0.458 . . . . 0.0 110.327 175.041 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 1.5 m -79.27 -30.22 42.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.99 -179.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.44 -60.53 2.37 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.309 0.576 . . . . 0.0 110.773 178.489 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 867' ' ' ASN . . . . . 0.452 ' HB3' ' H ' ' A' ' 868' ' ' HIS . 1.4 t-20 -104.95 -119.44 0.22 Allowed 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 177.914 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 868' ' ' HIS . . . . . 0.452 ' H ' ' HB3' ' A' ' 867' ' ' ASN . 0.1 OUTLIER -163.8 -45.58 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 110.499 -0.186 . . . . 0.0 110.499 173.183 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 869' ' ' ILE . . . . . 0.447 ' HB ' ' O ' ' A' ' 868' ' ' HIS . 2.7 mp 73.32 146.93 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 O-C-N 123.613 0.571 . . . . 0.0 111.293 174.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 65.2 m-20 -85.54 -49.97 7.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.204 0.526 . . . . 0.0 110.672 -179.491 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 871' ' ' ILE . . . . . 0.69 HG12 ' HD2' ' A' ' 939' ' ' TYR . 0.8 OUTLIER -135.42 133.64 52.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.936 -0.575 . . . . 0.0 109.905 -179.729 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 872' ' ' VAL . . . . . 0.43 HG13 HD12 ' A' ' 828' ' ' LEU . 64.6 t -115.87 127.94 73.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.592 -178.315 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 873' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -120.14 115.07 22.93 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.144 0.497 . . . . 0.0 110.196 175.298 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 874' ' ' SER . . . . . 0.817 ' HA ' HG23 ' A' ' 830' ' ' VAL . 0.3 OUTLIER -100.19 125.93 46.4 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.162 179.364 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 875' ' ' ASP . . . . . 0.732 ' HB3' ' HA ' ' A' ' 831' ' ' ASP . 1.2 t70 -109.6 123.89 50.22 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.336 0.588 . . . . 0.0 111.012 -179.291 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 876' ' ' VAL . . . . . 0.421 HG23 HG23 ' A' ' 903' ' ' THR . 0.1 OUTLIER -116.29 94.56 3.18 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.285 177.827 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 877' ' ' ASN . . . . . 0.474 ' HB2' ' OD2' ' A' ' 832' ' ' ASP . 68.6 m-80 -63.11 -27.18 69.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.792 174.28 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.533 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.447 174.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 -0.131 0 N-CA-C 112.017 -0.433 . . . . 0.0 112.017 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -160.78 -49.01 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -61.6 -46.48 89.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.877 179.436 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.93 -43.9 82.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.72 -178.031 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.23 -47.2 83.5 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.242 -179.021 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -59.41 -44.21 92.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.11 -179.314 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -70.13 -38.28 75.52 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.298 -177.518 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 890' ' ' ILE . . . . . 0.702 HG23 HD13 ' A' ' 895' ' ' LEU . 9.8 mt -59.63 -49.21 84.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.041 0.448 . . . . 0.0 110.985 -179.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 891' ' ' ARG . . . . . . . . . . . . . 35.9 ptt85 -75.69 -23.67 56.18 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.102 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.25 -44.66 94.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.158 176.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.15 -31.06 64.04 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.943 174.55 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 90.7 66.64 1.18 Allowed Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.25 177.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 895' ' ' LEU . . . . . 0.702 HD13 HG23 ' A' ' 890' ' ' ILE . 0.1 OUTLIER -65.78 111.54 3.29 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 110.016 -0.365 . . . . 0.0 110.016 177.889 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.63 -11.99 54.86 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.755 -175.668 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 897' ' ' LEU . . . . . 0.599 HD11 HD21 ' A' ' 864' ' ' LEU . 0.0 OUTLIER -92.64 148.03 35.37 Favored Pre-proline 0 C--N 1.323 -0.548 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.403 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -60.08 128.62 27.11 Favored 'Trans proline' 0 C--O 1.239 0.552 0 C-N-CA 122.844 2.363 . . . . 0.0 112.731 -177.274 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 899' ' ' VAL . . . . . 0.695 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 1.8 t -111.56 129.55 66.73 Favored 'Isoleucine or valine' 0 C--O 1.236 0.387 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.922 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 900' ' ' ILE . . . . . 0.505 HG12 ' CE2' ' A' ' 939' ' ' TYR . 0.0 OUTLIER -107.57 111.31 35.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.096 176.978 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -97.0 105.97 3.28 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.14 -177.201 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 902' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -93.32 130.41 42.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 177.611 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 903' ' ' THR . . . . . 0.642 HG21 ' HG2' ' A' ' 909' ' ' GLU . 0.2 OUTLIER -123.46 138.36 54.6 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.199 -178.431 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 904' ' ' ALA . . . . . 0.829 ' HA ' ' HB2' ' A' ' 925' ' ' LYS . . . -79.08 117.26 19.97 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.973 176.799 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 61.73 54.93 2.81 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-O 121.327 0.584 . . . . 0.0 110.323 -178.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 906' ' ' ALA . . . . . 0.485 ' HB1' ' HB2' ' A' ' 909' ' ' GLU . . . -69.94 85.23 0.51 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.465 178.732 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 907' ' ' LEU . . . . . 0.464 HD13 ' HA ' ' A' ' 907' ' ' LEU . 0.8 OUTLIER -83.91 -41.1 17.75 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.891 -178.979 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -127.7 4.02 6.1 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-O 121.412 0.625 . . . . 0.0 110.472 -178.378 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 909' ' ' GLU . . . . . 0.642 ' HG2' HG21 ' A' ' 903' ' ' THR . 5.7 mp0 -69.7 -17.01 63.44 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.794 -173.136 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 910' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.11 -37.8 84.51 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.14 0.495 . . . . 0.0 109.921 176.393 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.07 -34.42 66.24 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.806 177.186 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 6.4 mm100 -65.06 -36.82 85.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.483 177.036 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -62.34 -41.45 98.59 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.454 177.182 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 58.8 m -70.89 -31.15 67.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.748 178.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 915' ' ' LEU . . . . . 0.419 HD12 ' HA ' ' A' ' 915' ' ' LEU . 2.9 tp -70.67 -52.12 23.2 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.065 -179.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -74.18 -44.76 52.2 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.336 -177.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 51.22 46.6 26.22 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.336 -175.546 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -115.89 24.86 9.86 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.785 -177.127 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 919' ' ' MET . . . . . 0.695 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -141.15 -94.71 0.14 Allowed 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.955 -0.298 . . . . 0.0 110.878 -177.876 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 920' ' ' ASP . . . . . 0.489 ' H ' ' CG ' ' A' ' 919' ' ' MET . 29.7 t70 171.42 -57.2 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 123.934 0.894 . . . . 0.0 108.656 176.176 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -133.17 163.13 29.96 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.517 176.046 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 922' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -123.94 136.63 54.45 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.412 176.466 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 923' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -123.45 173.45 8.0 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.554 -179.094 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 924' ' ' SER . . . . . 0.812 ' HB2' ' HD2' ' A' ' 926' ' ' PRO . 0.4 OUTLIER -95.11 158.77 15.32 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.336 179.709 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 925' ' ' LYS . . . . . 0.829 ' HB2' ' HA ' ' A' ' 904' ' ' ALA . 0.0 OUTLIER -60.34 -46.95 97.64 Favored Pre-proline 0 CA--C 1.538 0.516 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.544 173.537 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 926' ' ' PRO . . . . . 0.812 ' HD2' ' HB2' ' A' ' 924' ' ' SER . 52.8 Cg_exo -58.05 88.82 0.05 OUTLIER 'Trans proline' 0 C--N 1.36 1.142 0 C-N-CA 122.161 1.907 . . . . 0.0 112.552 174.122 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 12.6 t -128.56 114.62 34.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.225 177.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.74 -177.08 3.37 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.83 -179.088 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 929' ' ' LEU . . . . . 0.584 HD23 ' HG2' ' A' ' 843' ' ' GLN . 1.0 OUTLIER -54.07 -45.75 71.81 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 111.917 0.339 . . . . 0.0 111.917 -175.994 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.98 -36.19 81.62 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.131 0.491 . . . . 0.0 110.669 -177.499 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 69.2 t -76.01 -43.0 38.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.588 -175.249 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 932' ' ' ILE . . . . . 0.613 HD11 HD12 ' A' ' 844' ' ' LEU . 15.4 tt -63.01 -38.95 83.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 178.524 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 2.2 tmmt? -65.12 -48.42 73.68 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.407 178.179 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -59.26 -49.33 78.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.328 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 17.6 m -64.92 -44.02 90.91 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.526 -178.394 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 936' ' ' LEU . . . . . 0.496 HD21 ' HG ' ' A' ' 844' ' ' LEU . 0.8 OUTLIER -62.62 -43.33 99.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.452 179.7 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 937' ' ' THR . . . . . 0.421 ' O ' ' HG2' ' A' ' 941' ' ' GLU . 27.5 m -68.34 -36.25 78.97 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.208 -179.776 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 3.5 tp -64.55 -35.42 80.93 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.956 0.408 . . . . 0.0 110.748 178.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 939' ' ' TYR . . . . . 0.69 ' HD2' HG12 ' A' ' 871' ' ' ILE . 1.1 m-85 -79.17 -36.6 40.06 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.732 178.72 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -64.91 -41.6 95.44 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.928 179.211 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 941' ' ' GLU . . . . . 0.421 ' HG2' ' O ' ' A' ' 937' ' ' THR . 9.7 pt-20 -69.06 -36.07 77.26 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.159 -0.312 . . . . 0.0 110.159 177.518 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 942' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -49.17 78.48 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.801 179.093 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 30.9 m -72.38 -30.61 35.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 C-N-CA 120.821 -0.351 . . . . 0.0 110.717 179.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 1.9 ttt-85 -63.56 -50.34 69.89 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.895 179.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.07 -19.89 61.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.856 0.36 . . . . 0.0 111.278 -178.141 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 17.6 m -81.37 -24.84 36.76 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.061 0.457 . . . . 0.0 110.416 175.6 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -84.05 -53.51 5.49 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.2 0.524 . . . . 0.0 110.443 178.502 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.565 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.659 -174.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.467 0.378 0 CA-C-O 121.1 0.476 . . . . 0.0 110.995 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . -173.31 19.51 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.951 -0.643 . . . . 0.0 112.159 -179.787 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 8.6 mmtm -121.45 145.59 47.77 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 178.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 708' ' ' ARG . . . . . 0.523 ' HG2' HG13 ' A' ' 732' ' ' VAL . 24.3 mtm180 -102.13 161.77 13.43 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.372 0.605 . . . . 0.0 110.685 -178.549 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 1.6 m -135.77 110.5 8.68 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.241 -0.891 . . . . 0.0 108.822 170.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 710' ' ' TRP . . . . . 0.51 ' CZ3' ' HB ' ' A' ' 734' ' ' THR . 97.2 m95 -90.53 103.77 16.43 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.951 -175.489 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 711' ' ' LEU . . . . . 0.525 ' O ' ' HG ' ' A' ' 711' ' ' LEU . 0.8 OUTLIER -102.3 120.48 40.56 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 121.596 0.713 . . . . 0.0 110.655 -177.969 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -104.29 43.46 1.1 Allowed 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.355 -0.839 . . . . 0.0 108.926 175.018 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 713' ' ' VAL . . . . . 0.746 ' HA ' ' CB ' ' A' ' 750' ' ' ASP . 16.4 t -101.42 124.18 54.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.426 -177.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 5.5 mtm-85 -108.43 0.57 21.12 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.404 0.621 . . . . 0.0 110.115 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -82.09 111.11 17.93 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.436 173.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -54.46 -55.03 33.09 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -171.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 717' ' ' SER . . . . . 0.417 ' O ' ' HB2' ' A' ' 721' ' ' PHE . 0.3 OUTLIER -60.4 -36.97 79.37 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.174 0.511 . . . . 0.0 110.926 -178.66 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 718' ' ' LEU . . . . . 0.594 ' HG ' ' HB2' ' A' ' 787' ' ' ALA . 0.9 OUTLIER -73.97 -49.81 22.82 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.206 -177.547 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 719' ' ' CYS . . . . . 0.452 ' O ' ' HB3' ' A' ' 723' ' ' GLU . 19.7 p -67.7 -44.09 78.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.622 -176.393 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.6 -43.65 98.47 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.101 -179.035 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 721' ' ' PHE . . . . . 0.417 ' HB2' ' O ' ' A' ' 717' ' ' SER . 0.8 OUTLIER -58.62 -55.97 28.2 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.911 0.386 . . . . 0.0 111.058 -179.806 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.36 -44.81 93.74 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.127 -177.214 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 723' ' ' GLU . . . . . 0.612 ' HA ' HG11 ' A' ' 733' ' ' VAL . 0.4 OUTLIER -60.68 -48.26 82.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.288 -176.247 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 724' ' ' THR . . . . . . . . . . . . . 8.3 m -63.48 -36.99 85.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.995 0.426 . . . . 0.0 111.087 -177.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 725' ' ' SER . . . . . 0.451 ' HA ' ' HD3' ' A' ' 728' ' ' ARG . 12.4 m -70.09 -37.11 75.32 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.203 -179.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 726' ' ' LEU . . . . . . . . . . . . . 20.9 mt -75.15 -43.94 49.6 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.239 -177.445 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -69.04 -10.63 58.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.133 0.492 . . . . 0.0 111.029 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 728' ' ' ARG . . . . . 0.451 ' HD3' ' HA ' ' A' ' 725' ' ' SER . 0.0 OUTLIER -67.84 -33.05 74.02 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.303 176.6 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.31 5.94 49.81 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.655 -176.152 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 730' ' ' GLY . . . . . . . . . . . . . . . 86.98 14.66 64.27 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.439 -0.886 . . . . 0.0 112.422 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 731' ' ' ILE . . . . . . . . . . . . . 14.9 mm -86.63 129.41 38.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 174.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 732' ' ' VAL . . . . . 0.523 HG13 ' HG2' ' A' ' 708' ' ' ARG . 1.4 p -83.97 103.94 11.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.636 0.731 . . . . 0.0 110.441 -177.426 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 733' ' ' VAL . . . . . 0.612 HG11 ' HA ' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -80.71 115.41 23.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.358 178.543 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 734' ' ' THR . . . . . 0.51 ' HB ' ' CZ3' ' A' ' 710' ' ' TRP . 0.2 OUTLIER -122.9 131.22 53.64 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.431 -177.605 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.27 122.53 17.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.304 -179.06 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 736' ' ' TYR . . . . . 0.446 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 21.8 t80 -86.57 98.0 10.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.157 0.504 . . . . 0.0 110.919 -178.572 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -95.71 -28.64 14.69 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.382 174.359 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 161.2 52.96 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.512 0 N-CA-C 110.774 -0.93 . . . . 0.0 110.774 179.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 8.4 mp0 -101.75 -171.32 1.96 Allowed 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -171.149 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 740' ' ' GLU . . . . . 0.5 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 1.0 OUTLIER -69.5 134.68 88.61 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.799 -176.719 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 741' ' ' PRO . . . . . 0.5 ' HD3' ' HA ' ' A' ' 740' ' ' GLU . 3.9 Cg_endo -88.42 137.41 3.58 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 123.478 2.785 . . . . 0.0 111.614 174.017 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 742' ' ' THR . . . . . 0.658 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.2 OUTLIER -131.55 140.21 37.67 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-O 120.777 0.322 . . . . 0.0 111.082 -179.362 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 743' ' ' PRO . . . . . 0.658 ' HD2' HG22 ' A' ' 742' ' ' THR . 38.3 Cg_endo -66.13 -11.19 30.11 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 123.364 2.71 . . . . 0.0 113.254 -177.401 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -108.95 2.71 21.58 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.05 0.453 . . . . 0.0 110.399 178.328 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 745' ' ' ASP . . . . . 0.444 ' CG ' ' HB2' ' A' ' 708' ' ' ARG . 56.5 m-20 -109.63 152.04 26.06 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.45 -175.625 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 746' ' ' VAL . . . . . 0.658 HG21 HD11 ' A' ' 795' ' ' LEU . 29.2 m -120.25 147.02 24.23 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.082 -178.159 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 747' ' ' LEU . . . . . 0.56 HD12 ' HB2' ' A' ' 757' ' ' TRP . 0.3 OUTLIER -105.05 108.72 20.38 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.112 177.153 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 19.8 mt -94.56 106.54 18.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 N-CA-C 108.82 -0.808 . . . . 0.0 108.82 173.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.94 153.76 19.24 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 116.056 -0.52 . . . . 0.0 112.23 -170.842 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 750' ' ' ASP . . . . . 0.746 ' CB ' ' HA ' ' A' ' 713' ' ' VAL . 9.3 t0 -113.27 113.41 25.25 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 175.361 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 751' ' ' GLU . . . . . 0.552 ' HG3' ' H ' ' A' ' 752' ' ' VAL . 3.1 tp10 68.15 -173.71 0.19 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.274 179.754 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 752' ' ' VAL . . . . . 0.552 ' H ' ' HG3' ' A' ' 751' ' ' GLU . 0.9 OUTLIER -61.0 127.17 20.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.5 178.092 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 8.8 p -114.93 -12.91 11.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.896 179.256 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 6.6 m 55.53 53.43 9.72 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.404 -178.193 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.03 167.96 28.6 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.407 178.612 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 756' ' ' LYS . . . . . 0.464 ' O ' ' HB3' ' A' ' 757' ' ' TRP . 6.1 tptm -111.3 -40.16 4.49 Favored 'General case' 0 C--N 1.322 -0.587 0 O-C-N 123.118 0.261 . . . . 0.0 110.705 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 757' ' ' TRP . . . . . 0.56 ' HB2' HD12 ' A' ' 747' ' ' LEU . 5.5 t-105 73.11 134.86 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.294 0 O-C-N 124.094 0.871 . . . . 0.0 111.005 179.024 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -114.0 115.4 27.55 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.065 178.014 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 759' ' ' GLY . . . . . . . . . . . . . . . -177.25 -139.65 3.37 Favored Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.826 -0.702 . . . . 0.0 111.813 -178.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 8.2 ttt180 -79.22 -54.5 5.91 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.885 0.374 . . . . 0.0 110.08 177.025 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -162.69 163.95 26.71 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.583 179.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 2.5 p -131.88 126.43 56.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.233 -0.44 . . . . 0.0 109.996 176.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 1.9 t -119.97 109.59 26.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.953 -178.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 764' ' ' THR . . . . . 0.412 ' O ' ' HA ' ' A' ' 782' ' ' VAL . 42.5 m -104.35 121.29 43.05 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.169 0.509 . . . . 0.0 112.072 -174.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 765' ' ' PHE . . . . . 0.448 ' CE1' HD22 ' A' ' 791' ' ' LEU . 29.9 m-85 -75.98 150.21 37.47 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 171.772 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -132.75 137.8 46.97 Favored 'General case' 0 C--N 1.318 -0.803 0 C-N-CA 120.923 -0.311 . . . . 0.0 110.591 179.65 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 767' ' ' ARG . . . . . 0.506 ' HB2' ' OE1' ' A' ' 751' ' ' GLU . 6.6 mmm-85 -117.78 43.73 2.33 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.162 0.506 . . . . 0.0 109.732 175.786 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 70.69 12.0 7.24 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 114.976 -1.011 . . . . 0.0 112.331 176.671 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . 0.512 ' HB2' ' CD ' ' A' ' 751' ' ' GLU . 41.1 m80 -102.8 60.66 0.8 Allowed 'General case' 0 C--N 1.328 -0.345 0 O-C-N 122.219 -0.301 . . . . 0.0 110.391 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 49.6 mt 73.11 130.45 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.101 -178.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -92.91 145.25 17.51 Favored Glycine 0 N--CA 1.444 -0.81 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.973 -179.037 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 772' ' ' ILE . . . . . 0.961 HG13 ' HD2' ' A' ' 773' ' ' PRO . 1.0 OUTLIER -89.31 161.9 38.69 Favored Pre-proline 0 C--N 1.323 -0.563 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 174.658 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 773' ' ' PRO . . . . . 0.961 ' HD2' HG13 ' A' ' 772' ' ' ILE . 10.3 Cg_endo -54.37 125.39 18.76 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.512 2.141 . . . . 0.0 112.581 177.021 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . 0.553 ' HB3' HG22 ' A' ' 782' ' ' VAL . 0.8 OUTLIER -93.29 -151.0 0.29 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.162 178.486 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 775' ' ' GLU . . . . . 0.536 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 2.8 mp0 -68.68 50.76 0.07 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.85 0.833 . . . . 0.0 112.947 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 776' ' ' LYS . . . . . 0.446 ' H ' ' HG2' ' A' ' 776' ' ' LYS . 0.0 OUTLIER -103.88 2.12 32.23 Favored 'General case' 0 C--N 1.308 -1.207 0 N-CA-C 107.152 -1.425 . . . . 0.0 107.152 168.342 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 777' ' ' ALA . . . . . 0.446 ' HB1' ' CD ' ' A' ' 778' ' ' PRO . . . -136.51 170.36 11.08 Favored Pre-proline 0 N--CA 1.447 -0.62 0 CA-C-N 113.816 -1.538 . . . . 0.0 109.003 -179.181 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 778' ' ' PRO . . . . . 0.446 ' CD ' ' HB1' ' A' ' 777' ' ' ALA . 31.1 Cg_exo -59.6 -26.94 83.69 Favored 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 122.943 2.429 . . . . 0.0 115.707 -169.011 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . -155.47 32.28 0.64 Allowed Glycine 0 C--N 1.331 0.266 0 C-N-CA 119.777 -1.201 . . . . 0.0 112.671 -174.39 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 780' ' ' GLU . . . . . 0.536 ' O ' ' HG3' ' A' ' 775' ' ' GLU . 10.9 mp0 -103.62 130.04 51.01 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 -177.592 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 22.9 m95 -134.94 151.64 51.03 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.655 -0.248 . . . . 0.0 110.438 -176.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . 0.553 HG22 ' HB3' ' A' ' 774' ' ' LEU . 35.2 m -139.33 157.72 27.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.377 173.643 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 783' ' ' HIS . . . . . 0.4 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 2.6 t-160 -167.3 121.63 1.01 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.97 0.414 . . . . 0.0 110.633 173.484 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -90.37 101.38 14.11 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.476 176.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -157.84 179.39 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.937 179.48 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -108.12 31.81 5.26 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.013 179.682 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 787' ' ' ALA . . . . . 0.594 ' HB2' ' HG ' ' A' ' 718' ' ' LEU . . . 63.6 71.74 0.6 Allowed Pre-proline 0 C--O 1.232 0.141 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.8 178.032 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 788' ' ' PRO . . . . . 0.469 ' HB2' ' H ' ' A' ' 789' ' ' HIS . 5.9 Cg_exo -79.95 -119.25 0.01 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 123.033 2.489 . . . . 0.0 110.885 172.455 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 789' ' ' HIS . . . . . 0.583 ' HA ' ' HG2' ' A' ' 792' ' ' PRO . 1.0 OUTLIER -130.77 12.57 5.3 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.037 -0.665 . . . . 0.0 111.835 175.993 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 790' ' ' GLU . . . . . 0.44 ' H ' ' HG3' ' A' ' 790' ' ' GLU . 0.0 OUTLIER -83.95 -54.02 5.16 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.103 -179.275 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 791' ' ' LEU . . . . . 0.521 ' N ' ' HD2' ' A' ' 792' ' ' PRO . 0.3 OUTLIER -63.31 -47.38 84.58 Favored Pre-proline 0 CA--C 1.535 0.396 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 179.32 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 792' ' ' PRO . . . . . 0.583 ' HG2' ' HA ' ' A' ' 789' ' ' HIS . 9.4 Cg_endo -55.81 -29.95 74.34 Favored 'Trans proline' 0 C--N 1.357 0.975 0 C-N-CA 121.775 1.65 . . . . 0.0 112.19 175.102 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -69.24 -41.23 77.27 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-O 120.881 0.372 . . . . 0.0 110.317 176.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.71 -43.33 97.96 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.825 176.23 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 795' ' ' LEU . . . . . 0.658 HD11 HG21 ' A' ' 746' ' ' VAL . 1.1 mm? -63.34 -45.07 92.94 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.782 178.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -63.4 -37.38 87.06 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.227 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.91 -34.66 71.76 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.455 -0.338 . . . . 0.0 110.372 178.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -62.47 -42.37 95.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.585 179.661 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -88.15 4.63 44.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.766 0.317 . . . . 0.0 110.913 179.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 40.1 mt . . . . . 0 C--O 1.233 0.191 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.843 178.148 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 10.5 t0 . . . . . 0 C--O 1.234 0.273 0 CA-C-O 121.133 0.492 . . . . 0.0 110.805 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -98.12 101.13 12.52 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.346 177.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 826' ' ' MET . . . . . . . . . . . . . 2.6 tpp -104.76 116.54 32.19 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.84 -178.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 827' ' ' ILE . . . . . 0.672 ' HB ' HD21 ' A' ' 844' ' ' LEU . 14.4 mm -114.44 137.19 48.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.309 -179.536 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 828' ' ' LEU . . . . . 0.644 HD11 HG13 ' A' ' 863' ' ' VAL . 0.4 OUTLIER -98.24 131.84 44.24 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.709 -179.479 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 829' ' ' VAL . . . . . 0.744 HG23 HD12 ' A' ' 840' ' ' LEU . 0.2 OUTLIER -122.1 104.09 14.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 174.919 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 830' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -120.67 100.57 9.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.196 -177.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 831' ' ' ASP . . . . . 0.807 ' HB2' ' HB3' ' A' ' 875' ' ' ASP . 0.2 OUTLIER -117.63 154.4 31.64 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.36 -177.173 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -94.01 -16.42 23.91 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -173.411 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 833' ' ' HIS . . . . . 0.421 ' HB2' ' HB2' ' A' ' 877' ' ' ASN . 1.1 m170 -124.5 98.87 37.05 Favored Pre-proline 0 C--N 1.328 -0.354 0 O-C-N 122.068 -0.395 . . . . 0.0 111.196 -178.427 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_exo -30.64 -39.34 0.06 OUTLIER 'Trans proline' 0 C--N 1.353 0.793 1 C-N-CA 126.032 4.488 . . . . 0.0 116.871 -168.654 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 835' ' ' ILE . . . . . 0.532 ' O ' ' HG3' ' A' ' 838' ' ' ARG . 8.2 tp -59.38 -41.57 84.78 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-N 117.846 0.293 . . . . 0.0 111.689 -176.625 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 836' ' ' ASN . . . . . 0.586 ' HA ' ' HB2' ' A' ' 839' ' ' LEU . 0.8 OUTLIER -79.79 -31.95 40.8 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 -178.802 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 837' ' ' ARG . . . . . 0.435 ' HB2' ' OD2' ' A' ' 831' ' ' ASP . 0.7 OUTLIER -52.73 -48.01 66.98 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.4 176.217 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 838' ' ' ARG . . . . . 0.532 ' HG3' ' O ' ' A' ' 835' ' ' ILE . 0.0 OUTLIER -73.99 -28.72 61.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.737 177.609 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 839' ' ' LEU . . . . . 0.586 ' HB2' ' HA ' ' A' ' 836' ' ' ASN . 0.2 OUTLIER -62.35 -53.92 47.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.728 -0.215 . . . . 0.0 111.442 -178.342 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 840' ' ' LEU . . . . . 0.744 HD12 HG23 ' A' ' 829' ' ' VAL . 0.0 OUTLIER -74.21 -29.55 61.78 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.393 -0.523 . . . . 0.0 110.731 -179.502 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -64.49 -38.65 91.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.233 0.539 . . . . 0.0 110.509 177.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -61.6 -49.53 76.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.408 -0.814 . . . . 0.0 109.941 176.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 843' ' ' GLN . . . . . 0.869 ' HG3' HD23 ' A' ' 929' ' ' LEU . 0.0 OUTLIER -58.99 -46.46 88.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.84 -179.811 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 844' ' ' LEU . . . . . 0.672 HD21 ' HB ' ' A' ' 827' ' ' ILE . 0.0 OUTLIER -60.07 -39.87 87.55 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.635 178.073 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -61.71 -39.29 97.22 Favored Glycine 0 N--CA 1.448 -0.506 0 CA-C-N 115.697 -0.683 . . . . 0.0 112.317 176.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.24 -30.49 66.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.972 0.415 . . . . 0.0 110.485 179.769 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 29.3 mt -73.98 -21.25 60.07 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.812 178.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 86.86 38.28 8.1 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 121.087 -0.578 . . . . 0.0 112.962 175.675 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 849' ' ' TYR . . . . . 0.414 ' HB2' HD23 ' A' ' 844' ' ' LEU . 75.0 m-85 -118.2 150.54 39.23 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 178.263 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -72.25 109.67 6.15 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 179.344 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 851' ' ' CYS . . . . . 0.609 ' HB3' HD22 ' A' ' 844' ' ' LEU . 0.0 OUTLIER -102.15 112.07 24.6 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.241 -174.61 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -86.99 108.9 19.04 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 176.079 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 853' ' ' THR . . . . . 0.422 ' HA ' HG13 ' A' ' 829' ' ' VAL . 0.3 OUTLIER -104.1 123.43 47.24 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.015 0.436 . . . . 0.0 111.89 -171.355 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 854' ' ' ALA . . . . . . . . . . . . . . . -140.16 146.9 39.38 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.474 176.62 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 855' ' ' ASN . . . . . 0.436 ' HA ' ' O ' ' A' ' 831' ' ' ASP . 6.1 t-20 -114.76 76.47 0.99 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.109 0.48 . . . . 0.0 110.479 179.629 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 856' ' ' ASP . . . . . . . . . . . . . 8.8 t0 178.95 167.97 0.93 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.154 178.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -91.25 -53.39 2.18 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 121.21 -0.519 . . . . 0.0 111.831 178.344 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 6.6 m -58.23 -32.12 43.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.73 0.3 . . . . 0.0 111.707 -179.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -68.23 -20.1 64.79 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.41 -177.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -67.39 -39.9 85.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.171 0.51 . . . . 0.0 110.059 176.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 861' ' ' LEU . . . . . 0.582 HD11 ' HG ' ' A' ' 893' ' ' LEU . 0.2 OUTLIER -74.31 -37.37 63.64 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.126 176.784 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -65.37 -43.26 91.36 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.137 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 863' ' ' VAL . . . . . 0.644 HG13 HD11 ' A' ' 828' ' ' LEU . 9.3 p -71.88 -31.54 41.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.739 -0.209 . . . . 0.0 110.662 179.229 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 864' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.92 -36.06 71.95 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.175 0.512 . . . . 0.0 109.886 173.546 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 3.6 m -87.13 -16.7 34.67 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.718 178.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 866' ' ' LYS . . . . . 0.637 ' HB2' ' HA ' ' A' ' 863' ' ' VAL . 17.8 mttt -70.76 -55.42 8.65 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.39 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -143.67 -174.81 4.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.197 179.225 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -98.03 125.31 42.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.076 0.465 . . . . 0.0 111.354 -177.064 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 869' ' ' ILE . . . . . 0.638 HG21 ' HB2' ' A' ' 828' ' ' LEU . 3.4 mp -122.27 148.54 25.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.825 179.288 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -94.58 -58.79 2.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.782 0.325 . . . . 0.0 111.314 -176.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 871' ' ' ILE . . . . . 0.649 HG13 ' HG2' ' A' ' 898' ' ' PRO . 0.9 OUTLIER -116.27 135.72 55.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 179.227 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 872' ' ' VAL . . . . . . . . . . . . . 97.3 t -119.08 125.26 74.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.802 -178.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 873' ' ' LEU . . . . . 0.464 HD23 HD12 ' A' ' 900' ' ' ILE . 0.0 OUTLIER -109.79 116.0 30.87 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.908 0.385 . . . . 0.0 109.979 174.791 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -104.11 112.57 25.62 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 177.825 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 875' ' ' ASP . . . . . 0.807 ' HB3' ' HB2' ' A' ' 831' ' ' ASP . 58.6 t0 -109.52 124.54 51.26 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.576 -175.144 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -124.75 133.86 68.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.024 0.44 . . . . 0.0 110.721 -177.767 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 877' ' ' ASN . . . . . 0.502 ' HA ' ' HD2' ' A' ' 925' ' ' LYS . 0.1 OUTLIER -88.38 -18.32 28.65 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.067 176.886 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 28.1 mmt . . . . . 0 C--N 1.321 -0.665 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.85 179.12 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.223 -0.566 0 N-CA-C 113.025 -0.03 . . . . 0.0 113.025 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 22.2 t80 -118.16 -50.37 2.47 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 173.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 885' ' ' ARG . . . . . 0.418 ' O ' ' HB2' ' A' ' 889' ' ' ARG . 0.0 OUTLIER -64.53 -34.44 78.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.438 179.067 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -62.54 -52.76 62.17 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 116.253 -0.43 . . . . 0.0 109.848 177.19 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -60.67 -42.79 97.79 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.171 0.51 . . . . 0.0 111.094 -178.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 888' ' ' GLN . . . . . 0.413 ' HA ' ' OE1' ' A' ' 888' ' ' GLN . 2.5 tp-100 -62.66 -42.81 99.82 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.892 178.592 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 889' ' ' ARG . . . . . 0.509 ' HD3' ' HA ' ' A' ' 889' ' ' ARG . 0.0 OUTLIER -71.82 -44.18 64.34 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.546 -176.32 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 890' ' ' ILE . . . . . 0.467 HG23 HD12 ' A' ' 895' ' ' LEU . 3.3 tt -67.08 -37.54 79.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.826 -0.17 . . . . 0.0 111.449 -176.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 891' ' ' ARG . . . . . 0.812 ' HA ' ' HB2' ' A' ' 895' ' ' LEU . 5.6 ptm180 -72.01 -35.49 69.45 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.808 -0.357 . . . . 0.0 110.493 178.602 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -73.24 -22.71 60.36 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.994 -179.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 893' ' ' LEU . . . . . 0.582 ' HG ' HD11 ' A' ' 861' ' ' LEU . 0.1 OUTLIER -82.53 0.94 40.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.131 -178.538 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 101.11 51.45 1.15 Allowed Glycine 0 N--CA 1.448 -0.511 0 CA-C-N 115.712 -0.677 . . . . 0.0 112.484 176.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 895' ' ' LEU . . . . . 0.812 ' HB2' ' HA ' ' A' ' 891' ' ' ARG . 0.4 OUTLIER -72.91 114.21 10.81 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.975 0.417 . . . . 0.0 110.34 178.435 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -120.66 -12.74 8.83 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.075 -179.789 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 897' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -100.08 153.5 37.73 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.474 -175.877 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 898' ' ' PRO . . . . . 0.649 ' HG2' HG13 ' A' ' 871' ' ' ILE . 55.1 Cg_endo -71.12 126.56 12.54 Favored 'Trans proline' 0 C--O 1.239 0.527 0 C-N-CA 122.592 2.195 . . . . 0.0 112.697 -178.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 899' ' ' VAL . . . . . 0.74 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 97.7 t -112.4 119.38 60.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.117 177.305 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 900' ' ' ILE . . . . . 0.464 HD12 HD23 ' A' ' 873' ' ' LEU . 5.5 mt -95.8 115.58 35.3 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.977 179.597 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -95.06 93.79 1.66 Allowed Glycine 0 N--CA 1.444 -0.796 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.666 -174.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 902' ' ' VAL . . . . . 0.618 ' O ' ' HA ' ' A' ' 875' ' ' ASP . 1.3 t -76.8 125.24 36.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 175.584 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -139.35 149.24 43.93 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.233 0.539 . . . . 0.0 111.134 -179.019 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -71.13 113.67 8.41 Favored 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 168.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -52.43 102.64 0.05 Allowed 'General case' 0 C--O 1.234 0.246 0 O-C-N 123.463 0.477 . . . . 0.0 110.531 -176.161 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 906' ' ' ALA . . . . . 0.502 ' HB3' ' OE1' ' A' ' 909' ' ' GLU . . . -102.53 -77.68 0.55 Allowed 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.824 -174.625 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 5.7 mt -147.9 -86.97 0.09 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.847 0.356 . . . . 0.0 111.748 -176.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 908' ' ' ALA . . . . . 0.406 ' O ' ' HG2' ' A' ' 912' ' ' GLN . . . -102.0 24.88 9.4 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -170.073 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 909' ' ' GLU . . . . . 0.502 ' OE1' ' HB3' ' A' ' 906' ' ' ALA . 3.8 mp0 -56.73 -33.46 66.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.97 -179.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 910' ' ' GLU . . . . . 0.439 ' H ' ' HG3' ' A' ' 910' ' ' GLU . 0.0 OUTLIER -63.21 -50.89 68.46 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.667 179.14 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -58.21 -47.73 82.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.822 178.215 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 912' ' ' GLN . . . . . 0.406 ' HG2' ' O ' ' A' ' 908' ' ' ALA . 10.7 mm100 -61.14 -45.73 93.46 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.227 -178.211 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 913' ' ' ARG . . . . . 0.473 ' HD2' ' SG ' ' A' ' 922' ' ' CYS . 0.0 OUTLIER -55.78 -44.35 77.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.225 -178.729 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 10.8 m -73.83 -34.04 64.38 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.161 -178.37 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 2.8 tp -70.31 -40.47 74.21 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.796 0.331 . . . . 0.0 111.4 -178.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -77.95 -44.5 26.64 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.122 179.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 50.45 45.1 26.76 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.8 -0.637 . . . . 0.0 111.278 -177.635 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -116.42 24.68 9.65 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.814 -0.708 . . . . 0.0 111.948 -179.011 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 919' ' ' MET . . . . . 0.74 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -137.0 -100.44 0.2 Allowed 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 179.555 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 920' ' ' ASP . . . . . 0.471 ' H ' ' HB2' ' A' ' 919' ' ' MET . 15.4 t70 171.46 -64.96 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.45 175.358 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -121.59 175.34 6.27 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.649 -177.532 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 922' ' ' CYS . . . . . 0.473 ' SG ' ' HD2' ' A' ' 913' ' ' ARG . 0.4 OUTLIER -137.14 135.26 37.22 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.325 176.78 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 923' ' ' LEU . . . . . 0.669 HD11 HG21 ' A' ' 935' ' ' THR . 13.7 mt -120.67 167.62 12.25 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.284 -179.029 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -93.43 135.01 35.09 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 174.748 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 925' ' ' LYS . . . . . 0.502 ' HD2' ' HA ' ' A' ' 877' ' ' ASN . 0.1 OUTLIER -49.16 -44.17 71.76 Favored Pre-proline 0 CA--C 1.539 0.555 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -177.647 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -66.01 75.85 0.33 Allowed 'Trans proline' 0 C--N 1.356 0.935 0 C-N-CA 122.03 1.82 . . . . 0.0 112.402 174.215 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -87.96 159.43 3.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.395 179.495 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 928' ' ' THR . . . . . 0.47 ' O ' ' HB ' ' A' ' 932' ' ' ILE . 0.0 OUTLIER -131.97 172.9 11.77 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.639 -179.623 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 929' ' ' LEU . . . . . 0.869 HD23 ' HG3' ' A' ' 843' ' ' GLN . 1.3 tm? -61.67 -48.25 81.68 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.695 0.283 . . . . 0.0 111.699 -176.201 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -78.01 -32.0 50.89 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.864 -0.334 . . . . 0.0 111.327 -175.264 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -74.74 -36.19 39.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 C-N-CA 120.964 -0.295 . . . . 0.0 110.667 179.48 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 932' ' ' ILE . . . . . 0.789 HG21 ' HB3' ' A' ' 843' ' ' GLN . 0.4 OUTLIER -69.03 -34.73 65.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 174.611 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.9 -46.01 91.23 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.991 -0.55 . . . . 0.0 109.876 174.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -54.81 -58.27 8.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.766 177.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 935' ' ' THR . . . . . 0.669 HG21 HD11 ' A' ' 923' ' ' LEU . 1.9 m -57.55 -51.46 69.39 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.96 -178.363 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 936' ' ' LEU . . . . . 0.572 HD11 HG21 ' A' ' 827' ' ' ILE . 1.8 tp -61.68 -45.72 92.79 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.513 -177.014 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 41.3 m -67.4 -36.31 81.05 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.377 -178.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 938' ' ' LEU . . . . . 0.465 ' O ' ' HG3' ' A' ' 941' ' ' GLU . 3.6 tp -71.43 -36.64 71.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.158 0.504 . . . . 0.0 111.307 -178.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 939' ' ' TYR . . . . . 0.714 ' HA ' ' HB2' ' A' ' 942' ' ' ARG . 40.0 m-85 -86.49 -25.63 25.03 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 121.877 -0.514 . . . . 0.0 111.521 -178.076 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -67.53 -39.82 85.04 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.947 0.403 . . . . 0.0 110.282 173.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 941' ' ' GLU . . . . . 0.465 ' HG3' ' O ' ' A' ' 938' ' ' LEU . 0.2 OUTLIER -72.53 -27.91 62.53 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 174.647 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 942' ' ' ARG . . . . . 0.714 ' HB2' ' HA ' ' A' ' 939' ' ' TYR . 0.0 OUTLIER -60.5 -49.42 77.63 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.881 -179.578 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 6.5 m -72.46 -31.87 39.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.711 178.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.61 -36.17 82.94 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.226 -179.404 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.58 -23.51 29.61 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.596 0.236 . . . . 0.0 111.067 179.393 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 51.0 m -72.66 -39.03 67.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.129 0.49 . . . . 0.0 109.963 177.004 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 2.3 mtp180 -84.35 -30.05 25.8 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.579 177.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.466 -175.256 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.32 0 CA-C-O 121.075 0.464 . . . . 0.0 109.933 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 119.31 20.72 3.9 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.269 -178.134 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 707' ' ' LYS . . . . . 0.686 ' HB2' HG12 ' A' ' 731' ' ' ILE . 15.0 mmtt -81.79 165.38 20.95 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 177.67 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 708' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -121.01 130.51 53.82 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -172.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -118.02 111.71 19.29 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.345 177.074 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 710' ' ' TRP . . . . . 0.447 ' O ' HD23 ' A' ' 747' ' ' LEU . 98.3 m95 -97.24 112.08 24.04 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 175.337 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 711' ' ' LEU . . . . . 0.565 HD11 ' SG ' ' A' ' 719' ' ' CYS . 0.1 OUTLIER -121.87 131.64 54.14 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.16 0.505 . . . . 0.0 111.285 -174.741 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -125.23 57.57 1.3 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.598 179.152 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 713' ' ' VAL . . . . . 0.823 ' HA ' ' HB2' ' A' ' 750' ' ' ASP . 12.5 t -103.97 125.15 58.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.566 -177.004 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 714' ' ' ARG . . . . . 0.485 ' NH2' ' HG3' ' A' ' 751' ' ' GLU . 18.9 mtm180 -82.66 -38.38 23.54 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.029 0.442 . . . . 0.0 109.883 179.262 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -65.83 102.75 0.8 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.74 176.03 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 716' ' ' ALA . . . . . 0.53 ' HA ' ' HB3' ' A' ' 719' ' ' CYS . . . -63.63 -26.32 68.62 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.071 -174.856 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 4.3 m -65.01 -46.22 82.3 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.118 0.485 . . . . 0.0 109.913 176.006 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 718' ' ' LEU . . . . . 0.419 ' HB3' HG11 ' A' ' 713' ' ' VAL . 0.9 OUTLIER -74.14 -39.57 63.2 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.543 178.385 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 719' ' ' CYS . . . . . 0.648 ' HB2' ' HB ' ' A' ' 713' ' ' VAL . 0.7 OUTLIER -59.59 -51.56 69.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.7 179.683 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 720' ' ' GLN . . . . . 0.793 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -64.99 -33.7 76.67 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.524 -179.383 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -54.73 -55.8 26.07 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.172 0.511 . . . . 0.0 110.145 177.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -68.26 -48.5 64.9 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.177 -177.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 723' ' ' GLU . . . . . 0.793 ' HG2' ' HA ' ' A' ' 720' ' ' GLN . 10.4 pt-20 -60.77 -41.86 96.33 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 111.601 0.222 . . . . 0.0 111.601 -174.495 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 724' ' ' THR . . . . . . . . . . . . . 53.7 m -67.35 -44.37 79.2 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.948 0.404 . . . . 0.0 110.732 -179.239 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 74.0 m -66.57 -39.48 88.51 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.717 -177.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 726' ' ' LEU . . . . . . . . . . . . . 67.1 mt -74.96 -39.37 61.36 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.264 -178.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 1.6 pp0? -72.07 -23.75 61.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.792 -0.185 . . . . 0.0 111.062 -179.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 9.1 ptt85 -66.74 -22.25 66.05 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 121.278 0.561 . . . . 0.0 110.42 177.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 19.9 m -88.01 -78.39 0.32 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.299 179.695 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 730' ' ' GLY . . . . . . . . . . . . . . . 177.76 39.85 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 111.053 -0.819 . . . . 0.0 111.053 179.176 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 731' ' ' ILE . . . . . 0.686 HG12 ' HB2' ' A' ' 707' ' ' LYS . 27.0 mt -119.24 127.98 75.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 115.165 -0.518 . . . . 0.0 110.165 -177.454 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 732' ' ' VAL . . . . . 0.403 HG22 ' O ' ' A' ' 707' ' ' LYS . 10.6 m -81.21 118.45 29.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.339 0.59 . . . . 0.0 110.538 179.311 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 733' ' ' VAL . . . . . 0.521 ' CG1' HD22 ' A' ' 711' ' ' LEU . 21.9 t -89.71 125.04 42.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.628 -178.105 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 734' ' ' THR . . . . . 0.431 ' HB ' ' CZ3' ' A' ' 710' ' ' TRP . 0.3 OUTLIER -133.11 136.26 45.72 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.438 0.637 . . . . 0.0 110.571 -178.898 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.29 113.56 3.68 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.759 -1.11 . . . . 0.0 111.075 178.145 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -80.09 78.95 6.7 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.455 0.645 . . . . 0.0 109.605 176.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -78.36 -28.78 47.17 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.031 179.694 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 164.89 55.08 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.53 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 179.395 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 17.3 mp0 -96.63 -171.41 2.26 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.851 0.358 . . . . 0.0 111.331 -174.058 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -98.94 147.37 33.12 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.776 -176.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 741' ' ' PRO . . . . . 0.581 ' HA ' ' CZ3' ' A' ' 757' ' ' TRP . 73.0 Cg_endo -78.43 131.1 10.35 Favored 'Trans proline' 0 N--CA 1.463 -0.314 0 C-N-CA 122.825 2.35 . . . . 0.0 113.132 179.266 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 742' ' ' THR . . . . . 0.493 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.2 OUTLIER -118.21 135.39 23.49 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.394 176.411 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 743' ' ' PRO . . . . . 0.876 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 19.6 Cg_endo -60.7 -18.15 53.8 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 123.149 2.566 . . . . 0.0 113.152 -177.64 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -105.89 10.52 32.43 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.55 -0.296 . . . . 0.0 110.608 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -118.74 156.31 29.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.203 -174.342 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 746' ' ' VAL . . . . . 0.405 HG12 ' HB3' ' A' ' 760' ' ' ARG . 1.5 m -122.29 147.67 26.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.277 -178.395 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 747' ' ' LEU . . . . . 0.653 ' HB3' HG23 ' A' ' 762' ' ' VAL . 0.3 OUTLIER -118.13 134.65 54.8 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.97 178.944 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -127.58 107.79 17.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 172.846 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 749' ' ' THR . . . . . 0.429 HG23 ' HA ' ' A' ' 764' ' ' THR . 1.4 t -109.07 146.04 34.66 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.467 0.651 . . . . 0.0 112.016 -172.629 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 750' ' ' ASP . . . . . 0.823 ' HB2' ' HA ' ' A' ' 713' ' ' VAL . 59.8 t0 -91.88 108.56 20.01 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.968 -1.015 . . . . 0.0 109.442 175.569 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 751' ' ' GLU . . . . . 0.485 ' HG3' ' NH2' ' A' ' 714' ' ' ARG . 3.1 mm-40 63.47 -159.74 0.31 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.865 -174.858 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 752' ' ' VAL . . . . . . . . . . . . . 3.8 t -86.58 119.78 35.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.02 0.438 . . . . 0.0 112.099 -170.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 3.4 m -107.51 -3.31 10.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.462 172.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 13.0 m 53.88 55.02 8.93 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.61 -179.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.48 137.62 52.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.541 -179.335 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 20.7 tptt -100.4 87.48 3.41 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.346 0.593 . . . . 0.0 109.674 176.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 757' ' ' TRP . . . . . 0.581 ' CZ3' ' HA ' ' A' ' 741' ' ' PRO . 76.1 t-105 -67.93 106.03 2.19 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.631 -178.747 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.95 87.83 6.36 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 173.64 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 759' ' ' GLY . . . . . 0.876 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -159.18 -139.58 2.71 Favored Glycine 0 N--CA 1.444 -0.811 0 C-N-CA 120.512 -0.852 . . . . 0.0 112.377 -178.159 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 760' ' ' ARG . . . . . 0.405 ' HB3' HG12 ' A' ' 746' ' ' VAL . 0.7 OUTLIER -71.18 -55.64 7.73 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.989 -0.284 . . . . 0.0 110.573 178.6 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -170.59 150.69 3.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.874 179.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 762' ' ' VAL . . . . . 0.653 HG23 ' HB3' ' A' ' 747' ' ' LEU . 4.5 p -130.23 127.44 63.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.248 175.446 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 763' ' ' VAL . . . . . 0.694 HG11 HD21 ' A' ' 791' ' ' LEU . 85.6 t -112.46 128.65 69.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.515 178.455 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 764' ' ' THR . . . . . 0.429 ' HA ' HG23 ' A' ' 749' ' ' THR . 35.5 m -109.17 118.27 36.31 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.105 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 765' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -84.51 107.29 16.67 Favored 'General case' 0 C--O 1.223 -0.313 0 N-CA-C 109.813 -0.439 . . . . 0.0 109.813 177.341 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.06 134.31 36.61 Favored 'General case' 0 C--N 1.317 -0.848 0 C-N-CA 120.844 -0.343 . . . . 0.0 110.196 -175.474 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.79 -65.35 1.07 Allowed 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.803 -0.359 . . . . 0.0 111.312 -179.632 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 3.7 mtp85 -143.67 -4.82 0.84 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -176.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 2.3 m170 -84.17 -67.74 0.77 Allowed 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.294 -0.562 . . . . 0.0 110.863 -178.448 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 25.4 mt 68.65 144.6 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 CA-C-O 121.202 0.525 . . . . 0.0 111.395 -179.447 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . 158.88 -32.2 0.47 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.825 -0.703 . . . . 0.0 111.624 -178.297 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 772' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -82.09 154.24 69.73 Favored Pre-proline 0 C--N 1.324 -0.531 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 176.136 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 773' ' ' PRO . . . . . 0.506 ' HB2' ' H ' ' A' ' 774' ' ' LEU . 12.7 Cg_exo -70.58 -119.88 0.01 OUTLIER 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.792 2.328 . . . . 0.0 112.913 -179.732 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . 0.767 ' HA ' HG13 ' A' ' 782' ' ' VAL . 1.1 pt? 178.25 -167.04 0.06 Allowed 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 122.676 0.39 . . . . 0.0 110.105 -177.606 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 775' ' ' GLU . . . . . 0.723 ' HG3' ' HA ' ' A' ' 781' ' ' TRP . 2.4 mp0 -63.03 68.87 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 121.603 0.716 . . . . 0.0 112.631 174.472 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -127.82 6.61 6.11 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 114.642 -1.163 . . . . 0.0 108.214 171.712 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -145.42 144.3 22.61 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 114.314 -1.312 . . . . 0.0 108.946 179.233 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -60.62 100.57 0.16 Allowed 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 122.496 2.131 . . . . 0.0 112.97 -177.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 116.75 -3.92 19.36 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.996 176.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 780' ' ' GLU . . . . . 0.622 ' O ' ' HG3' ' A' ' 775' ' ' GLU . 10.2 tt0 -103.71 123.67 47.45 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 -177.296 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 781' ' ' TRP . . . . . 0.723 ' HA ' ' HG3' ' A' ' 775' ' ' GLU . 23.2 m95 -134.76 137.41 43.41 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 -179.606 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . 0.767 HG13 ' HA ' ' A' ' 774' ' ' LEU . 3.6 m -136.28 151.65 28.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 120.775 0.322 . . . . 0.0 110.29 173.075 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 783' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -167.5 129.18 1.56 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.477 -0.328 . . . . 0.0 110.492 178.858 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.61 101.92 11.11 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 174.255 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 785' ' ' VAL . . . . . 0.846 HG13 ' H ' ' A' ' 787' ' ' ALA . 1.8 p -170.91 168.15 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.202 -175.802 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -108.58 27.78 9.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.754 0.311 . . . . 0.0 110.781 -179.677 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 787' ' ' ALA . . . . . 0.846 ' H ' HG13 ' A' ' 785' ' ' VAL . . . 49.12 57.27 18.35 Favored Pre-proline 0 N--CA 1.47 0.527 0 CA-C-N 115.209 -0.905 . . . . 0.0 112.905 178.877 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 788' ' ' PRO . . . . . 0.509 ' HD3' ' N ' ' A' ' 787' ' ' ALA . 2.7 Cg_exo -76.35 -42.26 0.39 Allowed 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 122.285 1.99 . . . . 0.0 113.414 -178.049 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 4.9 p-80 -151.64 -14.62 0.2 Allowed 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 -170.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 790' ' ' GLU . . . . . 0.457 ' CD ' ' H ' ' A' ' 790' ' ' GLU . 0.0 OUTLIER -112.75 -41.92 3.71 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -169.393 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 791' ' ' LEU . . . . . 0.694 HD21 HG11 ' A' ' 763' ' ' VAL . 0.3 OUTLIER -67.89 -50.42 33.04 Favored Pre-proline 0 C--N 1.325 -0.487 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.035 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 792' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -63.9 -26.73 66.94 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 121.3 1.333 . . . . 0.0 111.411 179.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -75.0 -39.11 61.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.33 176.359 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -62.66 -41.07 98.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.76 176.382 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 795' ' ' LEU . . . . . 0.516 HD22 ' HA ' ' A' ' 795' ' ' LEU . 0.2 OUTLIER -60.26 -45.53 92.96 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.454 177.624 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -63.54 -38.72 92.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.925 178.456 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 797' ' ' ARG . . . . . 0.514 ' HA ' HD12 ' A' ' 800' ' ' LEU . 0.0 OUTLIER -67.18 -32.71 73.98 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.9 0.381 . . . . 0.0 110.526 178.959 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -70.77 -28.04 32.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.063 0.459 . . . . 0.0 110.694 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 799' ' ' TYR . . . . . 0.528 ' CE2' ' HB3' ' A' ' 707' ' ' LYS . 0.2 OUTLIER -104.26 9.32 36.06 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.171 176.882 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 800' ' ' LEU . . . . . 0.514 HD12 ' HA ' ' A' ' 797' ' ' ARG . 3.9 mt . . . . . 0 C--N 1.326 -0.415 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 177.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 824' ' ' ASP . . . . . 0.449 ' HB3' ' H ' ' A' ' 825' ' ' MET . 4.7 t0 . . . . . 0 N--CA 1.457 -0.118 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 825' ' ' MET . . . . . 0.449 ' H ' ' HB3' ' A' ' 824' ' ' ASP . 0.0 OUTLIER -93.28 129.92 39.18 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.02 179.508 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 826' ' ' MET . . . . . 0.509 ' HG3' ' O ' ' A' ' 868' ' ' HIS . 0.0 OUTLIER -124.54 139.25 54.06 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.561 0.696 . . . . 0.0 112.14 -174.777 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 827' ' ' ILE . . . . . 0.543 HG23 ' HB ' ' A' ' 871' ' ' ILE . 3.5 mm -121.25 137.43 54.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.051 -0.977 . . . . 0.0 109.534 177.894 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 13.5 tp -98.4 122.47 41.62 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 179.435 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -112.49 113.57 44.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 120.867 0.365 . . . . 0.0 110.424 -179.277 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 830' ' ' VAL . . . . . 0.501 ' HA ' ' O ' ' A' ' 854' ' ' ALA . 2.9 t -118.21 86.37 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.713 -177.247 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 831' ' ' ASP . . . . . 0.802 ' HA ' ' HB2' ' A' ' 875' ' ' ASP . 13.8 t70 -93.39 154.83 17.73 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.143 0.497 . . . . 0.0 111.475 -173.35 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 832' ' ' ASP . . . . . 1.068 ' HB3' ' HB ' ' A' ' 876' ' ' VAL . 0.0 OUTLIER -60.75 -33.67 73.28 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.818 -177.238 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 833' ' ' HIS . . . . . 0.678 ' HB2' HD21 ' A' ' 836' ' ' ASN . 34.8 m170 -136.4 138.61 27.36 Favored Pre-proline 0 N--CA 1.463 0.186 0 CA-C-O 120.517 0.198 . . . . 0.0 110.519 -178.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 834' ' ' PRO . . . . . 0.447 ' HA ' ' HB3' ' A' ' 837' ' ' ARG . 52.1 Cg_exo -56.12 -25.6 55.69 Favored 'Trans proline' 0 CA--C 1.532 0.415 0 C-N-CA 123.115 2.543 . . . . 0.0 113.511 -178.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -69.68 -48.18 66.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.946 0.403 . . . . 0.0 111.058 -179.092 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 836' ' ' ASN . . . . . 0.678 HD21 ' HB2' ' A' ' 833' ' ' HIS . 0.1 OUTLIER -74.35 -33.3 63.08 Favored 'General case' 0 CA--C 1.515 -0.396 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 178.508 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 837' ' ' ARG . . . . . 0.585 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 6.5 ttp180 -53.45 -43.2 67.89 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.193 175.042 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.75 -30.32 67.89 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.665 178.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.98 -49.13 66.36 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.312 178.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 840' ' ' LEU . . . . . 0.504 ' H ' ' HG ' ' A' ' 840' ' ' LEU . 0.0 OUTLIER -69.05 -32.94 72.79 Favored 'General case' 0 CA--C 1.521 -0.146 0 C-N-CA 120.704 -0.399 . . . . 0.0 110.139 178.216 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -64.97 -32.05 73.59 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.009 177.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.24 -42.62 88.35 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.04 0.447 . . . . 0.0 109.829 176.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 843' ' ' GLN . . . . . 0.545 ' HG3' ' CD2' ' A' ' 929' ' ' LEU . 0.0 OUTLIER -65.24 -46.88 78.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.842 178.868 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 844' ' ' LEU . . . . . 0.48 HD21 HD21 ' A' ' 936' ' ' LEU . 0.1 OUTLIER -59.18 -40.95 87.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.331 177.783 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -70.2 -27.39 72.92 Favored Glycine 0 N--CA 1.453 -0.205 0 C-N-CA 121.306 -0.473 . . . . 0.0 112.537 -179.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 18.4 m -79.34 -23.69 43.25 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.059 0.457 . . . . 0.0 110.449 177.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.04 -22.49 42.32 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.266 177.116 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 84.48 58.31 2.19 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.894 -0.669 . . . . 0.0 112.116 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 849' ' ' TYR . . . . . 0.44 ' HE1' ' HB3' ' A' ' 825' ' ' MET . 2.4 m-85 -132.75 147.26 52.32 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 29.1 mm-40 -72.99 115.39 12.24 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 176.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 851' ' ' CYS . . . . . 0.469 ' SG ' ' HB3' ' A' ' 844' ' ' LEU . 0.0 OUTLIER -109.48 136.08 49.45 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.986 0.422 . . . . 0.0 111.029 -176.277 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.3 116.45 31.03 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 173.757 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 853' ' ' THR . . . . . 0.482 ' HB ' ' CZ ' ' A' ' 837' ' ' ARG . 0.2 OUTLIER -91.02 134.11 34.76 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -171.464 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 854' ' ' ALA . . . . . 0.501 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -151.47 164.55 36.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.935 175.128 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 855' ' ' ASN . . . . . 0.54 ' O ' ' HB3' ' A' ' 856' ' ' ASP . 0.2 OUTLIER -153.5 74.02 0.99 Allowed 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.74 0.305 . . . . 0.0 110.978 176.63 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 856' ' ' ASP . . . . . 0.54 ' HB3' ' O ' ' A' ' 855' ' ' ASN . 4.3 p-10 163.82 173.65 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 124.28 1.032 . . . . 0.0 109.712 178.647 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -87.04 -44.2 5.75 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.732 -0.747 . . . . 0.0 113.898 -175.094 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -67.5 -38.21 80.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 112.011 0.374 . . . . 0.0 112.011 -174.324 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -67.89 -37.28 81.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.914 0.388 . . . . 0.0 110.622 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -61.63 -38.83 89.1 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.417 177.577 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 861' ' ' LEU . . . . . 0.496 HD21 ' HA ' ' A' ' 890' ' ' ILE . 0.1 OUTLIER -74.73 -31.31 61.8 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.957 178.036 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -64.68 -49.75 69.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.301 177.901 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 863' ' ' VAL . . . . . 0.489 HG22 HD11 ' A' ' 869' ' ' ILE . 7.9 p -66.99 -31.2 52.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.428 177.638 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 864' ' ' LEU . . . . . 0.669 ' HG ' HD11 ' A' ' 890' ' ' ILE . 0.7 OUTLIER -65.63 -33.86 76.87 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.824 175.683 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 27.2 m -65.9 -37.79 87.04 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.072 0.463 . . . . 0.0 109.861 178.164 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.05 -28.7 68.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.721 174.016 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 7.2 t30 56.12 73.0 0.46 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 114.575 -1.193 . . . . 0.0 111.976 176.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 868' ' ' HIS . . . . . 0.509 ' O ' ' HG3' ' A' ' 826' ' ' MET . 64.7 m-70 -135.14 46.24 2.43 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 174.558 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 869' ' ' ILE . . . . . 0.489 HD11 HG22 ' A' ' 863' ' ' VAL . 2.0 mp -142.2 145.79 23.35 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.132 -0.94 . . . . 0.0 109.835 -177.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -101.43 -52.42 3.24 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.88 0.372 . . . . 0.0 110.426 177.173 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 871' ' ' ILE . . . . . 0.543 ' HB ' HG23 ' A' ' 827' ' ' ILE . 38.4 mm -115.42 129.49 71.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.139 179.029 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 872' ' ' VAL . . . . . 0.764 HG23 HD11 ' A' ' 897' ' ' LEU . 9.7 t -106.53 124.39 62.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 120.728 0.299 . . . . 0.0 110.697 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 873' ' ' LEU . . . . . 0.843 HD11 HD11 ' A' ' 936' ' ' LEU . 52.1 mt -109.96 132.34 54.25 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.141 -0.481 . . . . 0.0 109.719 174.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -120.8 95.2 4.61 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.065 0.459 . . . . 0.0 110.011 178.01 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 875' ' ' ASP . . . . . 0.802 ' HB2' ' HA ' ' A' ' 831' ' ' ASP . 0.9 OUTLIER -88.66 105.63 17.8 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.978 -179.512 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 876' ' ' VAL . . . . . 1.068 ' HB ' ' HB3' ' A' ' 832' ' ' ASP . 2.9 t 50.92 65.56 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.558 0.694 . . . . 0.0 111.519 -179.372 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 877' ' ' ASN . . . . . 0.434 ' HB3' HD22 ' A' ' 886' ' ' LEU . 1.6 t-20 -90.48 33.17 0.91 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.827 176.392 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 4.7 tpp . . . . . 0 C--N 1.325 -0.498 0 CA-C-N 115.162 -0.927 . . . . 0.0 109.473 179.861 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.51 -0.273 0 N-CA-C 111.39 -0.684 . . . . 0.0 111.39 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 6.5 p90 -80.31 -18.84 48.04 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.296 -0.452 . . . . 0.0 110.687 -171.566 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.89 -32.12 73.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.857 0.36 . . . . 0.0 110.344 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 886' ' ' LEU . . . . . 0.434 HD22 ' HB3' ' A' ' 877' ' ' ASN . 0.0 OUTLIER -72.62 -50.73 23.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.15 179.807 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 887' ' ' THR . . . . . 0.631 ' HB ' ' HB3' ' A' ' 916' ' ' GLU . 0.0 OUTLIER -63.28 -40.6 97.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.139 -179.144 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 40.0 tp60 -65.31 -42.77 92.68 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.331 178.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 889' ' ' ARG . . . . . 0.404 ' HG2' HD22 ' A' ' 861' ' ' LEU . 0.7 OUTLIER -64.86 -45.75 84.75 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.992 -178.401 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 890' ' ' ILE . . . . . 0.669 HD11 ' HG ' ' A' ' 864' ' ' LEU . 1.1 tt -69.05 -34.15 62.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.62 0.247 . . . . 0.0 111.017 -177.882 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 891' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.17 -23.07 57.68 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.905 0.383 . . . . 0.0 110.475 178.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 -77.84 -52.21 9.25 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.456 176.326 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.82 -60.53 3.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.852 -175.116 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 171.3 77.99 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.712 0 C-N-CA 120.394 -0.908 . . . . 0.0 112.02 -176.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 895' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -92.27 110.28 21.67 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.023 0.44 . . . . 0.0 110.071 178.843 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -123.25 -26.5 4.29 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.617 178.08 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 897' ' ' LEU . . . . . 0.764 HD11 HG23 ' A' ' 872' ' ' VAL . 2.5 pt? -97.52 151.9 37.89 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.349 -177.35 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -66.91 128.55 18.98 Favored 'Trans proline' 0 C--O 1.239 0.555 0 C-N-CA 122.763 2.309 . . . . 0.0 112.732 -177.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 899' ' ' VAL . . . . . 0.655 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 58.7 t -105.9 109.37 27.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.225 176.748 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 900' ' ' ILE . . . . . 0.427 ' O ' ' HA ' ' A' ' 873' ' ' LEU . 3.6 mp -101.01 114.39 39.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 178.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -112.57 116.47 4.05 Favored Glycine 0 N--CA 1.442 -0.916 0 C-N-CA 120.448 -0.882 . . . . 0.0 112.599 -174.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 902' ' ' VAL . . . . . 0.675 HG22 ' HA ' ' A' ' 875' ' ' ASP . 0.8 OUTLIER -89.55 138.71 18.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 108.76 -0.829 . . . . 0.0 108.76 176.031 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -138.27 160.5 39.3 Favored 'General case' 0 C--N 1.319 -0.739 0 O-C-N 121.957 -0.464 . . . . 0.0 111.686 -176.597 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -85.4 105.85 16.33 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.327 174.319 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 905' ' ' ASN . . . . . 0.403 ' HB3' ' H ' ' A' ' 906' ' ' ALA . 11.8 t-20 62.29 -96.41 0.06 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.778 -174.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 906' ' ' ALA . . . . . 0.494 ' O ' ' HG3' ' A' ' 909' ' ' GLU . . . 53.22 55.61 8.57 Favored 'General case' 0 N--CA 1.462 0.141 0 O-C-N 123.487 0.492 . . . . 0.0 111.05 -179.413 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 907' ' ' LEU . . . . . 0.417 ' O ' ' HB3' ' A' ' 908' ' ' ALA . 2.1 tp -49.31 143.1 6.65 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.394 -179.281 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 908' ' ' ALA . . . . . 0.417 ' HB3' ' O ' ' A' ' 907' ' ' LEU . . . 76.5 39.38 0.26 Allowed 'General case' 0 N--CA 1.465 0.315 0 O-C-N 124.33 1.018 . . . . 0.0 109.685 -173.898 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 909' ' ' GLU . . . . . 0.494 ' HG3' ' O ' ' A' ' 906' ' ' ALA . 1.0 OUTLIER -57.79 -45.41 86.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.951 -178.307 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 910' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.42 -44.17 88.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.586 179.077 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.54 -33.95 76.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.847 -178.469 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.17 -57.9 8.99 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.327 177.396 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.83 -33.46 71.79 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.37 -176.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 77.0 m -76.24 -33.53 59.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.116 179.398 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 4.6 tp -70.8 -47.75 57.85 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.868 0.365 . . . . 0.0 110.63 179.372 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 916' ' ' GLU . . . . . 0.631 ' HB3' ' HB ' ' A' ' 887' ' ' THR . 28.5 mt-10 -69.87 -27.51 64.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.155 -178.225 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.59 35.63 15.18 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.294 178.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -140.77 24.71 2.59 Favored Glycine 0 C--O 1.226 -0.351 0 C-N-CA 120.517 -0.849 . . . . 0.0 112.488 -179.002 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 919' ' ' MET . . . . . 0.655 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -125.29 -119.29 0.27 Allowed 'General case' 0 C--N 1.323 -0.577 0 O-C-N 122.812 -0.228 . . . . 0.0 110.686 -177.233 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 920' ' ' ASP . . . . . 0.543 ' H ' ' HB3' ' A' ' 919' ' ' MET . 20.1 t70 173.29 -68.28 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 123.683 0.793 . . . . 0.0 109.429 174.252 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 25.5 m -128.67 137.73 51.79 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.065 -177.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 922' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -103.42 129.89 50.63 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.54 -179.666 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 923' ' ' LEU . . . . . . . . . . . . . 14.3 mt -126.11 178.0 6.04 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.126 -179.763 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -108.27 148.04 30.57 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 176.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 925' ' ' LYS . . . . . 0.456 ' N ' ' HD2' ' A' ' 926' ' ' PRO . 0.8 OUTLIER -67.16 -48.76 47.69 Favored Pre-proline 0 CA--C 1.533 0.316 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.298 177.881 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 926' ' ' PRO . . . . . 0.456 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 56.2 Cg_endo -71.58 64.88 3.01 Favored 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 121.914 1.743 . . . . 0.0 111.789 172.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -105.9 149.17 9.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.603 -178.801 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.91 153.9 40.8 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.89 179.688 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 929' ' ' LEU . . . . . 0.545 ' CD2' ' HG3' ' A' ' 843' ' ' GLN . 1.1 tm? -59.95 -31.78 70.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.005 -176.898 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -71.26 -26.53 62.93 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.971 -178.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 21.3 t -78.54 -44.98 26.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.839 -0.164 . . . . 0.0 111.314 -178.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 932' ' ' ILE . . . . . 0.465 HG12 HD22 ' A' ' 936' ' ' LEU . 0.0 OUTLIER -60.61 -41.86 89.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 174.775 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -44.72 96.18 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.651 176.402 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 934' ' ' GLN . . . . . 0.549 ' O ' ' HB2' ' A' ' 938' ' ' LEU . 0.7 OUTLIER -58.16 -53.09 62.25 Favored 'General case' 0 C--O 1.222 -0.39 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.05 179.888 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 4.0 m -61.46 -43.23 99.24 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.812 0.339 . . . . 0.0 111.309 -177.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 936' ' ' LEU . . . . . 0.843 HD11 HD11 ' A' ' 873' ' ' LEU . 0.0 OUTLIER -64.55 -51.32 63.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.954 -179.178 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 24.0 m -66.61 -39.38 88.34 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.381 -176.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 938' ' ' LEU . . . . . 0.549 ' HB2' ' O ' ' A' ' 934' ' ' GLN . 0.3 OUTLIER -61.94 -47.46 84.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.813 -179.277 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 939' ' ' TYR . . . . . 0.429 ' O ' HG22 ' A' ' 943' ' ' VAL . 5.1 m-85 -76.68 -32.78 58.14 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.002 -177.253 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -61.85 -49.38 76.48 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.86 0.362 . . . . 0.0 110.564 177.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 941' ' ' GLU . . . . . 0.599 ' O ' ' HB3' ' A' ' 945' ' ' LYS . 7.9 pt-20 -67.08 -30.71 70.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.36 179.29 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 942' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.71 -49.27 54.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.565 -178.443 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 943' ' ' VAL . . . . . 0.429 HG22 ' O ' ' A' ' 939' ' ' TYR . 18.5 m -70.38 -34.13 56.83 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 CA-C-O 121.263 0.554 . . . . 0.0 110.282 -178.653 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.56 -18.62 61.61 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.287 176.457 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 945' ' ' LYS . . . . . 0.599 ' HB3' ' O ' ' A' ' 941' ' ' GLU . 0.0 OUTLIER -85.17 -23.37 28.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.727 179.31 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -74.06 -39.74 63.28 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.971 0.415 . . . . 0.0 110.137 173.683 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 6.8 mtt180 -72.8 -50.01 26.97 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.202 176.006 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 21.6 t0 . . . . . 0 C--N 1.321 -0.655 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.977 -179.975 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.465 0.297 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 94.18 -11.19 70.93 Favored Glycine 0 C--N 1.33 0.238 0 CA-C-N 115.416 -0.811 . . . . 0.0 114.187 166.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 707' ' ' LYS . . . . . 0.413 ' HD2' ' H ' ' A' ' 708' ' ' ARG . 0.1 OUTLIER -81.85 142.16 32.78 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 117.377 0.589 . . . . 0.0 111.196 -176.968 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 708' ' ' ARG . . . . . 0.48 ' HA ' HG23 ' A' ' 732' ' ' VAL . 0.0 OUTLIER -95.18 143.1 26.88 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.164 178.87 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -117.82 119.06 33.73 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 174.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 710' ' ' TRP . . . . . 0.419 ' O ' HD23 ' A' ' 747' ' ' LEU . 77.4 m95 -91.56 115.7 28.26 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 711' ' ' LEU . . . . . 0.444 HD22 HG12 ' A' ' 733' ' ' VAL . 0.7 OUTLIER -119.74 129.72 54.64 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.476 0.655 . . . . 0.0 110.945 -178.576 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -126.43 56.88 1.44 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.019 175.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 713' ' ' VAL . . . . . 0.821 HG13 ' HB3' ' A' ' 750' ' ' ASP . 24.0 t -107.23 118.3 54.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 115.031 -0.986 . . . . 0.0 109.713 179.158 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.46 -3.17 58.5 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.402 0.62 . . . . 0.0 110.005 -179.425 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 715' ' ' ASN . . . . . 0.617 ' HB3' ' HB2' ' A' ' 718' ' ' LEU . 1.8 m-80 -86.74 103.13 14.89 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.507 -0.769 . . . . 0.0 109.553 175.687 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 716' ' ' ALA . . . . . 0.56 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -54.6 -46.78 73.87 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -172.346 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.2 -39.42 93.95 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.141 0.496 . . . . 0.0 110.714 -179.756 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 718' ' ' LEU . . . . . 0.617 ' HB2' ' HB3' ' A' ' 715' ' ' ASN . 0.2 OUTLIER -69.5 -50.06 48.82 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.089 -178.911 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 719' ' ' CYS . . . . . 0.732 ' HB3' ' HB ' ' A' ' 713' ' ' VAL . 31.9 p -67.61 -39.51 84.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.687 -176.411 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 720' ' ' GLN . . . . . 0.433 ' HA ' ' OE1' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -59.59 -43.98 93.51 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.335 178.277 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -59.33 -49.6 77.19 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.831 0.348 . . . . 0.0 110.998 -178.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 722' ' ' LEU . . . . . 0.485 HD23 ' HG3' ' A' ' 792' ' ' PRO . 4.8 mt -65.83 -45.34 82.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.785 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 723' ' ' GLU . . . . . 0.591 ' HG2' ' N ' ' A' ' 724' ' ' THR . 0.0 OUTLIER -57.82 -49.19 77.47 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.822 -177.204 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 724' ' ' THR . . . . . 0.591 ' N ' ' HG2' ' A' ' 723' ' ' GLU . 6.1 m -67.15 -36.77 82.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.304 -174.616 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 27.7 m -69.91 -35.95 74.98 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.02 0.438 . . . . 0.0 111.022 179.544 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 726' ' ' LEU . . . . . 0.58 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 29.4 mt -75.74 -44.16 43.18 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.305 -177.845 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.65 -25.88 65.05 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.888 0.375 . . . . 0.0 110.394 177.649 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 728' ' ' ARG . . . . . 0.582 ' HB2' ' O ' ' A' ' 724' ' ' THR . 0.0 OUTLIER -65.74 -33.57 76.17 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.582 175.57 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 19.0 m -85.4 -56.7 3.39 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.002 -177.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 730' ' ' GLY . . . . . . . . . . . . . . . 155.42 28.2 0.03 OUTLIER Glycine 0 N--CA 1.453 -0.172 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.617 -179.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 731' ' ' ILE . . . . . 0.58 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 11.1 mm -113.66 129.73 68.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 178.549 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 732' ' ' VAL . . . . . 0.48 HG23 ' HA ' ' A' ' 708' ' ' ARG . 3.9 m -85.62 114.83 26.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.445 0.641 . . . . 0.0 110.707 -179.203 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 733' ' ' VAL . . . . . 0.446 HG11 ' HB2' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -78.19 115.22 19.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.661 -177.637 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -121.92 126.37 48.49 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.434 179.705 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.41 127.84 34.14 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.911 177.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -73.59 90.79 1.8 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.303 0.573 . . . . 0.0 110.037 177.641 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -73.53 -73.75 0.2 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.085 176.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -168.74 63.56 0.19 Allowed Glycine 0 N--CA 1.449 -0.494 0 N-CA-C 111.078 -0.809 . . . . 0.0 111.078 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -103.67 155.2 18.75 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.62 0.248 . . . . 0.0 110.632 -175.403 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 740' ' ' GLU . . . . . 0.491 ' CD ' ' H ' ' A' ' 740' ' ' GLU . 1.5 pm0 -71.47 129.58 88.59 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 116.112 -0.494 . . . . 0.0 109.708 177.53 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 741' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -57.64 122.81 12.39 Favored 'Trans proline' 0 C--O 1.233 0.244 0 C-N-CA 122.938 2.425 . . . . 0.0 112.912 -175.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 742' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -93.78 129.23 38.77 Favored Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.146 176.717 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 743' ' ' PRO . . . . . 0.595 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 41.2 Cg_endo -67.22 -5.73 14.48 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 123.087 2.525 . . . . 0.0 113.328 -175.324 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -112.57 4.98 17.63 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.662 0.268 . . . . 0.0 110.62 176.286 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -112.6 157.99 20.53 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.167 0.508 . . . . 0.0 110.849 -175.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 746' ' ' VAL . . . . . 0.54 HG21 HD11 ' A' ' 795' ' ' LEU . 10.2 m -120.57 147.76 24.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.601 -178.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 747' ' ' LEU . . . . . 0.419 HD23 ' O ' ' A' ' 710' ' ' TRP . 0.1 OUTLIER -119.78 107.82 13.65 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.098 178.91 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 6.7 mt -94.66 108.44 20.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 176.202 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 4.8 t -121.36 165.52 15.41 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.655 -0.248 . . . . 0.0 110.63 -176.154 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 750' ' ' ASP . . . . . 0.821 ' HB3' HG13 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -122.93 148.22 45.71 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.032 0.444 . . . . 0.0 111.306 179.357 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 61.2 -119.64 0.77 Allowed 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.064 -177.032 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 752' ' ' VAL . . . . . . . . . . . . . 29.9 t -125.51 93.8 2.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.041 0.448 . . . . 0.0 111.002 -175.542 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 9.8 p -74.74 -21.96 17.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.868 178.162 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 55.42 53.95 9.19 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.108 -179.025 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.25 134.33 32.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.847 -177.622 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -90.25 85.9 6.36 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 175.558 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 77.1 t-105 -68.97 94.47 0.64 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.901 179.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 61.2 mt-30 -82.61 67.59 8.72 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.298 0.57 . . . . 0.0 109.964 176.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 759' ' ' GLY . . . . . 0.595 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -128.91 -136.9 4.22 Favored Glycine 0 N--CA 1.44 -1.071 0 CA-C-N 115.64 -0.709 . . . . 0.0 112.188 -178.44 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 7.5 ttm-85 -86.43 -47.84 8.96 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.818 0.342 . . . . 0.0 110.456 178.1 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 761' ' ' ALA . . . . . 0.402 ' O ' ' HA ' ' A' ' 746' ' ' VAL . . . -164.66 138.42 5.08 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.921 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 2.4 p -113.92 130.53 67.92 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 172.44 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 763' ' ' VAL . . . . . 0.641 HG11 HD21 ' A' ' 791' ' ' LEU . 0.7 OUTLIER -115.65 113.13 42.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-O 120.971 0.415 . . . . 0.0 110.5 -178.032 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 764' ' ' THR . . . . . 0.5 ' HB ' HG12 ' A' ' 782' ' ' VAL . 44.5 m -102.66 112.78 25.71 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.983 -175.509 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 765' ' ' PHE . . . . . 0.683 ' HE1' HG23 ' A' ' 785' ' ' VAL . 6.2 m-85 -88.58 105.72 17.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.818 174.706 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.23 134.02 37.13 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.691 0.281 . . . . 0.0 110.949 -173.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 767' ' ' ARG . . . . . 0.417 ' HA ' ' HD3' ' A' ' 767' ' ' ARG . 0.1 OUTLIER -112.66 -64.52 1.29 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.114 -178.092 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.15 -31.97 3.52 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.783 0.325 . . . . 0.0 111.395 -176.152 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 9.6 t-80 -115.31 133.5 55.97 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.182 0.515 . . . . 0.0 110.779 -177.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 2.0 mt -106.07 158.77 6.28 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.459 176.322 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -175.78 -37.76 0.05 OUTLIER Glycine 0 CA--C 1.507 -0.468 0 N-CA-C 110.806 -0.918 . . . . 0.0 110.806 -178.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 772' ' ' ILE . . . . . . . . . . . . . 1.6 mm -83.8 133.92 45.36 Favored Pre-proline 0 C--N 1.324 -0.52 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 172.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 773' ' ' PRO . . . . . 0.563 ' O ' ' HB3' ' A' ' 774' ' ' LEU . 23.6 Cg_endo -62.41 -92.86 0.0 OUTLIER 'Trans proline' 0 CA--C 1.535 0.531 0 C-N-CA 122.93 2.42 . . . . 0.0 113.75 -175.633 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . 0.665 ' HA ' HG13 ' A' ' 782' ' ' VAL . 1.3 pt? 165.98 -171.8 0.01 OUTLIER 'General case' 0 C--O 1.234 0.268 0 C-N-CA 123.147 0.579 . . . . 0.0 110.218 -174.569 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 775' ' ' GLU . . . . . 0.606 ' HG3' ' HA ' ' A' ' 781' ' ' TRP . 1.5 mp0 -62.07 69.18 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 O-C-N 123.834 0.709 . . . . 0.0 112.036 172.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 18.7 pttt -128.79 7.87 5.7 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 172.489 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 777' ' ' ALA . . . . . 0.433 ' HA ' ' HD3' ' A' ' 778' ' ' PRO . . . -145.07 149.37 41.84 Favored Pre-proline 0 N--CA 1.449 -0.515 0 CA-C-N 114.348 -1.296 . . . . 0.0 109.122 -179.157 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 778' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 777' ' ' ALA . 24.7 Cg_exo -64.16 93.92 0.19 Allowed 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.72 2.28 . . . . 0.0 112.407 -179.452 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 112.15 19.62 7.1 Favored Glycine 0 C--O 1.228 -0.255 0 C-N-CA 120.923 -0.656 . . . . 0.0 113.2 176.794 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 780' ' ' GLU . . . . . 0.522 ' O ' ' HA ' ' A' ' 775' ' ' GLU . 0.1 OUTLIER -119.73 124.88 47.29 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 177.593 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 781' ' ' TRP . . . . . 0.606 ' HA ' ' HG3' ' A' ' 775' ' ' GLU . 17.0 m95 -137.24 136.02 37.73 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 -176.556 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . 0.665 HG13 ' HA ' ' A' ' 774' ' ' LEU . 32.6 m -129.69 155.67 41.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.981 0.419 . . . . 0.0 110.875 176.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 783' ' ' HIS . . . . . 0.537 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.2 OUTLIER -161.18 126.92 3.77 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.931 176.189 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 784' ' ' SER . . . . . 0.404 ' O ' HG13 ' A' ' 785' ' ' VAL . 0.9 OUTLIER -96.67 99.48 11.09 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 120.874 0.369 . . . . 0.0 110.03 177.703 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 785' ' ' VAL . . . . . 0.683 HG23 ' HE1' ' A' ' 765' ' ' PHE . 0.0 OUTLIER -171.24 -170.52 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.225 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -179.747 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -123.67 56.72 1.2 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.733 0.301 . . . . 0.0 110.824 178.111 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 787' ' ' ALA . . . . . 0.463 ' HB2' HD23 ' A' ' 718' ' ' LEU . . . 53.57 63.23 8.31 Favored Pre-proline 0 N--CA 1.467 0.382 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.34 178.717 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 788' ' ' PRO . . . . . 0.615 ' HD2' ' OE1' ' A' ' 790' ' ' GLU . 5.2 Cg_exo -76.01 43.27 1.1 Allowed 'Trans proline' 0 CA--C 1.534 0.498 0 C-N-CA 123.086 2.524 . . . . 0.0 113.292 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 69.71 -0.02 2.82 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 171.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 790' ' ' GLU . . . . . 0.615 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -94.55 -46.08 7.13 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 121.882 -0.511 . . . . 0.0 111.305 -177.447 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 791' ' ' LEU . . . . . 0.641 HD21 HG11 ' A' ' 763' ' ' VAL . 0.2 OUTLIER -58.82 -45.05 99.64 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -179.926 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 792' ' ' PRO . . . . . 0.485 ' HG3' HD23 ' A' ' 722' ' ' LEU . 51.7 Cg_exo -54.17 -31.87 67.7 Favored 'Trans proline' 0 C--N 1.356 0.941 0 C-N-CA 121.717 1.611 . . . . 0.0 111.974 175.917 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -70.44 -44.37 67.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.774 179.006 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 794' ' ' LEU . . . . . 0.552 ' HA ' ' HG2' ' A' ' 797' ' ' ARG . 0.3 OUTLIER -71.55 -28.76 64.09 Favored 'General case' 0 C--O 1.219 -0.51 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.732 179.784 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 795' ' ' LEU . . . . . 0.54 HD11 HG21 ' A' ' 746' ' ' VAL . 0.1 OUTLIER -62.99 -39.42 94.69 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.116 0.484 . . . . 0.0 110.072 177.037 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -62.94 -48.85 77.13 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.262 177.522 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 797' ' ' ARG . . . . . 0.748 ' HA ' HD23 ' A' ' 800' ' ' LEU . 8.8 ptp180 -71.45 -32.99 68.95 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.684 -177.541 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 798' ' ' ILE . . . . . 0.432 ' HB ' ' O ' ' A' ' 794' ' ' LEU . 0.1 OUTLIER -60.95 -34.01 57.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.622 0.249 . . . . 0.0 111.061 175.569 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 799' ' ' TYR . . . . . 0.44 ' HD1' ' HA ' ' A' ' 799' ' ' TYR . 0.5 OUTLIER -83.19 -61.48 1.84 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.658 -0.246 . . . . 0.0 110.424 177.631 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 800' ' ' LEU . . . . . 0.748 HD23 ' HA ' ' A' ' 797' ' ' ARG . 0.2 OUTLIER . . . . . 0 N--CA 1.468 0.436 0 O-C-N 123.666 0.604 . . . . 0.0 112.122 178.661 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 824' ' ' ASP . . . . . 0.4 ' HB3' ' H ' ' A' ' 825' ' ' MET . 19.2 t0 . . . . . 0 CA--C 1.53 0.193 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 825' ' ' MET . . . . . 0.563 ' O ' ' HB2' ' A' ' 850' ' ' GLN . 0.0 OUTLIER -115.76 139.0 50.58 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.915 -175.551 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 826' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -105.39 123.13 47.36 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.041 -176.496 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 827' ' ' ILE . . . . . 0.58 HG23 ' HB ' ' A' ' 871' ' ' ILE . 1.2 mm -119.87 124.28 72.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.699 177.786 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 828' ' ' LEU . . . . . 0.678 HD12 ' HB3' ' A' ' 852' ' ' LYS . 3.1 tp -109.01 123.31 48.92 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.648 0.261 . . . . 0.0 110.699 -178.229 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 829' ' ' VAL . . . . . 0.76 HG12 HD12 ' A' ' 873' ' ' LEU . 27.0 m -105.43 128.36 59.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.822 177.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 830' ' ' VAL . . . . . 0.502 ' HA ' ' O ' ' A' ' 854' ' ' ALA . 0.2 OUTLIER -126.09 87.48 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 116.771 -0.195 . . . . 0.0 111.047 -177.775 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 831' ' ' ASP . . . . . 0.578 ' HA ' ' O ' ' A' ' 875' ' ' ASP . 9.9 t70 -107.67 137.97 44.73 Favored 'General case' 0 CA--C 1.515 -0.397 0 C-N-CA 120.631 -0.428 . . . . 0.0 110.388 -178.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.38 -31.2 72.29 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.125 -178.307 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 833' ' ' HIS . . . . . 0.434 ' HA ' ' HD3' ' A' ' 834' ' ' PRO . 0.2 OUTLIER -108.81 128.77 24.9 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-O 120.781 0.324 . . . . 0.0 111.697 -173.549 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 834' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 833' ' ' HIS . 67.6 Cg_exo -53.81 -45.26 42.3 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 123.51 2.807 . . . . 0.0 113.584 -178.711 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 835' ' ' ILE . . . . . 0.445 ' HA ' ' HD2' ' A' ' 838' ' ' ARG . 1.1 pt -65.35 -37.17 79.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 121.074 0.464 . . . . 0.0 110.778 -179.29 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 836' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -72.06 -45.47 60.61 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.692 179.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 837' ' ' ARG . . . . . . . . . . . . . 19.2 ttp180 -53.73 -47.73 70.32 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.377 -0.828 . . . . 0.0 111.07 177.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 838' ' ' ARG . . . . . 0.445 ' HD2' ' HA ' ' A' ' 835' ' ' ILE . 0.0 OUTLIER -66.01 -29.6 70.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.806 -179.827 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.92 -51.4 62.06 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.727 179.475 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 840' ' ' LEU . . . . . 0.496 ' H ' ' HG ' ' A' ' 840' ' ' LEU . 0.0 OUTLIER -72.32 -29.6 63.99 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.673 0.273 . . . . 0.0 110.873 -179.859 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -66.65 -31.14 71.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.045 0.45 . . . . 0.0 110.442 176.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -68.5 -44.16 75.29 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.806 175.05 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 843' ' ' GLN . . . . . 0.622 ' HG3' HD23 ' A' ' 929' ' ' LEU . 0.0 OUTLIER -60.39 -52.42 65.32 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.861 178.929 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 844' ' ' LEU . . . . . 0.526 ' HG ' HD23 ' A' ' 847' ' ' LEU . 0.2 OUTLIER -61.63 -31.62 71.72 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.91 177.555 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -65.36 -33.63 87.17 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 121.122 -0.561 . . . . 0.0 112.364 177.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.29 -22.85 51.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.963 0.411 . . . . 0.0 110.291 175.721 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 847' ' ' LEU . . . . . 0.526 HD23 ' HG ' ' A' ' 844' ' ' LEU . 1.0 OUTLIER -72.98 -44.33 61.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.06 177.478 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 100.19 25.48 8.88 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.54 -0.838 . . . . 0.0 113.912 172.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 6.0 m-30 -103.68 169.12 8.71 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 117.254 0.527 . . . . 0.0 109.865 176.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 850' ' ' GLN . . . . . 0.563 ' HB2' ' O ' ' A' ' 825' ' ' MET . 2.2 mt-30 -69.1 111.33 5.0 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 110.368 -0.234 . . . . 0.0 110.368 -178.577 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -98.63 112.94 24.84 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.055 0.455 . . . . 0.0 111.409 -175.092 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 852' ' ' LYS . . . . . 0.678 ' HB3' HD12 ' A' ' 828' ' ' LEU . 0.2 OUTLIER -101.56 110.48 22.48 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 173.851 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.26 117.6 29.78 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.666 -175.868 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 854' ' ' ALA . . . . . 0.502 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -136.83 162.28 33.65 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.626 178.796 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 26.7 p-10 -153.01 75.53 1.09 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.095 0.474 . . . . 0.0 111.689 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 856' ' ' ASP . . . . . . . . . . . . . 27.9 t70 173.1 150.94 0.07 Allowed 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.176 176.159 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -72.33 -47.85 27.28 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 121.183 -0.532 . . . . 0.0 112.656 -179.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -73.16 -34.14 43.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.027 0.442 . . . . 0.0 110.232 -177.099 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -61.49 -35.14 76.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.793 176.005 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 860' ' ' ALA . . . . . 0.427 ' O ' HG12 ' A' ' 863' ' ' VAL . . . -66.28 -39.5 89.43 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.681 177.573 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 861' ' ' LEU . . . . . 0.625 HD11 ' HB3' ' A' ' 889' ' ' ARG . 1.9 mt -67.17 -40.92 86.66 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.156 0.503 . . . . 0.0 110.337 177.348 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -63.0 -45.72 91.06 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.522 178.692 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 863' ' ' VAL . . . . . 0.427 HG12 ' O ' ' A' ' 860' ' ' ALA . 0.3 OUTLIER -66.36 -31.99 56.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.918 179.913 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 864' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.6 -35.75 80.55 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.913 0.387 . . . . 0.0 110.084 175.851 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 2.2 m -74.4 -37.97 63.24 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.438 178.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -65.03 -54.03 36.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.164 -179.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -144.17 143.19 30.98 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.505 -179.416 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -73.5 140.56 46.48 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.962 -179.742 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 869' ' ' ILE . . . . . . . . . . . . . 1.9 mp -120.55 134.05 65.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.023 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -74.88 -55.46 5.78 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.039 0.447 . . . . 0.0 110.617 -177.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 871' ' ' ILE . . . . . 0.58 ' HB ' HG23 ' A' ' 827' ' ' ILE . 28.4 mm -117.2 120.83 66.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.157 -177.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 872' ' ' VAL . . . . . 0.532 HG21 HD12 ' A' ' 897' ' ' LEU . 0.0 OUTLIER -105.82 125.56 61.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.821 -178.055 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 873' ' ' LEU . . . . . 0.76 HD12 HG12 ' A' ' 829' ' ' VAL . 26.5 mt -110.95 108.77 18.64 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 177.01 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 2.1 m -94.39 96.72 9.71 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 177.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 875' ' ' ASP . . . . . 0.578 ' O ' ' HA ' ' A' ' 831' ' ' ASP . 3.1 m-20 -93.03 104.41 16.63 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.822 0.82 . . . . 0.0 110.78 -173.762 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 876' ' ' VAL . . . . . 0.635 ' HB ' HG23 ' A' ' 903' ' ' THR . 0.2 OUTLIER -104.65 89.07 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.752 -178.244 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -68.54 -43.45 76.67 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 174.683 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 10.6 ptm . . . . . 0 N--CA 1.452 -0.346 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.496 173.022 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.866 0 N-CA-C 111.951 -0.46 . . . . 0.0 111.951 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -149.17 -36.99 0.17 Allowed 'General case' 0 C--O 1.235 0.312 0 CA-C-O 120.47 0.176 . . . . 0.0 111.462 -179.727 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -68.44 -46.24 70.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.495 -176.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -55.89 -49.78 72.48 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.394 177.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.1 -45.35 87.36 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.437 -177.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -64.67 -49.99 68.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.929 179.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 889' ' ' ARG . . . . . 0.625 ' HB3' HD11 ' A' ' 861' ' ' LEU . 0.0 OUTLIER -64.15 -41.16 97.29 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.853 -174.659 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 890' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -68.5 -40.41 82.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 111.511 0.189 . . . . 0.0 111.511 -176.646 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 891' ' ' ARG . . . . . 0.428 ' HB3' ' HA2' ' A' ' 918' ' ' GLY . 0.4 OUTLIER -75.31 -24.38 57.44 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.068 0.461 . . . . 0.0 110.425 178.988 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -73.36 -54.79 7.48 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.795 178.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 893' ' ' LEU . . . . . 0.454 HD13 ' HA ' ' A' ' 893' ' ' LEU . 1.8 mm? -67.2 -50.85 59.37 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.306 -174.489 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 166.46 82.96 0.05 OUTLIER Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 119.775 -1.202 . . . . 0.0 112.887 -178.223 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 895' ' ' LEU . . . . . . . . . . . . . 4.6 tp -89.93 109.33 20.36 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 175.462 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.16 6.26 5.9 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.054 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 897' ' ' LEU . . . . . 0.532 HD12 HG21 ' A' ' 872' ' ' VAL . 0.0 OUTLIER -123.81 141.22 36.22 Favored Pre-proline 0 C--N 1.325 -0.461 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 179.89 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -61.8 114.67 2.38 Favored 'Trans proline' 0 C--O 1.236 0.422 0 C-N-CA 122.799 2.333 . . . . 0.0 112.847 -176.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 899' ' ' VAL . . . . . 0.665 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 27.1 t -98.64 113.4 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-O 121.361 0.601 . . . . 0.0 110.257 177.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 900' ' ' ILE . . . . . 0.422 HG13 ' OG ' ' A' ' 921' ' ' SER . 1.7 mp -85.63 112.5 22.45 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.688 176.648 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -89.87 104.33 3.11 Favored Glycine 0 N--CA 1.443 -0.878 0 C-N-CA 120.595 -0.812 . . . . 0.0 111.464 177.486 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 902' ' ' VAL . . . . . 0.813 HG22 ' HE2' ' A' ' 925' ' ' LYS . 0.2 OUTLIER -110.59 103.34 15.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.632 0.729 . . . . 0.0 109.663 179.537 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 903' ' ' THR . . . . . 0.635 HG23 ' HB ' ' A' ' 876' ' ' VAL . 0.2 OUTLIER -108.64 149.13 29.37 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.356 -174.44 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -94.76 135.87 35.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.668 175.336 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 61.28 -156.77 0.34 Allowed 'General case' 0 C--N 1.33 -0.268 0 O-C-N 123.676 0.61 . . . . 0.0 110.247 -176.328 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . 68.92 -71.84 0.11 Allowed 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.39 0.676 . . . . 0.0 111.959 176.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 97.6 mt 68.92 176.33 0.27 Allowed 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 123.203 0.601 . . . . 0.0 111.069 -179.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . 65.49 30.36 10.78 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.518 0.675 . . . . 0.0 109.759 -173.189 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -67.65 -18.02 64.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.842 -1.072 . . . . 0.0 111.546 -174.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 910' ' ' GLU . . . . . 0.441 ' HA ' ' SG ' ' A' ' 922' ' ' CYS . 0.4 OUTLIER -66.13 -42.02 89.69 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.956 0.408 . . . . 0.0 109.963 176.431 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 911' ' ' LYS . . . . . 0.418 ' HE2' HD12 ' A' ' 915' ' ' LEU . 0.0 OUTLIER -73.3 -34.05 65.53 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.043 178.902 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -66.1 -43.33 87.57 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.859 178.365 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 913' ' ' ARG . . . . . 0.465 ' HA ' ' SD ' ' A' ' 919' ' ' MET . 0.0 OUTLIER -63.12 -35.67 81.05 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.71 179.649 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 82.6 m -71.8 -37.23 70.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.902 0.382 . . . . 0.0 110.349 176.588 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 915' ' ' LEU . . . . . 0.418 HD12 ' HE2' ' A' ' 911' ' ' LYS . 0.2 OUTLIER -62.53 -51.76 66.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.168 -179.252 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -77.5 -33.0 54.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.299 -177.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.21 48.84 22.29 Favored 'General case' 0 N--CA 1.464 0.266 0 O-C-N 123.675 0.61 . . . . 0.0 111.433 -177.402 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 918' ' ' GLY . . . . . 0.428 ' HA2' ' HB3' ' A' ' 891' ' ' ARG . . . -140.15 25.02 2.66 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.295 -178.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 919' ' ' MET . . . . . 0.665 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -129.72 -111.66 0.26 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.623 0.249 . . . . 0.0 110.757 -177.473 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 920' ' ' ASP . . . . . . . . . . . . . 10.8 t70 169.33 -60.13 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 123.986 0.914 . . . . 0.0 109.034 177.375 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . 0.422 ' OG ' HG13 ' A' ' 900' ' ' ILE . 0.0 OUTLIER -123.17 170.08 10.6 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.808 178.363 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 922' ' ' CYS . . . . . 0.441 ' SG ' ' HA ' ' A' ' 910' ' ' GLU . 0.8 OUTLIER -144.64 130.39 19.15 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.7 0.286 . . . . 0.0 110.804 -179.34 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 923' ' ' LEU . . . . . 0.544 ' O ' ' HA ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -139.04 165.62 26.67 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 177.327 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -87.43 147.9 25.22 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.004 177.804 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 925' ' ' LYS . . . . . 0.813 ' HE2' HG22 ' A' ' 902' ' ' VAL . 0.0 OUTLIER -47.56 -38.81 18.1 Favored Pre-proline 0 CA--C 1.539 0.545 0 N-CA-C 114.02 1.118 . . . . 0.0 114.02 -179.008 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -58.66 77.28 0.04 OUTLIER 'Trans proline' 0 C--N 1.358 1.066 0 C-N-CA 122.039 1.826 . . . . 0.0 112.777 170.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 88.9 t -107.76 97.05 5.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.872 178.202 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 928' ' ' THR . . . . . 0.405 ' O ' HG22 ' A' ' 932' ' ' ILE . 0.2 OUTLIER -71.87 170.26 14.07 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.436 -179.674 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 929' ' ' LEU . . . . . 0.622 HD23 ' HG3' ' A' ' 843' ' ' GLN . 0.7 OUTLIER -52.29 -45.84 65.65 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.139 -0.482 . . . . 0.0 112.06 -177.314 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 930' ' ' ASP . . . . . 0.463 ' HA ' ' HE3' ' A' ' 933' ' ' LYS . 0.5 OUTLIER -69.89 -33.6 72.43 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.764 -0.375 . . . . 0.0 110.437 -177.738 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 43.1 t -66.48 -52.12 49.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.768 -179.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 932' ' ' ILE . . . . . 0.498 HD11 HD12 ' A' ' 844' ' ' LEU . 3.8 tt -65.15 -36.4 77.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.92 0.391 . . . . 0.0 110.582 -179.023 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 933' ' ' LYS . . . . . 0.463 ' HE3' ' HA ' ' A' ' 930' ' ' ASP . 0.3 OUTLIER -68.2 -47.6 67.46 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.139 -179.398 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 934' ' ' GLN . . . . . 0.53 ' HG3' ' N ' ' A' ' 935' ' ' THR . 0.4 OUTLIER -68.34 -36.52 79.37 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.694 -0.23 . . . . 0.0 111.231 -177.551 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 935' ' ' THR . . . . . 0.53 ' N ' ' HG3' ' A' ' 934' ' ' GLN . 22.9 m -67.34 -43.89 80.45 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.896 0.379 . . . . 0.0 110.531 178.534 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 936' ' ' LEU . . . . . 0.501 HD13 ' HA ' ' A' ' 936' ' ' LEU . 0.2 OUTLIER -63.5 -47.5 81.45 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.639 179.073 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 34.2 m -62.92 -42.12 99.69 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.004 -179.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 938' ' ' LEU . . . . . 0.466 ' HB2' ' O ' ' A' ' 934' ' ' GLN . 0.6 OUTLIER -60.39 -45.24 94.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.022 179.505 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -78.63 -27.33 45.38 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.699 -175.295 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -64.3 -43.61 94.18 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.382 0.611 . . . . 0.0 110.089 174.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 941' ' ' GLU . . . . . 0.418 ' HG3' ' N ' ' A' ' 942' ' ' ARG . 0.0 OUTLIER -73.63 -29.67 62.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.109 177.152 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 942' ' ' ARG . . . . . 0.439 HH11 ' HD3' ' A' ' 942' ' ' ARG . 0.2 OUTLIER -65.9 -47.09 75.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.137 179.973 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 27.5 m -68.17 -29.83 45.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.893 0.378 . . . . 0.0 110.439 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.4 -31.39 71.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.583 174.453 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 20.4 mmtm -70.06 -36.37 74.93 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.071 178.657 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.96 -45.12 12.49 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.409 -176.223 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 947' ' ' ARG . . . . . 0.41 ' HE ' ' HB3' ' A' ' 947' ' ' ARG . 0.1 OUTLIER -73.88 -52.59 12.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.28 -177.893 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 3.0 t70 . . . . . 0 C--N 1.326 -0.425 0 CA-C-O 120.71 0.291 . . . . 0.0 110.842 -175.795 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 705' ' ' SER . . . . . 0.755 ' HA ' ' O ' ' A' ' 730' ' ' GLY . 0.9 OUTLIER . . . . . 0 N--CA 1.45 -0.447 0 CA-C-O 121.309 0.576 . . . . 0.0 110.619 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 154.71 -19.77 0.59 Allowed Glycine 0 N--CA 1.448 -0.513 0 N-CA-C 111.033 -0.827 . . . . 0.0 111.033 -175.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 4.1 mmtt -77.48 130.99 37.72 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 174.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 708' ' ' ARG . . . . . 0.448 ' HA ' HG13 ' A' ' 732' ' ' VAL . 5.9 mtm-85 -95.64 139.55 31.73 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.235 0.54 . . . . 0.0 111.86 -171.06 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -122.39 116.58 24.26 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.612 174.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 710' ' ' TRP . . . . . 0.694 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 93.0 m95 -99.65 118.55 36.43 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.721 0.295 . . . . 0.0 110.298 -177.296 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 711' ' ' LEU . . . . . 0.525 HD23 ' C ' ' A' ' 710' ' ' TRP . 5.2 mt -111.25 118.15 35.13 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.836 0.351 . . . . 0.0 111.424 -176.038 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 712' ' ' ALA . . . . . 0.56 ' HB3' ' HB ' ' A' ' 749' ' ' THR . . . -108.08 44.53 1.1 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.573 0.701 . . . . 0.0 109.382 174.769 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 713' ' ' VAL . . . . . 0.843 HG13 ' HB3' ' A' ' 750' ' ' ASP . 16.3 t -100.29 124.84 54.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.583 -177.655 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 714' ' ' ARG . . . . . 0.409 HH11 ' HD3' ' A' ' 714' ' ' ARG . 2.1 mtp180 -88.73 -21.02 24.07 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 177.645 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 715' ' ' ASN . . . . . 0.414 ' HB3' ' HB2' ' A' ' 718' ' ' LEU . 3.7 m-80 -71.39 102.4 2.62 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.876 174.665 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 716' ' ' ALA . . . . . 0.549 ' O ' ' HB2' ' A' ' 720' ' ' GLN . . . -59.95 -35.93 75.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.333 -177.21 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.44 -46.35 88.92 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.134 0.492 . . . . 0.0 110.549 178.615 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 718' ' ' LEU . . . . . 0.576 ' HB3' HG11 ' A' ' 713' ' ' VAL . 0.3 OUTLIER -69.38 -48.98 59.52 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.84 -179.76 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 719' ' ' CYS . . . . . 0.656 ' HB2' ' HB ' ' A' ' 713' ' ' VAL . 12.2 t -60.92 -51.77 67.85 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.702 -177.354 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 720' ' ' GLN . . . . . 0.783 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 1.2 mt-30 -63.03 -36.28 83.05 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.767 -176.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -59.48 -52.89 63.63 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.169 0.509 . . . . 0.0 110.4 179.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 48.9 mt -66.9 -48.25 69.3 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.316 -178.034 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 723' ' ' GLU . . . . . 0.783 ' HG2' ' HA ' ' A' ' 720' ' ' GLN . 1.4 pt-20 -60.94 -44.76 96.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.825 -173.684 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 724' ' ' THR . . . . . 0.618 ' N ' ' HG3' ' A' ' 723' ' ' GLU . 16.0 m -64.75 -43.3 93.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.79 0.329 . . . . 0.0 110.775 -179.394 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 18.5 m -63.73 -40.16 96.05 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.342 179.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 726' ' ' LEU . . . . . 0.462 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 11.0 mt -71.95 -37.96 69.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.842 0.354 . . . . 0.0 111.211 -179.041 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -66.17 -15.25 62.98 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.862 0.363 . . . . 0.0 111.319 179.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.44 -16.12 60.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.096 0.474 . . . . 0.0 110.612 176.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -104.39 -1.08 27.34 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.157 0.503 . . . . 0.0 110.783 177.435 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 730' ' ' GLY . . . . . 0.755 ' O ' ' HA ' ' A' ' 705' ' ' SER . . . 98.13 -0.63 58.88 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.52 179.23 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 731' ' ' ILE . . . . . 0.462 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 36.6 mm -66.22 120.05 12.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 120.683 0.278 . . . . 0.0 110.402 -178.539 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 732' ' ' VAL . . . . . 0.448 HG13 ' HA ' ' A' ' 708' ' ' ARG . 1.5 p -78.22 98.14 2.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 122.028 0.918 . . . . 0.0 110.06 -179.384 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 733' ' ' VAL . . . . . 0.55 HG21 ' HA ' ' A' ' 723' ' ' GLU . 82.8 t -81.96 119.95 32.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 114.915 -1.039 . . . . 0.0 110.601 179.746 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.33 125.46 44.39 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.945 177.603 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -59.74 114.42 2.76 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.646 177.334 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 736' ' ' TYR . . . . . 0.694 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 65.1 t80 -72.19 95.31 1.65 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.96 -179.871 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 737' ' ' GLU . . . . . 0.519 ' H ' ' HG3' ' A' ' 737' ' ' GLU . 0.0 OUTLIER -92.86 -52.83 4.42 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.139 0.495 . . . . 0.0 109.912 176.82 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -165.62 68.53 0.2 Allowed Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 111.083 -0.807 . . . . 0.0 111.083 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 15.7 mp0 -117.12 179.71 3.95 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.778 0.323 . . . . 0.0 110.581 -175.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -98.91 142.99 25.56 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.479 -179.123 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 741' ' ' PRO . . . . . 0.581 ' HB2' ' O ' ' A' ' 758' ' ' GLN . 71.8 Cg_endo -79.27 147.5 20.55 Favored 'Trans proline' 0 CA--C 1.532 0.414 0 C-N-CA 122.865 2.377 . . . . 0.0 113.446 -177.911 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 742' ' ' THR . . . . . 0.76 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.1 OUTLIER -132.61 144.24 52.11 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.597 179.122 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 743' ' ' PRO . . . . . 0.835 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 28.7 Cg_endo -62.5 -12.6 28.69 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 123.573 2.849 . . . . 0.0 113.777 -175.13 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 31.8 tp10 -98.08 -9.99 25.02 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.061 0.457 . . . . 0.0 110.792 179.39 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 745' ' ' ASP . . . . . 0.405 ' HB3' ' HD1' ' A' ' 710' ' ' TRP . 74.6 m-20 -106.65 158.47 16.93 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.321 -167.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 746' ' ' VAL . . . . . 0.511 HG11 HD11 ' A' ' 795' ' ' LEU . 6.4 p -126.64 138.56 54.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.731 -179.053 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 747' ' ' LEU . . . . . 0.49 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 0.0 OUTLIER -103.79 103.35 13.22 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.916 177.167 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 27.5 mt -94.93 107.64 19.75 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 175.377 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 749' ' ' THR . . . . . 0.56 ' HB ' ' HB3' ' A' ' 712' ' ' ALA . 1.9 t -119.92 148.19 43.81 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.611 -174.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 750' ' ' ASP . . . . . 0.843 ' HB3' HG13 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -109.54 126.32 53.44 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 176.421 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 751' ' ' GLU . . . . . 0.491 ' HB2' ' O ' ' A' ' 750' ' ' ASP . 3.6 mm-40 74.5 173.93 0.27 Allowed 'General case' 0 C--O 1.235 0.325 0 CA-C-N 114.684 -1.143 . . . . 0.0 110.372 -170.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 752' ' ' VAL . . . . . 0.837 HG13 HG13 ' A' ' 772' ' ' ILE . 27.7 t -81.31 102.82 7.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.243 -176.208 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 753' ' ' VAL . . . . . 0.626 HG13 ' HB2' ' A' ' 755' ' ' LYS . 7.1 p -80.7 -1.21 4.67 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.09 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 40.7 m 58.88 40.3 22.86 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.404 178.618 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 755' ' ' LYS . . . . . 0.626 ' HB2' HG13 ' A' ' 753' ' ' VAL . 0.0 OUTLIER -130.14 153.87 48.08 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.579 178.28 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 756' ' ' LYS . . . . . 0.542 ' O ' ' HD2' ' A' ' 756' ' ' LYS . 0.0 OUTLIER -95.78 -49.26 5.42 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 123.071 0.232 . . . . 0.0 111.136 -178.079 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 757' ' ' TRP . . . . . 0.49 ' CD2' ' HB2' ' A' ' 747' ' ' LEU . 71.4 t-105 76.88 139.47 0.07 Allowed 'General case' 0 N--CA 1.467 0.402 0 O-C-N 123.88 0.737 . . . . 0.0 110.634 179.486 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 758' ' ' GLN . . . . . 0.581 ' O ' ' HB2' ' A' ' 741' ' ' PRO . 0.0 OUTLIER -128.37 105.02 8.05 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.81 178.341 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 759' ' ' GLY . . . . . 0.835 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -178.03 -140.77 3.93 Favored Glycine 0 N--CA 1.44 -1.085 0 C-N-CA 119.733 -1.222 . . . . 0.0 112.824 -178.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 760' ' ' ARG . . . . . 0.407 ' HD2' HH11 ' A' ' 760' ' ' ARG . 7.2 ttm105 -67.19 -52.76 37.36 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.927 0.394 . . . . 0.0 110.086 -179.219 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -170.44 165.32 8.63 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.53 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 2.2 p -131.66 120.52 45.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.845 174.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 57.9 t -104.92 104.03 16.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 116.165 -0.471 . . . . 0.0 109.929 -178.436 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 764' ' ' THR . . . . . 0.547 HG21 HD12 ' A' ' 772' ' ' ILE . 38.5 m -103.18 117.5 34.67 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.415 -177.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 765' ' ' PHE . . . . . 0.633 ' HZ ' ' HG ' ' A' ' 791' ' ' LEU . 75.9 m-85 -81.84 133.3 35.31 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.046 176.477 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -95.93 136.43 36.38 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 -179.032 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 767' ' ' ARG . . . . . 0.466 ' HB3' ' HD2' ' A' ' 768' ' ' ARG . 0.0 OUTLIER -136.92 -73.04 0.43 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.722 0.296 . . . . 0.0 110.953 -178.253 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 768' ' ' ARG . . . . . 0.466 ' HD2' ' HB3' ' A' ' 767' ' ' ARG . 0.0 OUTLIER -112.25 -35.28 5.66 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.028 -176.396 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 74.3 m80 -100.33 136.94 39.45 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.308 -178.298 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 2.6 mt -129.92 127.74 64.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.955 -179.199 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . 148.72 26.1 0.07 OUTLIER Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.317 -0.944 . . . . 0.0 112.972 179.293 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 772' ' ' ILE . . . . . 0.837 HG13 HG13 ' A' ' 752' ' ' VAL . 0.0 OUTLIER -104.56 146.49 32.72 Favored Pre-proline 0 C--N 1.324 -0.5 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 176.912 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 773' ' ' PRO . . . . . 0.499 ' HD2' HG12 ' A' ' 772' ' ' ILE . 26.4 Cg_endo -61.73 125.76 17.42 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.615 2.21 . . . . 0.0 112.82 -178.398 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . 0.588 ' HA ' HG13 ' A' ' 782' ' ' VAL . 0.4 OUTLIER -98.13 -162.14 0.93 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.893 176.666 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 775' ' ' GLU . . . . . 0.591 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 2.4 mp0 -67.62 59.6 0.06 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 122.099 0.952 . . . . 0.0 112.691 177.903 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 14.5 ptpt -128.19 10.9 6.39 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 167.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 777' ' ' ALA . . . . . 0.728 ' HB1' ' HD2' ' A' ' 778' ' ' PRO . . . -133.79 164.63 42.61 Favored Pre-proline 0 N--CA 1.446 -0.645 0 CA-C-N 113.741 -1.572 . . . . 0.0 108.692 178.485 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 778' ' ' PRO . . . . . 0.728 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 14.2 Cg_endo -55.44 -24.35 43.22 Favored 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 123.591 2.861 . . . . 0.0 115.64 -169.756 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . -158.49 27.62 0.42 Allowed Glycine 0 CA--C 1.507 -0.407 0 C-N-CA 119.804 -1.189 . . . . 0.0 112.316 -174.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 780' ' ' GLU . . . . . 0.591 ' O ' ' HG3' ' A' ' 775' ' ' GLU . 13.8 mp0 -103.67 129.13 50.95 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -175.384 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 14.3 m95 -133.01 140.6 47.83 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 -177.561 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . 0.588 HG13 ' HA ' ' A' ' 774' ' ' LEU . 4.4 m -135.7 148.71 28.03 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.319 0 CA-C-O 120.53 0.205 . . . . 0.0 110.637 174.008 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 783' ' ' HIS . . . . . 0.564 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.1 OUTLIER -169.98 148.72 3.5 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.793 0.33 . . . . 0.0 110.978 177.771 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 784' ' ' SER . . . . . 0.414 ' HB3' ' NH1' ' A' ' 767' ' ' ARG . 0.9 OUTLIER -105.48 102.32 11.8 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.078 175.94 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 785' ' ' VAL . . . . . 0.868 HG13 ' H ' ' A' ' 787' ' ' ALA . 1.4 p -171.03 160.02 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 -179.627 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -94.63 25.01 4.22 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.787 0.327 . . . . 0.0 111.289 -178.574 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 787' ' ' ALA . . . . . 0.868 ' H ' HG13 ' A' ' 785' ' ' VAL . . . 52.43 64.47 7.41 Favored Pre-proline 0 CA--C 1.535 0.378 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.972 -179.491 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 788' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -65.43 -50.68 1.78 Allowed 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.55 2.166 . . . . 0.0 111.947 -178.113 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -161.98 -30.84 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.06 -179.685 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 790' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.57 -45.17 95.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.914 -0.584 . . . . 0.0 112.14 -178.183 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 791' ' ' LEU . . . . . 0.633 ' HG ' ' HZ ' ' A' ' 765' ' ' PHE . 0.3 OUTLIER -66.41 -53.66 29.2 Favored Pre-proline 0 CA--C 1.534 0.363 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -177.469 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 792' ' ' PRO . . . . . 0.415 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 9.7 Cg_endo -56.97 -34.58 97.76 Favored 'Trans proline' 0 C--N 1.357 0.98 0 C-N-CA 121.441 1.427 . . . . 0.0 112.17 176.187 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -64.05 -44.79 91.39 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.76 0.314 . . . . 0.0 110.624 176.408 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 794' ' ' LEU . . . . . 0.635 ' HA ' ' HD3' ' A' ' 797' ' ' ARG . 1.3 tm? -58.97 -49.13 79.05 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.16 178.678 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 795' ' ' LEU . . . . . 0.511 HD11 HG11 ' A' ' 746' ' ' VAL . 2.5 mm? -65.42 -41.24 93.76 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.336 -176.655 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -60.12 -50.36 74.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.286 -179.521 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 797' ' ' ARG . . . . . 0.635 ' HD3' ' HA ' ' A' ' 794' ' ' LEU . 0.0 OUTLIER -71.82 -25.4 61.97 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.583 -177.423 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -73.93 -23.73 19.1 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 CA-C-O 120.942 0.401 . . . . 0.0 111.29 178.436 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -80.26 -19.3 47.1 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.787 177.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 5.3 mt . . . . . 0 C--O 1.234 0.265 0 O-C-N 124.291 0.995 . . . . 0.0 112.011 177.955 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 824' ' ' ASP . . . . . 0.467 ' HB3' ' H ' ' A' ' 825' ' ' MET . 13.9 t0 . . . . . 0 C--O 1.231 0.129 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 825' ' ' MET . . . . . 0.467 ' H ' ' HB3' ' A' ' 824' ' ' ASP . 35.9 ttm -96.32 137.62 35.13 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.715 -175.863 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 826' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.66 120.23 37.38 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.886 -177.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 827' ' ' ILE . . . . . 0.71 HD12 ' HB ' ' A' ' 871' ' ' ILE . 13.0 mm -107.59 125.21 63.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.5 176.213 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 828' ' ' LEU . . . . . 0.407 ' HB3' HG21 ' A' ' 869' ' ' ILE . 6.7 tp -98.66 130.11 45.16 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.883 0.373 . . . . 0.0 110.613 -177.529 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 829' ' ' VAL . . . . . 0.549 HG21 HD12 ' A' ' 840' ' ' LEU . 0.2 OUTLIER -118.92 117.08 53.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.852 179.117 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 830' ' ' VAL . . . . . 0.434 HG13 ' HB3' ' A' ' 854' ' ' ALA . 0.0 OUTLIER -112.54 99.36 8.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 115.617 -0.719 . . . . 0.0 109.521 178.021 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 831' ' ' ASP . . . . . 0.665 ' HA ' ' O ' ' A' ' 875' ' ' ASP . 0.2 OUTLIER -117.29 146.98 42.97 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.834 0.349 . . . . 0.0 110.385 -178.609 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -91.75 -14.29 30.18 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.272 -172.449 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 2.5 m80 -124.98 98.42 36.35 Favored Pre-proline 0 C--N 1.327 -0.408 0 C-N-CA 120.881 -0.328 . . . . 0.0 111.346 -176.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 834' ' ' PRO . . . . . 0.632 ' HA ' ' HD3' ' A' ' 837' ' ' ARG . 15.1 Cg_exo -31.37 -41.98 0.11 Allowed 'Trans proline' 0 C--N 1.352 0.744 1 C-N-CA 125.899 4.399 . . . . 0.0 117.0 -169.29 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -58.94 -35.38 56.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.824 0.345 . . . . 0.0 111.569 -177.469 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 836' ' ' ASN . . . . . 0.595 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 62.1 m-80 -72.32 -38.84 68.57 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 -179.002 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 837' ' ' ARG . . . . . 0.651 ' HG3' ' HB3' ' A' ' 831' ' ' ASP . 0.0 OUTLIER -51.72 -45.33 63.56 Favored 'General case' 0 C--O 1.224 -0.263 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.112 177.002 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 838' ' ' ARG . . . . . 0.489 ' HD3' ' N ' ' A' ' 839' ' ' LEU . 0.0 OUTLIER -59.09 -50.39 74.26 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.248 176.843 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 839' ' ' LEU . . . . . 0.489 ' N ' ' HD3' ' A' ' 838' ' ' ARG . 0.1 OUTLIER -62.99 -52.87 61.32 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.706 -0.679 . . . . 0.0 112.551 -170.045 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 840' ' ' LEU . . . . . 0.595 ' HG ' ' O ' ' A' ' 836' ' ' ASN . 0.0 OUTLIER -72.24 -33.11 67.28 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 120.293 -0.563 . . . . 0.0 110.964 -176.703 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -67.54 -39.3 85.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.933 0.397 . . . . 0.0 110.37 179.412 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.97 -41.18 97.63 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.089 177.396 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 843' ' ' GLN . . . . . 0.819 ' HG2' HD23 ' A' ' 929' ' ' LEU . 11.4 mt-30 -58.62 -48.05 82.3 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.214 175.672 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 844' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.81 -34.69 73.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.751 -0.658 . . . . 0.0 111.038 177.495 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -65.2 -40.2 96.6 Favored Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.89 -0.596 . . . . 0.0 112.411 178.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.81 -25.02 64.46 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.884 0.373 . . . . 0.0 110.574 178.416 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.18 -27.51 61.68 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.145 0.498 . . . . 0.0 110.196 176.06 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 94.39 25.46 16.1 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.755 -0.736 . . . . 0.0 113.16 175.206 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 849' ' ' TYR . . . . . 0.405 ' CE1' ' HB3' ' A' ' 825' ' ' MET . 0.4 OUTLIER -115.91 161.98 18.01 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.986 0.393 . . . . 0.0 110.654 179.86 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.55 131.0 37.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.321 -177.545 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -116.63 142.99 46.18 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.665 -178.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.11 109.84 13.4 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 175.603 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 853' ' ' THR . . . . . 0.441 HG22 ' HG2' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -94.21 133.99 37.15 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.945 0.402 . . . . 0.0 111.395 -175.988 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 854' ' ' ALA . . . . . 0.434 ' HB3' HG13 ' A' ' 830' ' ' VAL . . . -146.79 177.15 9.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.783 178.753 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 855' ' ' ASN . . . . . 0.574 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 42.5 t30 -154.58 80.72 1.1 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.349 177.754 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 856' ' ' ASP . . . . . 0.574 ' HB2' ' O ' ' A' ' 855' ' ' ASN . 2.1 t0 164.85 145.27 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.538 0 O-C-N 123.979 0.799 . . . . 0.0 110.151 177.285 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -73.59 -42.33 40.54 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.179 179.617 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 3.6 m -69.41 -31.34 49.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.778 0.323 . . . . 0.0 111.015 -178.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -73.96 -37.19 64.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.847 0.356 . . . . 0.0 110.539 179.418 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 860' ' ' ALA . . . . . 0.402 ' O ' HG12 ' A' ' 863' ' ' VAL . . . -61.1 -36.64 80.24 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.09 175.679 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 861' ' ' LEU . . . . . 0.855 HD21 ' HA ' ' A' ' 890' ' ' ILE . 6.8 mt -68.41 -43.46 77.14 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.574 176.763 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 32.5 t30 -58.69 -50.28 74.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.817 179.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 863' ' ' VAL . . . . . 0.529 HG13 HD11 ' A' ' 869' ' ' ILE . 1.6 p -64.4 -30.99 51.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.987 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 864' ' ' LEU . . . . . 0.474 ' HA ' HD12 ' A' ' 869' ' ' ILE . 0.7 OUTLIER -63.24 -38.02 89.53 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.002 0.429 . . . . 0.0 110.973 177.307 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -83.34 -18.89 37.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.909 0.385 . . . . 0.0 111.03 -177.45 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 11.6 tptp -87.54 -46.54 9.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.121 -178.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -130.9 165.49 22.96 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.874 -174.529 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 53.5 t60 -87.66 128.77 35.28 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.929 0.395 . . . . 0.0 110.695 -179.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 869' ' ' ILE . . . . . 0.529 HD11 HG13 ' A' ' 863' ' ' VAL . 4.4 mt -117.31 136.68 53.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.389 174.738 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 870' ' ' ASP . . . . . 0.412 ' OD2' ' HG3' ' A' ' 825' ' ' MET . 23.0 m-20 -88.53 -48.72 7.38 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.814 0.34 . . . . 0.0 110.856 -177.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 871' ' ' ILE . . . . . 0.71 ' HB ' HD12 ' A' ' 827' ' ' ILE . 6.6 mm -128.4 137.26 57.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.316 -179.127 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 872' ' ' VAL . . . . . 0.548 HG22 HD12 ' A' ' 897' ' ' LEU . 0.0 OUTLIER -110.4 117.9 55.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.66 0.267 . . . . 0.0 111.173 -179.36 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 873' ' ' LEU . . . . . 0.403 HD12 ' HB ' ' A' ' 829' ' ' VAL . 0.3 OUTLIER -105.09 113.0 26.33 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 175.192 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -104.71 96.85 6.85 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 177.671 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 875' ' ' ASP . . . . . 0.665 ' O ' ' HA ' ' A' ' 831' ' ' ASP . 52.8 t0 -104.83 106.95 17.66 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.395 0.617 . . . . 0.0 110.395 -174.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 876' ' ' VAL . . . . . 0.429 HG23 HG23 ' A' ' 903' ' ' THR . 0.0 OUTLIER -124.56 134.66 66.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.302 -176.273 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -72.1 -50.39 28.5 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 173.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 3.2 ptm . . . . . 0 C--N 1.325 -0.479 0 CA-C-N 115.315 -0.857 . . . . 0.0 108.805 174.414 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.722 0 N-CA-C 111.264 -0.735 . . . . 0.0 111.264 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 30.7 t80 -122.68 -44.34 2.22 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.082 0.468 . . . . 0.0 110.423 -177.015 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.46 -38.51 80.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.074 -177.793 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.33 -48.89 73.85 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.62 -178.48 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.53 -42.68 98.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.442 -178.704 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.16 -48.52 81.19 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.37 178.562 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 889' ' ' ARG . . . . . 0.405 ' HB3' HD11 ' A' ' 861' ' ' LEU . 0.0 OUTLIER -63.15 -41.87 99.35 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.768 -176.651 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 890' ' ' ILE . . . . . 0.855 ' HA ' HD21 ' A' ' 861' ' ' LEU . 8.1 mm -58.8 -52.81 55.74 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 121.131 0.491 . . . . 0.0 111.023 -178.888 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 891' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -71.48 -22.72 61.77 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.795 -179.1 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.31 -45.85 78.91 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.832 0.349 . . . . 0.0 110.41 177.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -67.82 -43.8 78.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.301 178.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 125.41 81.5 0.44 Allowed Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 120.219 -0.991 . . . . 0.0 112.567 178.133 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 895' ' ' LEU . . . . . 0.631 ' HG ' ' O ' ' A' ' 895' ' ' LEU . 0.3 OUTLIER -70.33 120.67 16.34 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.244 0.545 . . . . 0.0 110.211 178.452 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -113.97 8.86 17.29 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.601 0.715 . . . . 0.0 110.895 179.22 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 897' ' ' LEU . . . . . 0.548 HD12 HG22 ' A' ' 872' ' ' VAL . 0.0 OUTLIER -130.43 137.85 31.74 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.541 -176.481 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -58.97 120.38 8.21 Favored 'Trans proline' 0 C--O 1.236 0.406 0 C-N-CA 122.656 2.237 . . . . 0.0 112.104 -178.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 899' ' ' VAL . . . . . 0.714 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 7.4 t -95.36 127.71 47.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.096 0.474 . . . . 0.0 110.629 -179.118 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 900' ' ' ILE . . . . . 0.529 HG23 ' HB2' ' A' ' 921' ' ' SER . 4.5 mt -107.95 109.6 28.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.851 176.215 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 901' ' ' GLY . . . . . 0.462 ' HA3' ' SD ' ' A' ' 919' ' ' MET . . . -92.95 97.82 2.31 Favored Glycine 0 N--CA 1.444 -0.812 0 CA-C-N 115.865 -0.607 . . . . 0.0 112.319 -178.124 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 902' ' ' VAL . . . . . 0.946 ' HB ' ' HB3' ' A' ' 923' ' ' LEU . 0.2 OUTLIER -94.07 119.77 42.47 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.218 0.532 . . . . 0.0 109.797 175.981 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 903' ' ' THR . . . . . 0.506 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.3 OUTLIER -125.68 154.68 42.02 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.562 -179.098 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -88.22 102.56 14.93 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.636 -0.426 . . . . 0.0 110.685 178.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 14.2 t30 40.65 67.55 0.5 Allowed 'General case' 0 N--CA 1.47 0.574 0 O-C-N 124.135 0.897 . . . . 0.0 112.168 176.64 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -72.83 -53.36 11.68 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.035 -177.088 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 167.52 -53.68 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 -176.937 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -163.87 86.6 0.49 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.379 -1.282 . . . . 0.0 109.164 178.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -55.15 -36.46 65.84 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.576 -176.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 910' ' ' GLU . . . . . 0.573 ' HG2' ' N ' ' A' ' 911' ' ' LYS . 8.0 pm0 -68.43 -40.48 81.16 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.661 -179.684 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 911' ' ' LYS . . . . . 0.573 ' N ' ' HG2' ' A' ' 910' ' ' GLU . 7.2 tttt -71.07 -35.11 71.76 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.127 -178.884 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 912' ' ' GLN . . . . . 0.585 ' O ' ' HG3' ' A' ' 916' ' ' GLU . 5.0 tp60 -60.03 -48.05 83.32 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.765 175.191 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 913' ' ' ARG . . . . . 0.576 ' HA ' ' OE2' ' A' ' 916' ' ' GLU . 0.0 OUTLIER -59.75 -34.78 73.4 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.123 179.017 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 66.3 m -70.71 -33.91 71.36 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.906 0.384 . . . . 0.0 110.607 177.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.71 -52.87 15.57 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.559 -178.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 916' ' ' GLU . . . . . 0.585 ' HG3' ' O ' ' A' ' 912' ' ' GLN . 1.2 pp20? -78.17 -46.73 19.77 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.215 -176.135 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 1.4 m 51.16 43.94 28.94 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.727 -175.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 918' ' ' GLY . . . . . 0.409 ' H ' ' CD ' ' A' ' 916' ' ' GLU . . . -122.86 -32.55 0.92 Allowed Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.024 179.238 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 919' ' ' MET . . . . . 0.714 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 75.0 mtm -72.58 -91.01 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 176.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 920' ' ' ASP . . . . . 0.712 ' HB2' ' O ' ' A' ' 919' ' ' MET . 14.8 t0 149.31 -49.09 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.923 1.289 . . . . 0.0 110.43 172.682 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . 0.529 ' HB2' HG23 ' A' ' 900' ' ' ILE . 0.8 OUTLIER -113.62 148.8 35.59 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.832 0.349 . . . . 0.0 110.69 179.878 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 922' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -117.26 141.96 47.65 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.056 178.842 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 923' ' ' LEU . . . . . 0.946 ' HB3' ' HB ' ' A' ' 902' ' ' VAL . 0.3 OUTLIER -148.4 167.68 24.62 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.843 0.354 . . . . 0.0 110.553 -179.401 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 924' ' ' SER . . . . . 0.506 ' HA ' ' O ' ' A' ' 903' ' ' THR . 3.9 m -115.88 150.0 37.76 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.997 175.498 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 925' ' ' LYS . . . . . 0.515 ' N ' ' HD2' ' A' ' 926' ' ' PRO . 1.4 tttp -51.62 -43.72 88.23 Favored Pre-proline 0 CA--C 1.54 0.595 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 926' ' ' PRO . . . . . 0.515 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 42.7 Cg_endo -69.01 63.24 1.36 Allowed 'Trans proline' 0 C--N 1.357 1.003 0 C-N-CA 121.987 1.792 . . . . 0.0 113.073 174.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 3.4 p -92.97 147.19 5.56 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.807 175.482 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -103.56 167.54 9.73 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.011 -177.593 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 929' ' ' LEU . . . . . 0.819 HD23 ' HG2' ' A' ' 843' ' ' GLN . 1.6 tm? -63.84 -35.8 81.81 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.152 179.04 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.28 -47.44 79.53 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.256 0.551 . . . . 0.0 110.359 -179.198 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 82.3 t -67.49 -44.94 86.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.924 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 932' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -62.43 -36.18 73.49 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-O 120.569 0.223 . . . . 0.0 110.426 -179.702 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 1.6 ttmt -68.28 -47.87 66.51 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.409 179.227 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.91 -43.02 95.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.907 179.425 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 17.8 m -65.45 -50.08 66.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.214 -178.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 936' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.33 -44.38 95.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.943 -178.45 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 36.2 m -62.94 -43.33 99.09 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.814 0.34 . . . . 0.0 111.48 -179.198 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.29 -49.36 64.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.954 -179.662 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -66.21 -34.65 78.5 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.213 -177.192 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -63.13 -45.57 91.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.794 0.33 . . . . 0.0 111.063 178.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 941' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.81 -34.11 76.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.121 179.266 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 942' ' ' ARG . . . . . 0.576 ' HG3' ' N ' ' A' ' 943' ' ' VAL . 0.0 OUTLIER -63.96 -47.56 79.94 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.967 -178.668 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 943' ' ' VAL . . . . . 0.576 ' N ' ' HG3' ' A' ' 942' ' ' ARG . 15.9 m -73.08 -29.9 30.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.551 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.49 -40.48 95.75 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.011 178.821 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 945' ' ' LYS . . . . . 0.441 ' HG2' ' O ' ' A' ' 942' ' ' ARG . 0.4 OUTLIER -79.63 -20.76 46.0 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 121.098 -0.241 . . . . 0.0 111.473 -179.161 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 16.1 m -72.93 -30.4 63.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.561 0.696 . . . . 0.0 109.797 171.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -82.55 -17.6 44.36 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.08 174.265 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 10.1 t70 . . . . . 0 C--O 1.232 0.146 0 CA-C-N 114.858 -1.065 . . . . 0.0 110.771 -178.609 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 705' ' ' SER . . . . . 0.503 ' HA ' ' O ' ' A' ' 730' ' ' GLY . 0.0 OUTLIER . . . . . 0 N--CA 1.452 -0.357 0 CA-C-O 120.739 0.304 . . . . 0.0 111.033 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 93.42 -19.79 50.42 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.527 179.411 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 707' ' ' LYS . . . . . 0.681 ' NZ ' ' HA ' ' A' ' 745' ' ' ASP . 7.8 tmtm? -84.61 147.98 26.7 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 -179.89 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 708' ' ' ARG . . . . . 0.459 ' HD2' ' CZ2' ' A' ' 710' ' ' TRP . 6.4 mtm-85 -113.22 162.68 15.72 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.612 0.72 . . . . 0.0 111.678 -177.171 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 709' ' ' CYS . . . . . 0.63 ' SG ' HD22 ' A' ' 726' ' ' LEU . 1.2 m -132.88 117.89 18.26 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 114.6 -1.182 . . . . 0.0 108.847 168.11 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 710' ' ' TRP . . . . . 0.459 ' CZ2' ' HD2' ' A' ' 708' ' ' ARG . 91.0 m95 -94.04 107.16 19.1 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 711' ' ' LEU . . . . . 0.964 HD21 HG13 ' A' ' 733' ' ' VAL . 0.1 OUTLIER -110.12 128.46 55.46 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.127 0.489 . . . . 0.0 111.124 -176.845 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -119.45 44.19 2.43 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.21 175.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 713' ' ' VAL . . . . . 0.933 ' HA ' ' HB2' ' A' ' 750' ' ' ASP . 43.6 t -99.42 123.52 52.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.431 -178.387 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 714' ' ' ARG . . . . . 0.728 HH12 ' HG3' ' A' ' 751' ' ' GLU . 0.0 OUTLIER -78.46 -35.98 45.94 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 177.836 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 13.7 m-80 -59.92 109.95 1.06 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.382 -0.827 . . . . 0.0 110.715 -176.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -58.91 -43.67 91.09 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.491 -176.343 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.28 -42.81 96.21 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.229 0.538 . . . . 0.0 110.73 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 718' ' ' LEU . . . . . 0.606 ' HB3' HG11 ' A' ' 713' ' ' VAL . 0.2 OUTLIER -72.05 -49.71 34.42 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.121 -177.858 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 719' ' ' CYS . . . . . 0.812 ' SG ' ' HB ' ' A' ' 713' ' ' VAL . 0.1 OUTLIER -62.67 -50.35 71.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.089 -178.251 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -59.09 -44.15 91.89 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.668 -177.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -61.39 -52.13 65.88 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.799 0.333 . . . . 0.0 110.993 -178.158 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 14.7 mt -62.73 -45.1 94.27 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.653 -178.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 723' ' ' GLU . . . . . 0.538 ' HA ' HG21 ' A' ' 733' ' ' VAL . 0.8 OUTLIER -59.08 -46.47 88.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.865 -179.045 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 724' ' ' THR . . . . . . . . . . . . . 57.6 m -61.63 -41.73 97.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.892 0.377 . . . . 0.0 111.043 -178.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 14.1 m -67.22 -39.49 86.25 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.067 -0.515 . . . . 0.0 112.167 -175.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 726' ' ' LEU . . . . . 0.89 HD23 HD12 ' A' ' 731' ' ' ILE . 0.2 OUTLIER -82.31 -33.68 28.91 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.916 -0.313 . . . . 0.0 111.326 -178.881 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 727' ' ' GLN . . . . . 0.461 HE21 ' HB3' ' A' ' 727' ' ' GLN . 0.8 OUTLIER -72.95 -13.24 61.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.02 0.438 . . . . 0.0 110.413 177.28 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.84 -19.3 63.97 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.618 176.487 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 729' ' ' SER . . . . . 0.432 ' HB2' ' H ' ' A' ' 730' ' ' GLY . 0.0 OUTLIER -98.11 -96.26 0.22 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.339 177.748 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 730' ' ' GLY . . . . . 0.503 ' O ' ' HA ' ' A' ' 705' ' ' SER . . . -159.1 21.64 0.29 Allowed Glycine 0 N--CA 1.45 -0.416 0 N-CA-C 111.016 -0.834 . . . . 0.0 111.016 178.264 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 731' ' ' ILE . . . . . 0.89 HD12 HD23 ' A' ' 726' ' ' LEU . 2.5 mt -89.76 132.25 34.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 -177.283 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 732' ' ' VAL . . . . . 0.422 HG13 ' HG3' ' A' ' 708' ' ' ARG . 1.5 p -87.13 108.59 18.27 Favored 'Isoleucine or valine' 0 C--O 1.238 0.488 0 CA-C-O 121.826 0.822 . . . . 0.0 111.335 -176.784 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 733' ' ' VAL . . . . . 0.964 HG13 HD21 ' A' ' 711' ' ' LEU . 2.2 t -75.41 117.33 19.59 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.0 -1.0 . . . . 0.0 109.85 176.661 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.01 126.28 41.03 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.637 -179.085 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -56.89 130.63 46.69 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.802 177.551 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -72.42 77.86 1.03 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.394 0.616 . . . . 0.0 110.443 178.192 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.41 -13.1 61.74 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.639 177.375 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 109.1 39.5 1.67 Allowed Glycine 0 N--CA 1.447 -0.574 0 N-CA-C 111.06 -0.816 . . . . 0.0 111.06 -174.531 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -85.81 -167.15 1.75 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.47 -0.365 . . . . 0.0 110.784 -177.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -67.78 122.0 81.78 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.341 -177.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 741' ' ' PRO . . . . . 0.442 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 29.4 Cg_endo -65.22 122.9 10.77 Favored 'Trans proline' 0 N--CA 1.463 -0.315 0 C-N-CA 122.371 2.047 . . . . 0.0 111.183 176.765 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 742' ' ' THR . . . . . 0.719 ' HB ' ' HB2' ' A' ' 745' ' ' ASP . 0.1 OUTLIER -104.99 124.88 35.21 Favored Pre-proline 0 C--N 1.322 -0.606 0 CA-C-O 120.948 0.404 . . . . 0.0 111.363 -174.391 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 743' ' ' PRO . . . . . 0.822 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 34.7 Cg_endo -65.47 -12.93 37.25 Favored 'Trans proline' 0 N--CA 1.473 0.267 0 C-N-CA 123.497 2.798 . . . . 0.0 113.693 -175.681 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -108.18 -0.66 20.85 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.553 0.692 . . . . 0.0 110.583 177.564 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 745' ' ' ASP . . . . . 0.719 ' HB2' ' HB ' ' A' ' 742' ' ' THR . 28.0 m-20 -111.89 165.87 11.7 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.758 -173.927 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 746' ' ' VAL . . . . . 0.654 HG21 HD11 ' A' ' 795' ' ' LEU . 16.6 m -123.46 147.42 27.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.432 -171.517 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 747' ' ' LEU . . . . . 0.424 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 0.2 OUTLIER -107.45 99.9 9.38 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.18 178.231 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 5.7 mt -90.62 106.61 17.59 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 174.403 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 8.9 t -117.89 148.13 42.43 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.361 0.6 . . . . 0.0 111.989 -171.522 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 750' ' ' ASP . . . . . 0.933 ' HB2' ' HA ' ' A' ' 713' ' ' VAL . 54.0 t0 -95.86 109.24 21.61 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.089 -0.959 . . . . 0.0 109.033 177.287 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 751' ' ' GLU . . . . . 0.728 ' HG3' HH12 ' A' ' 714' ' ' ARG . 9.2 mt-10 67.66 -150.76 0.17 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.423 -177.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 752' ' ' VAL . . . . . 0.481 ' H ' ' HB3' ' A' ' 751' ' ' GLU . 59.0 t -88.03 116.96 30.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.17 0.509 . . . . 0.0 111.815 -172.691 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 6.1 p -95.97 156.4 3.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.016 171.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.7 41.5 0.57 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.952 0.406 . . . . 0.0 111.887 -176.537 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.77 -170.44 2.9 Favored 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 179.044 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 756' ' ' LYS . . . . . 0.617 ' O ' ' HB2' ' A' ' 757' ' ' TRP . 0.0 OUTLIER -117.22 -77.28 0.57 Allowed 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 170.138 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 757' ' ' TRP . . . . . 0.617 ' HB2' ' O ' ' A' ' 756' ' ' LYS . 10.7 t-105 152.93 109.21 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.41 0 O-C-N 124.76 1.288 . . . . 0.0 110.359 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.81 75.89 4.24 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 171.017 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 759' ' ' GLY . . . . . 0.822 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -158.1 -143.52 3.68 Favored Glycine 0 N--CA 1.444 -0.798 0 CA-C-N 115.681 -0.69 . . . . 0.0 112.381 -175.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.63 -55.72 5.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.767 0.283 . . . . 0.0 111.105 -178.051 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -166.51 149.12 6.78 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.746 -179.08 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 2.5 p -116.64 131.03 70.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 121.006 0.431 . . . . 0.0 110.572 178.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 763' ' ' VAL . . . . . 0.605 HG11 HD21 ' A' ' 791' ' ' LEU . 38.9 t -110.54 111.34 35.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.956 -0.565 . . . . 0.0 109.938 179.315 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 764' ' ' THR . . . . . 0.447 ' HB ' HG12 ' A' ' 782' ' ' VAL . 1.5 m -103.47 122.18 44.37 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.21 -176.518 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 765' ' ' PHE . . . . . . . . . . . . . 36.5 m-85 -92.16 123.98 35.91 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 175.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 766' ' ' CYS . . . . . 0.49 ' SG ' ' HB ' ' A' ' 782' ' ' VAL . 1.3 m -96.4 132.89 41.47 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.762 0.315 . . . . 0.0 110.814 -176.158 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.83 -57.01 1.35 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.614 179.481 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 2.7 tpm_? -136.15 -43.36 0.64 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.17 0.509 . . . . 0.0 110.288 177.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 10.5 m170 -89.6 110.51 21.37 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.759 179.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 5.1 mt -116.87 83.26 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-O 121.109 0.48 . . . . 0.0 110.003 178.593 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -125.71 13.18 7.3 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.302 179.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 772' ' ' ILE . . . . . 0.441 ' HA ' ' HD3' ' A' ' 773' ' ' PRO . 42.6 mm -105.36 132.78 20.58 Favored Pre-proline 0 C--N 1.322 -0.6 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 177.868 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 773' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 772' ' ' ILE . 36.0 Cg_exo -61.7 150.41 85.83 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.771 2.314 . . . . 0.0 112.381 178.016 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . 0.626 ' HG ' ' H ' ' A' ' 776' ' ' LYS . 0.5 OUTLIER -97.45 -162.34 0.95 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.602 179.874 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 775' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -62.4 8.31 0.05 Allowed 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 113.307 0.855 . . . . 0.0 113.307 179.552 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 776' ' ' LYS . . . . . 0.626 ' H ' ' HG ' ' A' ' 774' ' ' LEU . 7.6 ptmt -65.07 -18.26 65.15 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 165.692 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 777' ' ' ALA . . . . . 0.725 ' HB3' ' HB2' ' A' ' 780' ' ' GLU . . . -105.83 161.17 23.63 Favored Pre-proline 0 N--CA 1.451 -0.415 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.79 176.099 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 778' ' ' PRO . . . . . 0.566 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 57.2 Cg_endo -69.77 -9.6 26.5 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.781 2.321 . . . . 0.0 114.47 -172.305 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . -156.35 23.54 0.51 Allowed Glycine 0 CA--C 1.505 -0.551 0 C-N-CA 119.838 -1.173 . . . . 0.0 112.603 -175.393 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 780' ' ' GLU . . . . . 0.725 ' HB2' ' HB3' ' A' ' 777' ' ' ALA . 0.4 OUTLIER -114.88 129.2 56.66 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 -178.601 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 18.6 m95 -129.62 139.13 51.51 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 179.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . 0.49 ' HB ' ' SG ' ' A' ' 766' ' ' CYS . 14.7 m -133.45 143.89 37.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 110.17 -0.308 . . . . 0.0 110.17 173.732 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 783' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -166.62 148.03 6.29 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.536 176.319 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -102.57 102.35 12.58 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.38 178.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -154.7 162.8 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.587 -0.279 . . . . 0.0 110.252 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -100.4 32.23 3.12 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.115 -179.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 56.5 79.15 0.34 Allowed Pre-proline 0 N--CA 1.465 0.291 0 CA-C-N 116.064 -0.516 . . . . 0.0 112.006 178.081 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 788' ' ' PRO . . . . . 0.642 ' HB2' ' OE2' ' A' ' 790' ' ' GLU . 10.2 Cg_endo -88.35 -128.4 0.01 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 122.948 2.432 . . . . 0.0 111.278 175.544 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 789' ' ' HIS . . . . . 0.465 ' H ' ' HB2' ' A' ' 788' ' ' PRO . 14.2 p-80 -114.06 1.09 14.52 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.875 0.369 . . . . 0.0 111.038 -179.18 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 790' ' ' GLU . . . . . 0.642 ' OE2' ' HB2' ' A' ' 788' ' ' PRO . 1.7 pm0 -92.36 -44.51 8.67 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.334 -176.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 791' ' ' LEU . . . . . 0.605 HD21 HG11 ' A' ' 763' ' ' VAL . 0.2 OUTLIER -71.18 -42.48 11.91 Favored Pre-proline 0 CA--C 1.535 0.387 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -177.769 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 792' ' ' PRO . . . . . 0.549 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 10.3 Cg_endo -57.83 -29.37 85.82 Favored 'Trans proline' 0 C--N 1.353 0.8 0 C-N-CA 121.261 1.307 . . . . 0.0 111.607 172.048 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -74.34 -34.29 63.37 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.258 175.824 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -60.31 -43.24 96.5 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.671 174.512 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 795' ' ' LEU . . . . . 0.654 HD11 HG21 ' A' ' 746' ' ' VAL . 0.2 OUTLIER -62.29 -39.77 94.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.566 177.971 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -63.54 -46.31 86.58 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.788 178.653 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 797' ' ' ARG . . . . . 0.443 ' HG3' ' N ' ' A' ' 798' ' ' ILE . 0.0 OUTLIER -65.51 -34.8 79.12 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.477 -0.328 . . . . 0.0 110.37 179.037 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 798' ' ' ILE . . . . . 0.443 ' N ' ' HG3' ' A' ' 797' ' ' ARG . 0.1 OUTLIER -65.49 -25.92 38.03 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.527 179.878 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.03 -65.36 0.69 Allowed 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.309 -0.405 . . . . 0.0 109.936 175.352 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 800' ' ' LEU . . . . . 0.478 ' HA ' HD23 ' A' ' 800' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.248 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.062 177.444 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 32.6 t70 . . . . . 0 C--O 1.232 0.172 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 1.4 tpp -79.49 90.77 5.09 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 171.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 826' ' ' MET . . . . . 0.519 ' H ' ' HG2' ' A' ' 826' ' ' MET . 0.0 OUTLIER -93.3 105.74 17.78 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.142 -173.938 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 827' ' ' ILE . . . . . . . . . . . . . 6.4 mm -115.12 129.25 71.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.342 178.244 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -94.81 131.9 40.18 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 178.739 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 829' ' ' VAL . . . . . 0.567 HG13 HD12 ' A' ' 873' ' ' LEU . 0.0 OUTLIER -113.84 95.89 4.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 176.959 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 830' ' ' VAL . . . . . . . . . . . . . 10.7 t -97.18 88.18 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.147 -179.601 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 831' ' ' ASP . . . . . 0.675 ' HA ' ' HB2' ' A' ' 875' ' ' ASP . 0.0 OUTLIER -104.65 154.61 19.74 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.087 -176.077 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -87.63 -22.82 24.5 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -175.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -130.74 114.17 16.61 Favored Pre-proline 0 N--CA 1.465 0.32 0 O-C-N 121.394 -0.817 . . . . 0.0 111.951 -174.433 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -42.44 -52.93 4.02 Favored 'Trans proline' 0 N--CA 1.479 0.632 0 C-N-CA 124.731 3.621 . . . . 0.0 115.315 -172.134 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 835' ' ' ILE . . . . . 0.419 ' O ' ' HB3' ' A' ' 838' ' ' ARG . 3.6 tp -58.67 -40.02 78.06 Favored 'Isoleucine or valine' 0 C--O 1.24 0.572 0 CA-C-O 121.437 0.637 . . . . 0.0 111.063 -178.149 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 836' ' ' ASN . . . . . 0.547 ' HB3' ' HZ2' ' A' ' 925' ' ' LYS . 3.7 m-20 -70.23 -40.5 74.45 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.608 -179.703 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 837' ' ' ARG . . . . . 0.668 ' HB2' ' OD1' ' A' ' 831' ' ' ASP . 0.0 OUTLIER -54.72 -44.53 73.57 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.55 174.755 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 838' ' ' ARG . . . . . 0.419 ' HB3' ' O ' ' A' ' 835' ' ' ILE . 0.0 OUTLIER -51.54 -46.54 63.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.557 178.766 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.5 -48.06 79.14 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.881 -0.6 . . . . 0.0 112.042 -176.251 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 840' ' ' LEU . . . . . 0.495 ' H ' ' HG ' ' A' ' 840' ' ' LEU . 0.0 OUTLIER -70.87 -37.84 73.08 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 122.037 -0.414 . . . . 0.0 110.928 -178.13 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -66.35 -31.69 72.63 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.241 0.543 . . . . 0.0 110.366 178.343 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 842' ' ' ASP . . . . . 0.41 ' HB2' ' O ' ' A' ' 838' ' ' ARG . 10.9 t0 -65.39 -42.47 92.6 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.83 175.35 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 843' ' ' GLN . . . . . 0.579 ' HG3' HD23 ' A' ' 929' ' ' LEU . 0.0 OUTLIER -64.96 -44.92 87.8 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.33 178.581 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 844' ' ' LEU . . . . . 0.628 ' HA ' HD23 ' A' ' 847' ' ' LEU . 0.0 OUTLIER -60.95 -43.55 98.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.086 178.752 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -64.71 -42.4 97.22 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.913 -0.66 . . . . 0.0 112.282 179.682 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 51.0 m -77.02 -9.58 58.8 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.904 0.383 . . . . 0.0 111.185 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 847' ' ' LEU . . . . . 0.628 HD23 ' HA ' ' A' ' 844' ' ' LEU . 0.0 OUTLIER -87.69 -28.31 21.88 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 175.333 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 106.97 18.32 10.71 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.488 174.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 5.5 m-30 -106.38 165.69 11.08 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.94 -0.392 . . . . 0.0 109.94 179.326 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -95.17 117.49 30.32 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.931 0.396 . . . . 0.0 110.343 -178.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -100.59 127.17 47.05 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.276 -176.189 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.64 116.66 32.32 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 172.153 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.71 132.93 35.51 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 -171.883 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 854' ' ' ALA . . . . . . . . . . . . . . . -151.02 147.2 26.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.769 176.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 855' ' ' ASN . . . . . 0.653 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 9.1 t-20 -128.13 73.19 1.45 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.982 176.144 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 856' ' ' ASP . . . . . 0.653 ' HB2' ' O ' ' A' ' 855' ' ' ASN . 2.1 t70 162.18 159.74 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.213 175.865 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -81.66 -30.98 34.32 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.137 178.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 858' ' ' VAL . . . . . 0.455 HG22 ' OD1' ' A' ' 856' ' ' ASP . 3.3 m -73.23 -31.76 35.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.688 0.28 . . . . 0.0 111.074 -178.222 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -67.79 -42.75 81.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.236 0.541 . . . . 0.0 109.973 178.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 860' ' ' ALA . . . . . 0.439 ' O ' ' HB2' ' A' ' 864' ' ' LEU . . . -64.77 -44.69 89.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.641 177.43 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 861' ' ' LEU . . . . . 0.484 HD21 ' HA3' ' A' ' 894' ' ' GLY . 0.1 OUTLIER -61.06 -34.25 74.59 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.717 178.348 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -61.17 -54.57 42.66 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.915 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 14.4 p -71.78 -32.45 44.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.731 0.301 . . . . 0.0 110.824 -177.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 864' ' ' LEU . . . . . 0.439 ' HB2' ' O ' ' A' ' 860' ' ' ALA . 0.2 OUTLIER -63.5 -45.12 92.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.771 178.311 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 15.2 m -71.71 -21.76 61.73 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.801 -179.192 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.28 -69.18 0.37 Allowed 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 173.811 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 867' ' ' ASN . . . . . 0.599 ' O ' ' HB2' ' A' ' 868' ' ' HIS . 2.3 t-20 159.17 127.4 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.609 0 O-C-N 124.274 0.984 . . . . 0.0 110.021 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 868' ' ' HIS . . . . . 0.599 ' HB2' ' O ' ' A' ' 867' ' ' ASN . 14.3 m-70 134.92 171.7 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.005 0 O-C-N 125.202 1.564 . . . . 0.0 110.528 165.667 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 869' ' ' ILE . . . . . 0.591 ' HB ' ' O ' ' A' ' 868' ' ' HIS . 1.5 mp 86.0 129.57 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 O-C-N 124.461 1.1 . . . . 0.0 111.109 174.748 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -112.76 -16.58 12.74 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.435 -178.311 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 871' ' ' ILE . . . . . . . . . . . . . 2.1 mt -145.95 137.69 19.69 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 178.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 872' ' ' VAL . . . . . 0.587 ' HB ' HG22 ' A' ' 899' ' ' VAL . 7.2 t -122.39 135.75 61.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.676 0.274 . . . . 0.0 110.962 -177.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 873' ' ' LEU . . . . . 0.567 HD12 HG13 ' A' ' 829' ' ' VAL . 10.0 mt -110.88 136.11 50.4 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 173.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -120.66 104.96 10.33 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.26 178.8 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 875' ' ' ASP . . . . . 0.675 ' HB2' ' HA ' ' A' ' 831' ' ' ASP . 0.8 OUTLIER -89.17 105.68 17.94 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.543 -176.825 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -95.95 100.02 10.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.548 -177.145 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 877' ' ' ASN . . . . . 0.424 ' HA ' ' HB3' ' A' ' 904' ' ' ALA . 0.8 OUTLIER -73.11 -43.0 62.33 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.758 176.368 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.577 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.256 174.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.32 0 N-CA-C 112.66 -0.176 . . . . 0.0 112.66 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 23.3 p90 -89.28 -22.4 22.71 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 -178.292 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -61.5 -31.35 71.34 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.752 174.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.92 -53.89 53.14 Favored 'General case' 0 CA--C 1.528 0.127 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.609 179.613 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.49 -36.19 80.62 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.839 -178.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 888' ' ' GLN . . . . . 0.474 ' HA ' ' HD3' ' A' ' 891' ' ' ARG . 60.9 mm-40 -61.08 -50.48 73.11 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.004 179.613 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.59 -44.72 95.93 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.485 -177.534 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 890' ' ' ILE . . . . . . . . . . . . . 18.0 mt -69.15 -46.45 77.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.059 -177.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 891' ' ' ARG . . . . . 0.474 ' HD3' ' HA ' ' A' ' 888' ' ' GLN . 2.3 ptm180 -66.96 -23.97 66.01 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.893 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 892' ' ' GLN . . . . . 0.457 ' HB2' ' O ' ' A' ' 888' ' ' GLN . 1.5 tp60 -71.88 -60.34 2.28 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.71 177.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -157.2 48.24 0.43 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.594 -176.349 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 894' ' ' GLY . . . . . 0.484 ' HA3' HD21 ' A' ' 861' ' ' LEU . . . -141.86 0.06 1.57 Allowed Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.35 176.508 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 895' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -108.4 110.74 22.36 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.973 0.416 . . . . 0.0 110.763 -178.312 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -134.54 22.57 3.67 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.563 0.697 . . . . 0.0 109.717 175.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 897' ' ' LEU . . . . . 0.406 ' HB2' ' HD2' ' A' ' 898' ' ' PRO . 0.4 OUTLIER -159.51 164.46 20.44 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.748 -173.666 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 898' ' ' PRO . . . . . 0.406 ' HD2' ' HB2' ' A' ' 897' ' ' LEU . 38.0 Cg_endo -67.07 128.76 19.2 Favored 'Trans proline' 0 C--O 1.241 0.629 0 C-N-CA 122.316 2.011 . . . . 0.0 111.941 176.129 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 899' ' ' VAL . . . . . 0.79 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 69.0 t -115.61 128.31 72.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.143 178.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 900' ' ' ILE . . . . . 0.455 ' HA ' ' O ' ' A' ' 921' ' ' SER . 3.0 mt -108.52 121.91 62.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.008 179.263 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -96.32 126.95 9.0 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 120.686 -0.768 . . . . 0.0 111.907 -178.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 902' ' ' VAL . . . . . 0.765 HG12 ' HA ' ' A' ' 925' ' ' LYS . 1.1 t -104.59 97.56 5.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 177.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.27 135.95 33.35 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.959 -172.895 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 904' ' ' ALA . . . . . 0.46 ' HA ' ' HB2' ' A' ' 925' ' ' LYS . . . -96.31 115.06 26.83 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.705 178.565 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 60.8 45.62 9.72 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 121.207 0.527 . . . . 0.0 111.238 177.267 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -98.27 98.86 10.07 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.046 177.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 11.1 tp -45.26 -45.15 11.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.521 176.476 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 908' ' ' ALA . . . . . 0.411 ' HB1' ' HB2' ' A' ' 911' ' ' LYS . . . -126.39 78.96 1.82 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.019 0.438 . . . . 0.0 110.582 177.605 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 909' ' ' GLU . . . . . 0.435 ' H ' ' HG2' ' A' ' 909' ' ' GLU . 0.0 OUTLIER -62.31 -41.37 98.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.527 -178.868 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 910' ' ' GLU . . . . . 0.526 ' H ' ' HG2' ' A' ' 910' ' ' GLU . 0.1 OUTLIER -64.02 -31.02 72.05 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.091 -179.753 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 911' ' ' LYS . . . . . 0.411 ' HB2' ' HB1' ' A' ' 908' ' ' ALA . 12.6 tttt -68.87 -41.64 78.08 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.259 179.781 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 69.9 tp60 -63.13 -36.24 82.96 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.134 177.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 913' ' ' ARG . . . . . 0.578 ' HB2' ' SG ' ' A' ' 922' ' ' CYS . 3.7 ttp180 -58.66 -46.96 86.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.944 177.814 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 7.4 m -74.94 -26.1 59.36 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.549 -176.171 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 1.2 tp -70.02 -51.74 29.81 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.954 0.407 . . . . 0.0 111.099 179.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -78.52 -42.53 29.24 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.506 -178.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 2.3 m 51.15 47.8 24.2 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.088 0.47 . . . . 0.0 111.573 -176.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -133.06 24.43 3.79 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.013 179.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 919' ' ' MET . . . . . 0.79 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -130.14 -101.45 0.31 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.576 0.226 . . . . 0.0 110.755 -177.198 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 920' ' ' ASP . . . . . 0.422 ' HB2' ' O ' ' A' ' 919' ' ' MET . 10.4 t70 168.2 -64.83 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.993 0.917 . . . . 0.0 108.801 179.83 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . 0.455 ' O ' ' HA ' ' A' ' 900' ' ' ILE . 70.9 m -139.23 163.11 33.32 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.653 179.018 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 922' ' ' CYS . . . . . 0.578 ' SG ' ' HB2' ' A' ' 913' ' ' ARG . 0.0 OUTLIER -137.6 158.24 44.8 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.03 0.443 . . . . 0.0 111.496 -177.506 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 923' ' ' LEU . . . . . 0.465 HD21 HG21 ' A' ' 935' ' ' THR . 0.0 OUTLIER -146.8 168.35 21.62 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.232 175.218 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 1.4 m -78.37 142.71 37.46 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.064 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 925' ' ' LYS . . . . . 0.765 ' HA ' HG12 ' A' ' 902' ' ' VAL . 0.0 OUTLIER -54.35 -39.95 78.8 Favored Pre-proline 0 CA--C 1.538 0.502 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 179.433 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -62.11 74.03 0.1 OUTLIER 'Trans proline' 0 C--N 1.36 1.162 0 C-N-CA 122.077 1.852 . . . . 0.0 112.194 171.184 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -98.47 140.17 18.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.968 -176.638 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.07 163.41 12.44 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.554 177.357 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 929' ' ' LEU . . . . . 0.579 HD23 ' HG3' ' A' ' 843' ' ' GLN . 0.0 OUTLIER -56.43 -46.41 80.29 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.355 -177.271 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -67.57 -34.38 76.93 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.028 0.442 . . . . 0.0 110.799 -177.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 62.4 t -69.61 -48.77 63.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.448 -178.728 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 932' ' ' ILE . . . . . 0.414 HG21 ' HB3' ' A' ' 843' ' ' GLN . 2.0 tp -67.28 -37.36 78.93 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 CA-C-O 120.64 0.257 . . . . 0.0 110.589 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 933' ' ' LYS . . . . . 0.492 ' HA ' HD13 ' A' ' 847' ' ' LEU . 0.8 OUTLIER -61.77 -47.64 84.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.169 176.87 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 934' ' ' GLN . . . . . 0.588 ' O ' ' HB2' ' A' ' 938' ' ' LEU . 1.9 tp60 -60.52 -51.08 70.95 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.743 -179.175 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 935' ' ' THR . . . . . 0.465 HG21 HD21 ' A' ' 923' ' ' LEU . 8.6 m -61.87 -47.63 84.16 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.529 -177.874 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 936' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.73 -47.84 68.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.385 -176.014 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 67.9 m -67.87 -39.46 83.71 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 111.708 0.262 . . . . 0.0 111.708 -178.181 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 938' ' ' LEU . . . . . 0.588 ' HB2' ' O ' ' A' ' 934' ' ' GLN . 0.2 OUTLIER -62.35 -44.31 96.78 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.987 0.422 . . . . 0.0 110.45 179.101 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -72.79 -30.65 64.26 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.929 -179.761 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -64.2 -35.82 82.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.857 0.361 . . . . 0.0 110.612 176.2 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 941' ' ' GLU . . . . . 0.419 ' HG3' ' N ' ' A' ' 942' ' ' ARG . 0.0 OUTLIER -78.9 -31.85 45.5 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.474 178.256 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 942' ' ' ARG . . . . . 0.625 ' HG3' ' N ' ' A' ' 943' ' ' VAL . 0.0 OUTLIER -65.59 -46.88 77.69 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 178.133 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 943' ' ' VAL . . . . . 0.625 ' N ' ' HG3' ' A' ' 942' ' ' ARG . 30.7 m -69.65 -28.25 36.76 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.265 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.08 179.503 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.7 -44.23 85.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.252 174.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 5.1 mttt -64.44 -45.06 89.12 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.315 -179.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.75 -35.64 77.35 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.832 0.349 . . . . 0.0 111.456 -178.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 27.4 mtt-85 -71.76 -50.38 30.52 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.861 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 6.7 t70 . . . . . 0 C--N 1.323 -0.549 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.404 -176.035 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 705' ' ' SER . . . . . 0.455 ' HA ' ' O ' ' A' ' 730' ' ' GLY . 0.7 OUTLIER . . . . . 0 N--CA 1.456 -0.143 0 CA-C-O 121.148 0.499 . . . . 0.0 111.825 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . -170.66 25.63 0.1 OUTLIER Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 121.042 -0.599 . . . . 0.0 112.038 176.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 707' ' ' LYS . . . . . 0.539 ' HE3' ' HB3' ' A' ' 744' ' ' GLU . 26.1 mmtm -133.7 137.56 45.35 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 178.014 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 708' ' ' ARG . . . . . 0.755 ' HA ' HG23 ' A' ' 732' ' ' VAL . 6.5 mtp85 -92.11 136.24 33.34 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 121.369 0.604 . . . . 0.0 111.218 -173.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 1.7 t -104.31 109.97 22.02 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 171.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 710' ' ' TRP . . . . . 0.417 ' CZ2' ' HD3' ' A' ' 708' ' ' ARG . 89.2 m95 -90.13 96.23 10.57 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.815 0.817 . . . . 0.0 109.156 -178.526 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 711' ' ' LEU . . . . . 0.458 HD21 ' HB2' ' A' ' 719' ' ' CYS . 1.3 tp -95.64 104.65 16.58 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 114.611 -1.177 . . . . 0.0 111.305 -169.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 712' ' ' ALA . . . . . 0.404 ' HB2' ' HB3' ' A' ' 736' ' ' TYR . . . -103.51 30.92 4.66 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.786 0.803 . . . . 0.0 109.345 174.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 713' ' ' VAL . . . . . 0.722 HG13 ' HB3' ' A' ' 750' ' ' ASP . 49.1 t -92.98 115.43 31.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 114.954 -1.021 . . . . 0.0 109.833 178.244 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 32.2 mtp85 -110.1 17.92 20.53 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.678 0.752 . . . . 0.0 110.069 -179.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -92.05 109.78 21.14 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.026 -0.988 . . . . 0.0 108.845 173.054 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -45.41 -53.49 8.63 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 -172.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.42 -48.59 81.1 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.1 0.476 . . . . 0.0 110.747 -178.56 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 718' ' ' LEU . . . . . 0.579 HD21 ' CD2' ' A' ' 765' ' ' PHE . 0.2 OUTLIER -68.76 -48.35 63.94 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.684 -176.292 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 719' ' ' CYS . . . . . 0.458 ' HB2' HD21 ' A' ' 711' ' ' LEU . 16.3 p -67.29 -46.66 72.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.06 -174.825 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -62.48 -34.56 77.09 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.647 -0.252 . . . . 0.0 110.967 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 721' ' ' PHE . . . . . 0.429 ' HE2' ' HG3' ' A' ' 792' ' ' PRO . 93.7 t80 -65.64 -56.34 12.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.871 0.367 . . . . 0.0 110.366 178.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 91.9 mt -61.53 -45.73 92.92 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.237 -177.35 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 723' ' ' GLU . . . . . 0.582 ' HG3' ' N ' ' A' ' 724' ' ' THR . 0.0 OUTLIER -59.78 -42.2 92.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.115 -175.891 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 724' ' ' THR . . . . . 0.582 ' N ' ' HG3' ' A' ' 723' ' ' GLU . 8.6 m -77.43 -41.41 39.95 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.657 0.265 . . . . 0.0 111.499 -177.877 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 25.9 m -65.0 -36.62 85.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.835 0.35 . . . . 0.0 111.297 -178.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 726' ' ' LEU . . . . . 0.513 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 50.9 mt -79.31 -42.72 25.1 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.562 -176.654 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 727' ' ' GLN . . . . . 0.438 ' HG3' ' O ' ' A' ' 724' ' ' THR . 3.5 pp0? -62.69 -19.61 64.05 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 120.676 0.274 . . . . 0.0 111.318 -177.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 8.5 mtp-105 -57.42 -39.87 77.11 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.082 178.401 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -96.31 6.26 49.17 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.056 -177.268 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 730' ' ' GLY . . . . . 0.455 ' O ' ' HA ' ' A' ' 705' ' ' SER . . . 94.26 7.65 60.6 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.556 -0.83 . . . . 0.0 113.09 176.422 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 731' ' ' ILE . . . . . 0.513 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 36.4 mm -67.23 116.4 6.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 176.096 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 732' ' ' VAL . . . . . 0.755 HG23 ' HA ' ' A' ' 708' ' ' ARG . 3.0 m -79.56 90.97 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 121.587 0.708 . . . . 0.0 111.097 -173.488 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 733' ' ' VAL . . . . . 0.511 HG21 ' HA ' ' A' ' 723' ' ' GLU . 21.8 t -72.4 135.71 27.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.097 178.393 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -143.89 127.4 16.94 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.15 -177.42 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.3 114.07 2.25 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.127 178.576 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 736' ' ' TYR . . . . . 0.404 ' HB3' ' HB2' ' A' ' 712' ' ' ALA . 43.0 t80 -87.25 100.63 12.83 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.107 0.479 . . . . 0.0 110.601 -178.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -104.62 -11.42 16.94 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.205 177.168 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 139.92 68.56 0.04 OUTLIER Glycine 0 N--CA 1.448 -0.519 0 N-CA-C 111.211 -0.756 . . . . 0.0 111.211 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 739' ' ' GLN . . . . . 0.458 ' HB3' ' H ' ' A' ' 740' ' ' GLU . 14.7 mp0 -110.0 -138.46 0.37 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.885 0.374 . . . . 0.0 111.376 -174.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 740' ' ' GLU . . . . . 0.458 ' H ' ' HB3' ' A' ' 739' ' ' GLN . 2.2 tp10 -108.21 133.84 20.39 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.969 -175.032 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 741' ' ' PRO . . . . . 0.623 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 1.1 Cg_endo -83.39 123.54 3.44 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 123.241 2.627 . . . . 0.0 112.324 177.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 742' ' ' THR . . . . . 0.434 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.2 OUTLIER -108.28 132.47 21.07 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.437 176.272 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 743' ' ' PRO . . . . . 0.434 ' HD2' HG22 ' A' ' 742' ' ' THR . 37.5 Cg_endo -66.2 -5.33 12.21 Favored 'Trans proline' 0 N--CA 1.475 0.411 0 C-N-CA 123.151 2.567 . . . . 0.0 113.53 -175.286 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 744' ' ' GLU . . . . . 0.539 ' HB3' ' HE3' ' A' ' 707' ' ' LYS . 5.4 mm-40 -116.38 0.52 12.81 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.837 0.351 . . . . 0.0 110.894 177.622 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 745' ' ' ASP . . . . . 0.447 ' CG ' ' HB2' ' A' ' 708' ' ' ARG . 30.8 m-20 -103.93 165.61 10.93 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.44 -176.328 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 746' ' ' VAL . . . . . 0.672 HG21 HD11 ' A' ' 795' ' ' LEU . 2.6 p -128.35 136.04 61.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.252 0.548 . . . . 0.0 111.603 -174.54 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 747' ' ' LEU . . . . . 0.416 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 0.6 OUTLIER -99.72 104.91 16.67 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.866 176.895 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 24.9 mt -98.96 109.54 24.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 109.157 -0.682 . . . . 0.0 109.157 174.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 14.7 t -117.43 158.51 24.36 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.205 -174.683 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 750' ' ' ASP . . . . . 0.722 ' HB3' HG13 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -105.33 136.54 44.69 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.69 174.786 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 60.87 -167.45 0.19 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.882 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 752' ' ' VAL . . . . . . . . . . . . . 3.6 t -82.2 91.0 2.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.301 -175.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 753' ' ' VAL . . . . . 0.426 HG13 ' HB2' ' A' ' 755' ' ' LYS . 4.8 p -78.7 -18.06 13.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.405 175.712 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 1.4 m 56.25 56.8 5.47 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.358 -179.102 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 755' ' ' LYS . . . . . 0.426 ' HB2' HG13 ' A' ' 753' ' ' VAL . 0.0 OUTLIER -131.6 152.43 50.82 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 176.031 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 756' ' ' LYS . . . . . 0.428 ' HD3' ' HA ' ' A' ' 756' ' ' LYS . 42.4 mmtt -93.93 -43.36 8.59 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.262 -177.912 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 757' ' ' TRP . . . . . 0.623 ' CH2' ' HA ' ' A' ' 741' ' ' PRO . 71.3 t-105 68.75 96.66 0.06 Allowed 'General case' 0 N--CA 1.464 0.265 0 O-C-N 124.019 0.825 . . . . 0.0 111.709 178.506 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 758' ' ' GLN . . . . . 0.413 ' HB2' HE21 ' A' ' 758' ' ' GLN . 0.7 OUTLIER -81.04 63.87 5.57 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.293 0.568 . . . . 0.0 110.501 175.622 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 759' ' ' GLY . . . . . 0.422 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -128.89 -149.77 6.99 Favored Glycine 0 N--CA 1.446 -0.698 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.966 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 2.0 ttt-85 -70.43 -49.36 49.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.782 0.325 . . . . 0.0 110.157 177.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -166.2 153.07 9.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.526 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 762' ' ' VAL . . . . . 0.441 ' HB ' ' HB3' ' A' ' 757' ' ' TRP . 7.7 p -119.03 132.1 69.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 176.626 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 763' ' ' VAL . . . . . 0.565 HG21 HD21 ' A' ' 795' ' ' LEU . 1.4 t -123.02 125.15 71.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 120.832 0.349 . . . . 0.0 110.649 -177.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 764' ' ' THR . . . . . 0.947 ' HB ' HG12 ' A' ' 782' ' ' VAL . 86.3 m -111.68 124.33 52.1 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.346 -179.282 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 765' ' ' PHE . . . . . 0.89 ' HE1' HG23 ' A' ' 785' ' ' VAL . 0.7 OUTLIER -95.41 110.32 22.37 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 172.672 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.25 133.1 38.13 Favored 'General case' 0 C--N 1.317 -0.837 0 C-N-CA 120.527 -0.469 . . . . 0.0 109.946 -178.266 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.7 -38.5 3.7 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.296 -179.407 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.67 -35.94 1.44 Allowed 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.288 -179.324 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 58.3 m80 -120.88 140.74 51.38 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.153 0.501 . . . . 0.0 111.212 -175.11 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 3.3 mt -123.97 103.25 12.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.484 179.12 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -121.41 -19.65 3.44 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.18 178.099 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 772' ' ' ILE . . . . . 0.422 ' HA ' ' HD3' ' A' ' 773' ' ' PRO . 18.8 mm -94.56 132.69 28.24 Favored Pre-proline 0 C--N 1.326 -0.416 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 773' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 772' ' ' ILE . 3.9 Cg_exo -80.31 164.86 21.5 Favored 'Trans proline' 0 N--CA 1.459 -0.552 0 C-N-CA 122.967 2.445 . . . . 0.0 112.45 179.848 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 774' ' ' LEU . . . . . 0.487 ' H ' HD23 ' A' ' 774' ' ' LEU . 0.7 OUTLIER -91.95 -157.47 0.52 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.337 179.074 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 775' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -64.76 61.13 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 178.609 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.71 -12.4 17.69 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 169.026 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -136.32 150.1 69.77 Favored Pre-proline 0 N--CA 1.447 -0.585 0 CA-C-N 114.139 -1.391 . . . . 0.0 108.617 176.507 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -61.94 102.65 0.26 Allowed 'Trans proline' 0 C--O 1.233 0.254 0 C-N-CA 122.706 2.271 . . . . 0.0 113.174 -177.034 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 115.34 -4.58 21.74 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.481 -0.866 . . . . 0.0 113.548 174.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 780' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.33 122.74 39.53 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 117.217 0.508 . . . . 0.0 109.999 -179.197 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 781' ' ' TRP . . . . . 0.706 ' HZ3' HD13 ' A' ' 794' ' ' LEU . 13.0 m95 -133.78 134.9 43.47 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 -179.178 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . 0.947 HG12 ' HB ' ' A' ' 764' ' ' THR . 26.6 m -140.77 152.11 20.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 121.129 0.49 . . . . 0.0 110.735 174.557 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 783' ' ' HIS . . . . . . . . . . . . . 3.1 t-160 -155.67 119.84 4.57 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.276 174.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -89.49 100.14 13.0 Favored 'General case' 0 C--N 1.317 -0.833 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.689 -179.701 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 785' ' ' VAL . . . . . 0.89 HG23 ' HE1' ' A' ' 765' ' ' PHE . 0.0 OUTLIER -167.58 -172.46 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.527 179.365 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -114.53 55.24 0.75 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.484 0.183 . . . . 0.0 111.468 -178.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 787' ' ' ALA . . . . . 0.542 ' HB2' ' HG ' ' A' ' 718' ' ' LEU . . . 51.52 61.99 11.81 Favored Pre-proline 0 N--CA 1.469 0.491 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.442 177.384 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 788' ' ' PRO . . . . . 0.417 ' HD3' ' N ' ' A' ' 787' ' ' ALA . 1.1 Cg_endo -84.0 46.24 1.96 Allowed 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 123.088 2.525 . . . . 0.0 112.837 -176.745 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 70.07 -15.73 0.32 Allowed 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 113.305 0.854 . . . . 0.0 113.305 174.167 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 790' ' ' GLU . . . . . 0.434 ' H ' ' HG3' ' A' ' 790' ' ' GLU . 0.0 OUTLIER -73.72 -51.76 15.49 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -175.39 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 791' ' ' LEU . . . . . 0.514 ' N ' ' HD2' ' A' ' 792' ' ' PRO . 0.3 OUTLIER -58.91 -50.54 87.46 Favored Pre-proline 0 CA--C 1.534 0.354 0 N-CA-C 112.427 0.528 . . . . 0.0 112.427 -176.959 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 792' ' ' PRO . . . . . 0.514 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 10.8 Cg_endo -55.8 -33.45 88.19 Favored 'Trans proline' 0 C--N 1.357 0.987 0 C-N-CA 121.971 1.781 . . . . 0.0 112.258 177.283 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -66.4 -50.39 63.6 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 120.938 0.399 . . . . 0.0 110.723 178.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 794' ' ' LEU . . . . . 0.706 HD13 ' HZ3' ' A' ' 781' ' ' TRP . 1.0 OUTLIER -64.41 -33.8 76.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.926 179.683 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 795' ' ' LEU . . . . . 0.672 HD11 HG21 ' A' ' 746' ' ' VAL . 0.7 OUTLIER -67.25 -43.8 81.01 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.995 -179.092 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -60.25 -37.14 79.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.074 0.464 . . . . 0.0 110.621 178.25 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 797' ' ' ARG . . . . . 0.462 ' HD2' HD23 ' A' ' 794' ' ' LEU . 0.0 OUTLIER -71.91 -48.78 43.12 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.225 179.124 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 798' ' ' ILE . . . . . 0.421 HG22 ' O ' ' A' ' 795' ' ' LEU . 0.6 OUTLIER -62.86 -18.02 20.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -176.979 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -63.22 -39.37 94.43 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 175.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 800' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 797' ' ' ARG . 6.1 mt . . . . . 0 N--CA 1.467 0.392 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.232 177.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 15.1 t70 . . . . . 0 N--CA 1.466 0.34 0 CA-C-O 120.883 0.373 . . . . 0.0 111.491 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 4.0 ttm -137.7 135.4 36.41 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 -178.176 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 826' ' ' MET . . . . . 0.559 ' HA ' ' HB2' ' A' ' 850' ' ' GLN . 21.2 ptp -108.43 129.09 55.27 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.663 0.744 . . . . 0.0 111.613 -177.122 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 827' ' ' ILE . . . . . . . . . . . . . 10.0 mm -109.82 144.17 18.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-N 114.864 -1.062 . . . . 0.0 108.836 175.405 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 828' ' ' LEU . . . . . 0.614 ' HB2' HG12 ' A' ' 869' ' ' ILE . 16.1 tp -103.23 122.24 44.35 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.664 0.268 . . . . 0.0 110.282 -177.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 829' ' ' VAL . . . . . 0.503 ' HA ' ' HG ' ' A' ' 873' ' ' LEU . 1.2 p -114.73 104.33 16.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.372 0.606 . . . . 0.0 110.1 -179.222 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 830' ' ' VAL . . . . . 0.796 HG22 ' HB3' ' A' ' 854' ' ' ALA . 60.6 t -119.09 119.87 62.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.172 -179.703 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 831' ' ' ASP . . . . . 1.014 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 0.9 OUTLIER -130.06 153.8 48.09 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 176.86 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.75 -13.96 59.07 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -172.365 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 7.8 m80 -131.68 95.83 22.24 Favored Pre-proline 0 C--N 1.327 -0.371 0 O-C-N 121.798 -0.564 . . . . 0.0 111.451 -178.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_exo -27.03 -46.52 0.08 OUTLIER 'Trans proline' 0 C--N 1.353 0.811 1 C-N-CA 125.835 4.357 . . . . 0.0 116.618 -171.756 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 1.2 pp -57.18 -44.0 82.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -176.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 836' ' ' ASN . . . . . 0.504 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 1.5 t30 -73.09 -46.75 49.57 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -178.322 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 837' ' ' ARG . . . . . 1.014 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 0.4 OUTLIER -51.9 -39.85 59.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.862 178.451 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 838' ' ' ARG . . . . . 0.403 ' HD3' ' O ' ' A' ' 838' ' ' ARG . 0.0 OUTLIER -64.51 -47.08 80.22 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.489 177.751 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.62 -42.48 95.47 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.106 -0.497 . . . . 0.0 112.011 -173.831 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 840' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 836' ' ' ASN . 0.0 OUTLIER -70.88 -26.79 63.39 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.211 177.14 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -66.81 -33.57 75.91 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.156 0.503 . . . . 0.0 109.818 175.257 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -64.49 -41.72 96.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.974 174.415 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 843' ' ' GLN . . . . . 0.645 ' HG2' HG21 ' A' ' 932' ' ' ILE . 0.3 OUTLIER -62.01 -41.61 98.26 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.491 176.069 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 844' ' ' LEU . . . . . 0.74 HD13 ' HB3' ' A' ' 851' ' ' CYS . 0.5 OUTLIER -61.66 -33.19 73.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.595 176.067 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -65.39 -34.19 88.64 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.94 -0.648 . . . . 0.0 111.707 175.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 9.3 m -68.91 -28.23 66.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.91 0.386 . . . . 0.0 110.606 176.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.65 -22.45 63.45 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.27 176.013 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 84.84 24.06 47.03 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 121.088 -0.577 . . . . 0.0 113.446 173.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -114.77 -177.93 3.25 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.718 0.294 . . . . 0.0 110.454 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 850' ' ' GLN . . . . . 0.559 ' HB2' ' HA ' ' A' ' 826' ' ' MET . 4.2 mm100 -85.76 141.38 29.74 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 177.011 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 851' ' ' CYS . . . . . 0.74 ' HB3' HD13 ' A' ' 844' ' ' LEU . 0.0 OUTLIER -132.09 116.59 17.23 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 120.797 0.332 . . . . 0.0 110.892 -177.682 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -93.74 109.6 21.26 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 176.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 853' ' ' THR . . . . . 0.443 ' HA ' HG13 ' A' ' 829' ' ' VAL . 0.0 OUTLIER -91.8 116.6 29.03 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.689 -174.065 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 854' ' ' ALA . . . . . 0.796 ' HB3' HG22 ' A' ' 830' ' ' VAL . . . -136.18 161.09 36.71 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.752 178.691 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -142.04 73.95 1.43 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.975 177.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 856' ' ' ASP . . . . . 0.769 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 31.7 t70 176.55 150.17 0.14 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.784 -178.474 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -77.4 -42.69 17.72 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.514 -178.103 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -71.71 -34.67 52.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.739 0.304 . . . . 0.0 110.348 -178.698 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 859' ' ' ASP . . . . . 0.769 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 0.1 OUTLIER -57.03 -38.85 73.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.642 177.306 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 860' ' ' ALA . . . . . 0.474 ' O ' HG12 ' A' ' 863' ' ' VAL . . . -66.57 -40.79 89.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.833 179.228 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 861' ' ' LEU . . . . . 0.467 HD22 ' HA ' ' A' ' 861' ' ' LEU . 0.2 OUTLIER -66.33 -33.25 75.3 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.095 0.474 . . . . 0.0 110.439 178.358 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -67.42 -42.55 83.03 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.884 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 863' ' ' VAL . . . . . 0.479 HG11 HD13 ' A' ' 828' ' ' LEU . 1.6 p -70.72 -32.02 47.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.715 0.293 . . . . 0.0 110.462 178.334 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 864' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -61.53 -39.68 91.93 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 121.15 0.5 . . . . 0.0 109.954 174.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 6.0 m -78.0 -16.97 57.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.935 178.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 2.8 tttp -76.26 -60.63 2.25 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.423 178.178 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -121.69 -90.17 0.58 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.147 177.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 23.7 p80 -179.1 -39.56 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 122.168 0.187 . . . . 0.0 110.869 176.291 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 869' ' ' ILE . . . . . 0.614 HG12 ' HB2' ' A' ' 828' ' ' LEU . 0.3 OUTLIER 69.38 149.58 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 O-C-N 123.392 0.432 . . . . 0.0 110.273 -175.6 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -92.41 -39.89 11.18 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.518 -0.473 . . . . 0.0 111.414 -177.073 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 871' ' ' ILE . . . . . . . . . . . . . 1.4 mt -138.64 133.9 42.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 177.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 872' ' ' VAL . . . . . 0.575 HG13 HD23 ' A' ' 828' ' ' LEU . 72.4 t -107.89 112.29 39.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.661 -179.363 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 873' ' ' LEU . . . . . 0.503 ' HG ' ' HA ' ' A' ' 829' ' ' VAL . 1.4 pp -108.72 127.92 54.41 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.115 0.484 . . . . 0.0 110.028 176.315 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -123.26 114.69 20.58 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.668 -177.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 875' ' ' ASP . . . . . 0.812 ' HB3' ' HB2' ' A' ' 831' ' ' ASP . 34.0 t0 -102.5 136.32 42.54 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 178.468 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 876' ' ' VAL . . . . . 0.452 HG23 HG23 ' A' ' 903' ' ' THR . 0.0 OUTLIER -141.09 129.19 22.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-O 121.296 0.569 . . . . 0.0 111.402 -177.053 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -80.21 -39.06 29.88 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 171.09 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.536 0 CA-C-N 114.519 -1.219 . . . . 0.0 109.001 175.21 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.341 0 CA-C-O 120.306 -0.163 . . . . 0.0 113.094 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -123.25 -43.25 2.21 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.101 0.477 . . . . 0.0 110.346 -178.03 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -60.92 -36.4 79.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.809 -177.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.26 -42.96 99.23 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.462 -179.552 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.2 -44.34 76.03 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.047 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 888' ' ' GLN . . . . . 0.445 ' OE1' ' HD3' ' A' ' 891' ' ' ARG . 3.3 tp-100 -60.49 -43.04 97.41 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.6 178.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -70.62 -33.08 70.63 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.148 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 890' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -60.81 -48.35 89.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.707 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 891' ' ' ARG . . . . . 0.468 HH21 ' HG3' ' A' ' 892' ' ' GLN . 0.0 OUTLIER -74.49 -23.17 58.82 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.814 0.34 . . . . 0.0 110.6 179.606 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 892' ' ' GLN . . . . . 0.468 ' HG3' HH21 ' A' ' 891' ' ' ARG . 5.3 mt-30 -70.92 -43.36 68.41 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.896 178.454 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.06 -55.04 18.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.87 -178.421 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 163.06 60.96 0.02 OUTLIER Glycine 0 N--CA 1.453 -0.208 0 C-N-CA 120.34 -0.933 . . . . 0.0 112.432 -179.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 895' ' ' LEU . . . . . 0.439 ' HB3' ' HA ' ' A' ' 891' ' ' ARG . 0.4 OUTLIER -68.15 111.15 4.33 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.971 0.415 . . . . 0.0 110.894 -179.509 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -128.42 7.84 5.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.442 174.143 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 897' ' ' LEU . . . . . 0.553 HD12 HG23 ' A' ' 872' ' ' VAL . 0.1 OUTLIER -125.31 138.98 32.74 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.032 -177.163 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.32 144.88 46.98 Favored 'Trans proline' 0 C--O 1.238 0.486 0 C-N-CA 122.571 2.181 . . . . 0.0 112.572 -178.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 899' ' ' VAL . . . . . 0.792 HG13 ' HA ' ' A' ' 919' ' ' MET . 0.2 OUTLIER -121.07 137.75 53.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 121.534 0.683 . . . . 0.0 110.331 179.443 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 900' ' ' ILE . . . . . 0.743 HG23 ' HB2' ' A' ' 921' ' ' SER . 6.3 mt -108.47 112.11 38.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.03 -179.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 901' ' ' GLY . . . . . 0.459 ' O ' ' HA ' ' A' ' 922' ' ' CYS . . . -97.93 110.04 3.94 Favored Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 121.053 -0.594 . . . . 0.0 112.009 -179.027 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 902' ' ' VAL . . . . . 0.579 ' HB ' ' HB2' ' A' ' 923' ' ' LEU . 0.2 OUTLIER -105.06 126.19 60.04 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 178.83 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 903' ' ' THR . . . . . 0.452 HG23 HG23 ' A' ' 876' ' ' VAL . 0.2 OUTLIER -135.2 153.77 51.83 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.056 0.455 . . . . 0.0 111.611 -174.665 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 904' ' ' ALA . . . . . 0.42 ' HB2' ' HD3' ' A' ' 925' ' ' LYS . . . -90.78 104.02 16.65 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.722 174.89 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 16.4 t30 43.73 61.46 2.27 Favored 'General case' 0 N--CA 1.468 0.427 0 O-C-N 124.034 0.834 . . . . 0.0 111.553 -178.326 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 906' ' ' ALA . . . . . 0.579 ' HB1' ' HB2' ' A' ' 909' ' ' GLU . . . -55.29 -64.82 0.72 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.843 -178.279 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 3.6 mp 56.24 35.19 25.34 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.848 178.475 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -175.7 -45.36 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.096 -175.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 909' ' ' GLU . . . . . 0.579 ' HB2' ' HB1' ' A' ' 906' ' ' ALA . 0.0 OUTLIER -69.99 -20.23 63.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.327 -175.618 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 910' ' ' GLU . . . . . 0.428 ' HG2' ' H ' ' A' ' 911' ' ' LYS . 3.5 pm0 -62.29 -40.82 97.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.245 0.545 . . . . 0.0 109.682 172.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 911' ' ' LYS . . . . . 0.428 ' H ' ' HG2' ' A' ' 910' ' ' GLU . 0.7 OUTLIER -67.84 -35.94 79.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.99 178.286 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 912' ' ' GLN . . . . . 0.463 ' O ' ' HG3' ' A' ' 916' ' ' GLU . 0.0 OUTLIER -63.32 -44.19 95.64 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.225 176.125 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 913' ' ' ARG . . . . . 0.58 ' HD3' ' HB3' ' A' ' 919' ' ' MET . 0.0 OUTLIER -63.7 -28.07 69.64 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.912 179.562 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 63.8 m -74.42 -28.11 60.92 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.96 0.41 . . . . 0.0 110.064 176.451 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.43 -49.98 50.02 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.049 179.217 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 916' ' ' GLU . . . . . 0.514 ' HG3' ' H ' ' A' ' 916' ' ' GLU . 0.0 OUTLIER -77.26 -38.42 51.02 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.984 -178.574 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.74 36.72 18.45 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 121.286 0.565 . . . . 0.0 111.18 -175.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -125.09 -14.06 3.44 Favored Glycine 0 N--CA 1.446 -0.646 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.691 179.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 919' ' ' MET . . . . . 0.792 ' HA ' HG13 ' A' ' 899' ' ' VAL . 2.7 ttm -63.79 -108.24 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.542 0.337 . . . . 0.0 110.575 175.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 920' ' ' ASP . . . . . 0.718 ' HB2' ' O ' ' A' ' 919' ' ' MET . 0.6 OUTLIER 153.0 -81.12 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.563 1.145 . . . . 0.0 110.097 174.355 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 921' ' ' SER . . . . . 0.743 ' HB2' HG23 ' A' ' 900' ' ' ILE . 0.0 OUTLIER -98.61 149.38 22.83 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.133 -174.188 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 922' ' ' CYS . . . . . 0.459 ' HA ' ' O ' ' A' ' 901' ' ' GLY . 10.2 m -130.82 119.46 22.28 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.045 0.45 . . . . 0.0 109.838 176.67 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 923' ' ' LEU . . . . . 0.579 ' HB2' ' HB ' ' A' ' 902' ' ' VAL . 68.3 mt -120.17 167.11 12.57 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.939 -174.759 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -89.29 147.06 24.32 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.143 175.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 925' ' ' LYS . . . . . 0.528 ' HB3' ' HD3' ' A' ' 926' ' ' PRO . 10.0 tttp -57.56 -49.05 95.99 Favored Pre-proline 0 CA--C 1.539 0.55 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 179.73 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 926' ' ' PRO . . . . . 0.528 ' HD3' ' HB3' ' A' ' 925' ' ' LYS . 11.5 Cg_exo -72.24 66.16 3.51 Favored 'Trans proline' 0 C--N 1.357 0.985 0 C-N-CA 122.245 1.963 . . . . 0.0 112.708 177.756 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 1.1 t -99.28 136.47 30.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.262 178.314 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -94.57 171.84 8.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.307 -178.179 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 929' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.43 -45.93 73.12 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 -177.105 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.8 -48.48 81.61 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.914 0.387 . . . . 0.0 110.287 -175.652 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 43.7 t -62.08 -52.39 60.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.42 179.009 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 932' ' ' ILE . . . . . 0.645 HG21 ' HG2' ' A' ' 843' ' ' GLN . 0.0 OUTLIER -63.13 -39.09 83.89 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 CA-C-O 120.647 0.261 . . . . 0.0 111.284 -175.412 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 933' ' ' LYS . . . . . 0.447 ' HE2' ' HB3' ' A' ' 933' ' ' LYS . 0.0 OUTLIER -67.26 -47.68 70.0 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-O 120.875 0.369 . . . . 0.0 110.305 -179.327 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 934' ' ' GLN . . . . . 0.604 ' O ' ' HB2' ' A' ' 938' ' ' LEU . 0.0 OUTLIER -65.62 -35.82 81.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.107 -178.455 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 935' ' ' THR . . . . . 0.502 ' N ' ' HG2' ' A' ' 934' ' ' GLN . 19.2 m -72.97 -43.86 61.75 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.621 0.248 . . . . 0.0 111.187 -179.486 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 936' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.19 -45.02 90.2 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.572 -0.285 . . . . 0.0 110.343 178.862 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 26.6 m -64.37 -40.75 96.45 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.829 178.049 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 938' ' ' LEU . . . . . 0.645 ' O ' ' HG2' ' A' ' 941' ' ' GLU . 1.4 tp -62.68 -42.38 99.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.063 179.155 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 939' ' ' TYR . . . . . 0.448 ' O ' HG13 ' A' ' 943' ' ' VAL . 2.3 m-85 -75.86 -27.09 57.66 Favored 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.974 -179.321 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -65.53 -32.65 74.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.172 0.511 . . . . 0.0 109.953 172.605 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 941' ' ' GLU . . . . . 0.645 ' HG2' ' O ' ' A' ' 938' ' ' LEU . 2.1 pt-20 -74.6 -31.46 62.03 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.161 175.621 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 942' ' ' ARG . . . . . 0.608 ' HG2' ' O ' ' A' ' 938' ' ' LEU . 4.6 mmt85 -65.34 -47.42 76.54 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-O 120.94 0.4 . . . . 0.0 110.278 177.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 943' ' ' VAL . . . . . 0.448 HG13 ' O ' ' A' ' 939' ' ' TYR . 5.1 m -69.01 -30.58 47.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.649 179.186 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.63 -41.76 83.38 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.422 177.042 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 2.0 pttt -74.36 -25.85 59.77 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.575 0.226 . . . . 0.0 110.906 -179.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 15.2 m -76.21 -34.93 59.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.225 0.536 . . . . 0.0 109.741 175.178 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -72.9 -22.92 60.67 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.315 176.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.267 177.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.064 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 80.69 -67.51 3.53 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.901 -0.666 . . . . 0.0 111.928 -178.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . 139.22 104.35 0.61 Allowed Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 121.045 -0.597 . . . . 0.0 112.015 -179.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.28 91.69 1.34 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.154 0.502 . . . . 0.0 111.096 -178.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . -127.08 119.27 3.23 Favored Glycine 0 N--CA 1.445 -0.735 0 C-N-CA 120.932 -0.652 . . . . 0.0 111.853 179.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . 0.509 ' HA ' ' OD1' ' A' ' 855' ' ' ASN . 1.5 m -115.32 145.12 21.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 120.935 0.397 . . . . 0.0 110.632 177.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -128.3 -87.01 0.56 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.055 178.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . 71.93 -116.54 6.02 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.132 179.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.551 HD22 HG12 ' A' ' 801' ' ' ILE . 0.4 OUTLIER -93.82 -30.94 14.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.889 0.376 . . . . 0.0 110.259 178.438 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.85 100.94 0.17 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.403 174.36 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 127.97 -6.72 6.87 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.971 -0.633 . . . . 0.0 111.751 -176.018 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 707' ' ' LYS . . . . . 0.412 ' HA ' ' HD2' ' A' ' 707' ' ' LYS . 2.9 mmmt -66.7 134.78 52.94 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 175.483 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 708' ' ' ARG . . . . . . . . . . . . . 10.5 mtt180 -102.7 146.25 28.49 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 121.473 0.654 . . . . 0.0 111.953 -171.291 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 709' ' ' CYS . . . . . 0.428 ' O ' ' HA ' ' A' ' 733' ' ' VAL . 61.8 m -134.86 119.73 18.46 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.986 -1.007 . . . . 0.0 109.019 174.146 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 710' ' ' TRP . . . . . 0.498 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 81.5 m95 -92.14 134.94 34.39 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 110.025 -0.361 . . . . 0.0 110.025 -177.288 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 711' ' ' LEU . . . . . 0.543 HD22 HG12 ' A' ' 733' ' ' VAL . 0.1 OUTLIER -126.16 125.55 42.67 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.611 0.72 . . . . 0.0 111.11 -177.958 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -120.9 65.59 0.86 Allowed 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.181 -0.918 . . . . 0.0 108.86 176.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 713' ' ' VAL . . . . . 0.829 HG13 ' HB3' ' A' ' 750' ' ' ASP . 21.1 t -114.76 113.54 43.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.348 -177.514 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 41.8 mtm180 -77.13 -23.61 51.71 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.186 0.517 . . . . 0.0 109.622 179.146 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -72.83 97.42 2.24 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.481 175.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -61.94 -31.52 71.85 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.897 -174.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.32 -48.25 78.83 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.136 0.493 . . . . 0.0 110.275 179.153 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 718' ' ' LEU . . . . . 0.502 HD12 ' HA ' ' A' ' 786' ' ' ALA . 1.4 tt -72.49 -42.53 64.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.496 178.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 719' ' ' CYS . . . . . 0.725 ' HB2' ' HB ' ' A' ' 713' ' ' VAL . 0.0 OUTLIER -58.93 -52.18 66.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.804 -177.852 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 720' ' ' GLN . . . . . 0.651 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 22.5 tt0 -62.23 -42.36 99.24 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.979 -179.124 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -59.39 -53.06 62.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.038 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 722' ' ' LEU . . . . . 0.432 ' HA ' HD22 ' A' ' 722' ' ' LEU . 0.3 OUTLIER -64.98 -44.76 88.23 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.253 -177.936 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 723' ' ' GLU . . . . . 0.651 ' HG2' ' HA ' ' A' ' 720' ' ' GLN . 2.0 pt-20 -64.55 -40.12 94.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.644 -174.535 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 724' ' ' THR . . . . . 0.526 ' N ' ' HG3' ' A' ' 723' ' ' GLU . 9.2 m -70.04 -38.61 75.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.853 0.358 . . . . 0.0 110.96 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 20.3 m -64.39 -38.28 90.47 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.507 -178.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 726' ' ' LEU . . . . . . . . . . . . . 5.4 mt -74.58 -36.34 63.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.055 0.455 . . . . 0.0 110.97 -178.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 727' ' ' GLN . . . . . 0.578 ' HG3' HG23 ' A' ' 733' ' ' VAL . 34.0 mt-30 -75.66 6.91 4.24 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.65 -178.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 8.3 mtm-85 -76.7 -16.51 59.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.881 0.372 . . . . 0.0 111.077 179.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 14.5 m -107.72 -99.68 0.36 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.759 177.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 730' ' ' GLY . . . . . . . . . . . . . . . -144.88 31.88 1.73 Allowed Glycine 0 N--CA 1.448 -0.514 0 N-CA-C 110.933 -0.867 . . . . 0.0 110.933 179.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 731' ' ' ILE . . . . . . . . . . . . . 26.6 mm -100.24 132.64 45.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.303 -0.448 . . . . 0.0 110.045 -176.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 732' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -100.72 105.4 17.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.094 0.473 . . . . 0.0 110.536 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 733' ' ' VAL . . . . . 0.578 HG23 ' HG3' ' A' ' 727' ' ' GLN . 4.5 t -84.08 126.9 40.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.624 177.121 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 734' ' ' THR . . . . . 0.434 ' HB ' ' CE3' ' A' ' 710' ' ' TRP . 0.2 OUTLIER -124.36 140.14 53.23 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.921 0.391 . . . . 0.0 111.131 -175.77 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 1.4 m -65.79 115.52 6.01 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.977 178.587 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 736' ' ' TYR . . . . . 0.498 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 70.3 t80 -89.57 114.08 25.59 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.474 -179.157 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -117.98 -49.77 2.5 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.475 178.169 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -157.32 38.86 0.55 Allowed Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.965 -0.636 . . . . 0.0 111.563 -179.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 15.5 mp0 -86.2 175.68 8.37 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.475 -0.362 . . . . 0.0 110.775 -177.022 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 740' ' ' GLU . . . . . 0.441 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 11.5 mt-10 -95.12 147.78 33.59 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.683 -178.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 741' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 740' ' ' GLU . 3.1 Cg_endo -84.77 122.45 2.66 Favored 'Trans proline' 0 N--CA 1.455 -0.774 0 C-N-CA 122.803 2.335 . . . . 0.0 112.471 -179.076 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 742' ' ' THR . . . . . 0.553 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.3 OUTLIER -103.32 138.11 19.45 Favored Pre-proline 0 C--N 1.322 -0.615 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.269 177.344 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 743' ' ' PRO . . . . . 0.553 ' HD2' HG22 ' A' ' 742' ' ' THR . 36.4 Cg_endo -66.02 -0.98 4.55 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.954 2.436 . . . . 0.0 113.131 -178.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -108.31 -6.51 16.26 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.088 0.47 . . . . 0.0 110.261 178.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 87.6 m-20 -108.49 157.66 18.25 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.596 -170.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 746' ' ' VAL . . . . . 0.512 HG11 HD11 ' A' ' 795' ' ' LEU . 1.3 p -123.71 137.35 57.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.484 -179.254 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 747' ' ' LEU . . . . . 0.484 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 0.6 OUTLIER -106.72 111.55 24.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.513 -179.43 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 2.9 mt -100.78 110.72 28.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 176.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 749' ' ' THR . . . . . 0.512 HG21 ' HB ' ' A' ' 753' ' ' VAL . 4.9 t -118.76 166.61 12.57 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.709 0.29 . . . . 0.0 111.012 -176.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 750' ' ' ASP . . . . . 0.829 ' HB3' HG13 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -111.74 136.89 50.39 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.589 177.663 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 751' ' ' GLU . . . . . 0.668 ' HG3' ' H ' ' A' ' 752' ' ' VAL . 3.0 tp10 66.51 174.74 0.24 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.917 -1.038 . . . . 0.0 111.433 -178.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 752' ' ' VAL . . . . . 0.668 ' H ' ' HG3' ' A' ' 751' ' ' GLU . 2.9 p -56.96 120.89 3.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 121.477 0.656 . . . . 0.0 111.233 -179.63 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 753' ' ' VAL . . . . . 0.512 ' HB ' HG21 ' A' ' 749' ' ' THR . 2.7 p -99.34 158.74 3.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.336 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -113.17 25.96 10.89 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.141 0.496 . . . . 0.0 110.5 -178.516 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 755' ' ' LYS . . . . . 0.403 ' H ' HG13 ' A' ' 753' ' ' VAL . 0.0 OUTLIER -120.67 169.29 10.52 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.1 -179.448 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -108.84 -39.69 5.26 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.723 -178.278 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 757' ' ' TRP . . . . . 0.484 ' CD2' ' HB2' ' A' ' 747' ' ' LEU . 76.6 t-105 61.9 85.09 0.13 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.51 0.672 . . . . 0.0 111.233 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 25.7 mm100 -78.01 67.4 3.85 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.1 176.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 759' ' ' GLY . . . . . 0.478 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -129.46 -147.12 6.23 Favored Glycine 0 N--CA 1.444 -0.801 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.291 -177.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.38 -47.22 20.4 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.717 0.294 . . . . 0.0 110.802 -179.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 761' ' ' ALA . . . . . 0.45 ' O ' ' HA ' ' A' ' 746' ' ' VAL . . . -166.75 158.56 13.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.689 -179.064 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 762' ' ' VAL . . . . . 0.817 HG13 ' HG2' ' A' ' 780' ' ' GLU . 1.5 p -131.69 137.37 55.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.53 175.258 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 77.7 t -115.96 121.82 68.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.04 -179.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 764' ' ' THR . . . . . 0.664 ' HB ' HG12 ' A' ' 782' ' ' VAL . 5.7 m -110.92 98.78 7.81 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.242 0.544 . . . . 0.0 111.468 -178.175 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 765' ' ' PHE . . . . . 0.417 ' CD1' HD11 ' A' ' 718' ' ' LEU . 20.6 m-85 -76.83 119.73 21.0 Favored 'General case' 0 C--O 1.221 -0.398 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 174.004 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -94.13 133.82 37.21 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 120.355 -0.538 . . . . 0.0 110.879 -174.103 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 767' ' ' ARG . . . . . 0.577 ' NE ' ' HA ' ' A' ' 767' ' ' ARG . 0.1 OUTLIER -110.08 -36.43 5.85 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.711 -179.374 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.37 -58.13 0.26 Allowed 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.76 0.281 . . . . 0.0 111.76 177.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 34.1 m170 -114.1 146.32 40.43 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 121.752 0.787 . . . . 0.0 112.514 -172.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 770' ' ' ILE . . . . . 0.69 HG22 ' H ' ' A' ' 771' ' ' GLY . 0.6 OUTLIER -110.37 -179.47 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.688 0 CA-C-N 114.448 -1.251 . . . . 0.0 109.644 -179.123 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 771' ' ' GLY . . . . . 0.69 ' H ' HG22 ' A' ' 770' ' ' ILE . . . 170.29 -33.56 0.16 Allowed Glycine 0 N--CA 1.451 -0.346 0 N-CA-C 110.668 -0.973 . . . . 0.0 110.668 -178.252 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 772' ' ' ILE . . . . . 1.051 HG13 ' HD2' ' A' ' 773' ' ' PRO . 1.2 tp -80.64 148.4 65.56 Favored Pre-proline 0 C--N 1.32 -0.685 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 171.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 773' ' ' PRO . . . . . 1.051 ' HD2' HG13 ' A' ' 772' ' ' ILE . 33.4 Cg_endo -65.45 -108.33 0.0 OUTLIER 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 122.652 2.235 . . . . 0.0 113.829 -179.433 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . 0.537 ' HG ' ' H ' ' A' ' 776' ' ' LYS . 1.0 OUTLIER 174.36 -154.75 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 -177.365 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 775' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -60.3 -0.01 0.21 Allowed 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . 0.537 ' H ' ' HG ' ' A' ' 774' ' ' LEU . 0.0 OUTLIER -75.01 -11.51 60.12 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 121.334 0.588 . . . . 0.0 109.829 171.487 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 777' ' ' ALA . . . . . 0.452 ' HB1' ' HD2' ' A' ' 778' ' ' PRO . . . -102.91 158.76 31.13 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.597 176.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 778' ' ' PRO . . . . . 0.452 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 54.7 Cg_endo -70.35 63.09 2.13 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.974 2.449 . . . . 0.0 113.445 -177.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 116.09 49.24 0.46 Allowed Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.807 176.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 780' ' ' GLU . . . . . 0.817 ' HG2' HG13 ' A' ' 762' ' ' VAL . 0.7 OUTLIER -130.78 140.06 50.26 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 177.165 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 45.5 m95 -141.47 112.64 7.41 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 110.487 -0.19 . . . . 0.0 110.487 -178.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . 0.664 HG12 ' HB ' ' A' ' 764' ' ' THR . 31.2 m -106.67 143.84 16.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-O 121.151 0.501 . . . . 0.0 111.063 179.138 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 783' ' ' HIS . . . . . . . . . . . . . 7.5 t-160 -165.47 121.38 1.36 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.189 174.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.45 100.74 9.46 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.106 176.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 785' ' ' VAL . . . . . 0.424 ' HB ' ' HD3' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -154.94 176.54 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.0 -0.545 . . . . 0.0 109.69 179.941 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 786' ' ' ALA . . . . . 0.502 ' HA ' HD12 ' A' ' 718' ' ' LEU . . . -115.87 39.92 2.92 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.515 178.518 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 787' ' ' ALA . . . . . 0.414 ' HB2' ' HG ' ' A' ' 718' ' ' LEU . . . 62.91 69.99 0.8 Allowed Pre-proline 0 CA--C 1.529 0.156 0 CA-C-N 115.795 -0.638 . . . . 0.0 111.595 178.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 788' ' ' PRO . . . . . 0.678 ' HD2' ' OE1' ' A' ' 790' ' ' GLU . 12.1 Cg_exo -70.18 -66.54 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.772 2.315 . . . . 0.0 111.529 175.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 789' ' ' HIS . . . . . 0.438 ' CE1' ' HA ' ' A' ' 808' ' ' PRO . 1.8 p80 177.08 -3.96 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.214 178.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 790' ' ' GLU . . . . . 0.678 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -84.38 -48.68 9.42 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.803 0.297 . . . . 0.0 111.803 -172.065 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 791' ' ' LEU . . . . . 0.568 ' N ' ' HD2' ' A' ' 792' ' ' PRO . 1.1 mt -70.43 -42.84 16.02 Favored Pre-proline 0 C--N 1.326 -0.438 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -177.187 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 792' ' ' PRO . . . . . 0.568 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 8.8 Cg_endo -54.23 -36.85 87.38 Favored 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 121.653 1.569 . . . . 0.0 111.713 170.83 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -69.84 -37.21 76.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.612 177.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -61.59 -39.02 89.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.104 176.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 795' ' ' LEU . . . . . 0.512 HD11 HG11 ' A' ' 746' ' ' VAL . 0.2 OUTLIER -63.23 -43.76 97.15 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.995 0.426 . . . . 0.0 110.658 178.531 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -66.63 -30.96 71.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.628 178.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.3 -44.24 65.55 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.753 178.384 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -65.55 -31.11 52.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.968 -179.078 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 799' ' ' TYR . . . . . 0.414 ' HD1' ' HA ' ' A' ' 799' ' ' TYR . 0.2 OUTLIER -83.7 -27.6 28.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.418 177.189 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 69.59 45.29 0.81 Allowed 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.169 179.454 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 801' ' ' ILE . . . . . 0.551 HG12 HD22 ' A' ' 704' ' ' LEU . 0.5 OUTLIER -85.37 -54.31 8.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 174.552 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 50.91 47.41 24.78 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 114.877 -1.056 . . . . 0.0 111.732 177.208 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 803' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.01 -30.68 17.61 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.078 0.466 . . . . 0.0 110.536 179.011 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 804' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -101.35 116.61 33.19 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.189 179.114 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.05 76.51 9.79 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.012 0.434 . . . . 0.0 110.409 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -79.47 -28.58 41.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.048 -177.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 26.2 t0 61.74 78.57 0.3 Allowed Pre-proline 0 N--CA 1.465 0.276 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.733 -172.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 808' ' ' PRO . . . . . 0.438 ' HA ' ' CE1' ' A' ' 789' ' ' HIS . 22.1 Cg_exo -64.78 -43.07 13.39 Favored 'Trans proline' 0 C--O 1.233 0.25 0 C-N-CA 122.915 2.41 . . . . 0.0 113.053 -175.298 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . 51.47 -120.07 1.56 Allowed 'General case' 0 CA--C 1.529 0.158 0 O-C-N 123.435 0.459 . . . . 0.0 110.313 -173.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 36.5 t-20 -167.83 135.53 2.3 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 174.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -78.3 -32.59 49.47 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.926 -178.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 812' ' ' LEU . . . . . 0.493 ' HA ' ' HD3' ' A' ' 813' ' ' PRO . 0.2 OUTLIER -160.28 135.57 5.78 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.292 -179.309 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 813' ' ' PRO . . . . . 0.493 ' HD3' ' HA ' ' A' ' 812' ' ' LEU . 6.4 Cg_exo -73.47 70.48 4.03 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 123.075 2.517 . . . . 0.0 111.52 177.791 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.32 -51.27 70.51 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.726 -175.654 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -140.5 138.6 34.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.86 -179.487 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -74.89 112.72 11.4 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 177.128 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -98.33 121.26 40.04 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.958 0.409 . . . . 0.0 110.797 -177.758 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -78.61 123.03 26.68 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.24 176.369 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 21.2 t -96.86 94.49 4.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 121.262 0.553 . . . . 0.0 110.787 -178.184 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -109.55 103.89 12.84 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.459 177.436 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -120.75 134.78 55.27 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.903 0.382 . . . . 0.0 110.397 -179.56 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -166.61 -42.38 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.127 177.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -88.45 70.04 8.99 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.223 176.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -132.07 74.86 1.61 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.721 -176.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 825' ' ' MET . . . . . 0.411 ' HG2' HD11 ' A' ' 827' ' ' ILE . 3.2 ttm -96.23 108.14 20.57 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.594 175.504 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 826' ' ' MET . . . . . 0.598 ' HG2' HG13 ' A' ' 869' ' ' ILE . 2.3 tpp -100.16 118.27 36.15 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.794 -178.509 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 827' ' ' ILE . . . . . 0.579 HG23 ' HB ' ' A' ' 871' ' ' ILE . 4.8 mm -108.58 128.79 63.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.657 178.129 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 828' ' ' LEU . . . . . 0.572 ' HB2' HG12 ' A' ' 869' ' ' ILE . 0.5 OUTLIER -105.41 128.76 53.69 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.424 -177.892 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 829' ' ' VAL . . . . . 0.63 ' HB ' HD12 ' A' ' 873' ' ' LEU . 1.2 p -114.77 114.87 47.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 121.084 0.469 . . . . 0.0 110.532 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 830' ' ' VAL . . . . . 0.482 HG22 ' HB3' ' A' ' 854' ' ' ALA . 80.3 t -109.23 105.45 18.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.918 177.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 831' ' ' ASP . . . . . 0.886 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 33.3 t0 -117.55 137.41 52.59 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.739 -177.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.05 -21.95 60.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.666 178.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 1.2 m170 -111.48 106.82 57.02 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.581 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -49.29 -44.57 33.46 Favored 'Trans proline' 0 CA--C 1.533 0.463 0 C-N-CA 123.965 3.11 . . . . 0.0 114.672 -174.047 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 835' ' ' ILE . . . . . 0.406 ' O ' ' HG3' ' A' ' 838' ' ' ARG . 0.4 OUTLIER -65.39 -36.21 77.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.862 0.363 . . . . 0.0 111.081 -178.253 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 836' ' ' ASN . . . . . 0.534 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 5.0 m120 -75.33 -35.47 61.21 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 178.186 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 837' ' ' ARG . . . . . 0.886 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 1.3 ttp180 -53.36 -45.91 69.35 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.427 175.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 838' ' ' ARG . . . . . 0.406 ' HG3' ' O ' ' A' ' 835' ' ' ILE . 1.2 ppt_? -72.03 -28.75 63.57 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.982 178.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.99 -53.21 27.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.53 -0.304 . . . . 0.0 111.807 -177.093 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 840' ' ' LEU . . . . . 0.538 HD12 HG21 ' A' ' 829' ' ' VAL . 0.0 OUTLIER -72.24 -27.69 62.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.944 0.402 . . . . 0.0 109.963 -179.997 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -64.63 -35.53 81.31 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.079 174.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -64.8 -43.94 91.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.211 176.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 843' ' ' GLN . . . . . 0.476 ' O ' HD22 ' A' ' 847' ' ' LEU . 0.9 OUTLIER -58.11 -46.45 85.54 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.128 176.526 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 844' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.5 -42.62 96.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.071 178.177 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -68.04 -22.36 74.12 Favored Glycine 0 N--CA 1.45 -0.369 0 CA-C-N 116.05 -0.523 . . . . 0.0 112.282 178.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 35.8 m -75.32 -30.34 60.29 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.515 -0.18 . . . . 0.0 110.515 177.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 847' ' ' LEU . . . . . 0.476 HD22 ' O ' ' A' ' 843' ' ' GLN . 0.1 OUTLIER -68.52 -44.51 74.45 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 120.911 0.386 . . . . 0.0 110.168 173.41 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 105.19 59.56 0.65 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.79 -0.719 . . . . 0.0 113.35 174.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -143.45 -178.59 5.95 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 122.781 -0.246 . . . . 0.0 110.348 177.51 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -74.86 122.26 23.11 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 -177.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -122.47 120.55 34.24 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.516 -177.056 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 852' ' ' LYS . . . . . 0.458 ' HB3' HD12 ' A' ' 828' ' ' LEU . 0.0 OUTLIER -110.85 115.26 29.23 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.405 178.84 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.78 114.84 26.61 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.026 -177.344 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 854' ' ' ALA . . . . . 0.482 ' HB3' HG22 ' A' ' 830' ' ' VAL . . . -132.42 171.81 13.27 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.112 0.482 . . . . 0.0 111.629 -179.391 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 855' ' ' ASN . . . . . 0.509 ' OD1' ' HA ' ' A' ' 701' ' ' VAL . 6.3 t-20 -160.8 97.53 1.18 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.305 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 856' ' ' ASP . . . . . 0.478 ' HB2' ' O ' ' A' ' 855' ' ' ASN . 48.8 t0 170.06 156.28 0.06 Allowed 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.293 179.354 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -88.61 -49.36 3.66 Favored Glycine 0 N--CA 1.447 -0.606 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.071 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -74.27 -34.83 38.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 O-C-N 122.773 -0.251 . . . . 0.0 111.138 -178.144 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 859' ' ' ASP . . . . . 0.453 ' HB2' ' OD2' ' A' ' 856' ' ' ASP . 3.7 t0 -69.05 -19.12 64.09 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 111.925 0.343 . . . . 0.0 111.925 -178.163 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -64.78 -53.02 53.58 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.5 0.666 . . . . 0.0 109.582 173.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 861' ' ' LEU . . . . . 0.849 HD13 ' HA ' ' A' ' 890' ' ' ILE . 9.6 tp -61.15 -41.54 96.94 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.481 -0.782 . . . . 0.0 109.731 175.183 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 862' ' ' ASN . . . . . 0.425 ' HB3' ' HA ' ' A' ' 859' ' ' ASP . 48.2 t30 -60.03 -29.23 68.36 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.742 -1.117 . . . . 0.0 110.834 178.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 863' ' ' VAL . . . . . 0.629 HG13 HD13 ' A' ' 869' ' ' ILE . 0.5 OUTLIER -72.92 -34.62 46.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.621 -179.211 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 864' ' ' LEU . . . . . 0.471 HD22 HD21 ' A' ' 897' ' ' LEU . 6.3 mt -64.71 -33.33 75.71 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.224 0.535 . . . . 0.0 109.774 175.305 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -78.14 -24.88 47.2 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.875 178.199 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 9.0 mtmt -77.93 -48.55 16.07 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.93 -178.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 2.1 p30 -156.72 176.55 12.59 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.21 -177.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 79.2 t60 -91.31 97.3 11.02 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.109 0.481 . . . . 0.0 112.01 -174.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 869' ' ' ILE . . . . . 0.629 HD13 HG13 ' A' ' 863' ' ' VAL . 0.7 OUTLIER -94.31 133.65 34.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 166.806 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 870' ' ' ASP . . . . . 0.408 ' O ' ' HB2' ' A' ' 897' ' ' LEU . 1.8 m-20 -86.37 -43.99 12.41 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.71 0.29 . . . . 0.0 111.143 -174.366 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 871' ' ' ILE . . . . . 0.579 ' HB ' HG23 ' A' ' 827' ' ' ILE . 43.2 mm -122.59 126.31 73.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.217 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 872' ' ' VAL . . . . . 0.437 HG21 HD21 ' A' ' 864' ' ' LEU . 3.6 t -106.46 122.48 60.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 120.683 0.278 . . . . 0.0 110.334 178.343 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 873' ' ' LEU . . . . . 0.63 HD12 ' HB ' ' A' ' 829' ' ' VAL . 0.1 OUTLIER -104.86 121.55 43.91 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.114 177.113 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -109.45 106.34 16.05 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 177.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 875' ' ' ASP . . . . . 0.468 ' OD1' ' HG2' ' A' ' 925' ' ' LYS . 7.0 t0 -106.13 119.92 40.46 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.491 -175.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 10.5 t -126.26 119.87 55.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.213 -176.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 877' ' ' ASN . . . . . 0.722 ' HB2' ' HE2' ' A' ' 925' ' ' LYS . 0.1 OUTLIER -109.78 -36.35 5.94 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.156 175.186 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 878' ' ' MET . . . . . 0.444 ' HA ' ' HD3' ' A' ' 879' ' ' PRO . 1.5 mmm -121.27 131.74 24.39 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-O 121.017 0.437 . . . . 0.0 111.308 -178.384 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 879' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' ' 878' ' ' MET . 4.5 Cg_exo -80.06 64.93 8.92 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 123.122 2.548 . . . . 0.0 111.986 178.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -81.91 -10.39 59.3 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.82 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 881' ' ' MET . . . . . 0.428 ' HG3' ' N ' ' A' ' 882' ' ' ASP . 0.0 OUTLIER -153.21 143.98 22.76 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.605 -175.483 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 882' ' ' ASP . . . . . 0.428 ' N ' ' HG3' ' A' ' 881' ' ' MET . 0.9 OUTLIER -65.25 132.64 49.59 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.458 177.506 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -104.11 2.12 44.09 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.46 -0.876 . . . . 0.0 113.711 -172.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -70.88 -43.04 69.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.442 0.639 . . . . 0.0 109.479 -177.609 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 885' ' ' ARG . . . . . 0.464 ' HG2' ' HG3' ' A' ' 889' ' ' ARG . 0.0 OUTLIER -58.21 -32.97 68.78 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.325 177.1 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.75 -56.22 19.51 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.909 -176.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 887' ' ' THR . . . . . 0.405 ' O ' HG22 ' A' ' 890' ' ' ILE . 0.1 OUTLIER -65.83 -44.32 85.89 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.434 -176.741 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 6.3 tp60 -61.24 -50.36 73.38 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.184 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 889' ' ' ARG . . . . . 0.464 ' HG3' ' HG2' ' A' ' 885' ' ' ARG . 2.9 mtt180 -66.51 -41.45 88.82 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.436 -176.196 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 890' ' ' ILE . . . . . 0.849 ' HA ' HD13 ' A' ' 861' ' ' LEU . 10.5 tt -64.53 -41.71 93.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 C-N-CA 121.159 -0.216 . . . . 0.0 111.398 -176.305 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 891' ' ' ARG . . . . . 0.973 ' HA ' ' HB2' ' A' ' 895' ' ' LEU . 10.5 ptt85 -76.35 -32.32 58.57 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.671 179.001 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -70.02 -45.58 66.91 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.319 -176.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 893' ' ' LEU . . . . . 0.781 HD12 HD21 ' A' ' 861' ' ' LEU . 3.9 mt -75.06 -26.91 59.72 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.865 0.321 . . . . 0.0 111.865 -175.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 146.48 71.88 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.027 -1.082 . . . . 0.0 113.47 175.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 895' ' ' LEU . . . . . 0.973 ' HB2' ' HA ' ' A' ' 891' ' ' ARG . 0.5 OUTLIER -85.22 127.87 34.46 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 173.977 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -129.38 -9.29 4.67 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.126 0.489 . . . . 0.0 111.367 -177.727 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 897' ' ' LEU . . . . . 0.471 HD21 HD22 ' A' ' 864' ' ' LEU . 0.4 OUTLIER -122.89 157.98 58.57 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.832 -172.368 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -71.33 140.14 36.34 Favored 'Trans proline' 0 C--O 1.241 0.643 0 C-N-CA 123.069 2.513 . . . . 0.0 112.718 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 899' ' ' VAL . . . . . 0.926 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 43.3 t -114.53 132.98 62.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.733 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 900' ' ' ILE . . . . . 0.446 HG12 ' HB2' ' A' ' 921' ' ' SER . 89.6 mt -103.5 114.33 42.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.955 175.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 901' ' ' GLY . . . . . 0.53 ' O ' ' HA ' ' A' ' 922' ' ' CYS . . . -94.17 109.75 3.87 Favored Glycine 0 N--CA 1.443 -0.866 0 C-N-CA 120.738 -0.744 . . . . 0.0 111.518 177.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 902' ' ' VAL . . . . . 0.812 ' HB ' HD12 ' A' ' 923' ' ' LEU . 0.1 OUTLIER -108.6 118.76 56.88 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 177.707 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.95 154.06 48.53 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.859 -171.258 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -83.0 105.76 14.26 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.018 174.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 69.07 104.08 0.06 Allowed 'General case' 0 N--CA 1.467 0.409 0 O-C-N 123.803 0.689 . . . . 0.0 110.944 179.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -81.13 53.25 1.96 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.747 -175.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 1.3 mt -80.79 -58.91 2.88 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.006 0.431 . . . . 0.0 110.368 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -94.0 -19.49 20.84 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.374 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.56 -54.03 50.62 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.158 -178.172 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 910' ' ' GLU . . . . . 0.465 ' HA ' ' NH1' ' A' ' 913' ' ' ARG . 9.8 tp10 -50.85 -46.44 60.15 Favored 'General case' 0 N--CA 1.463 0.189 0 O-C-N 123.581 0.551 . . . . 0.0 111.453 -176.172 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 10.1 tmtt? -64.77 -52.49 56.64 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.399 -176.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -69.61 -43.94 71.73 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 111.699 0.259 . . . . 0.0 111.699 -174.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 913' ' ' ARG . . . . . 0.465 ' NH1' ' HA ' ' A' ' 910' ' ' GLU . 0.1 OUTLIER -65.98 -27.26 68.0 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 121.184 -0.206 . . . . 0.0 111.135 -176.9 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 78.3 m -74.63 -39.8 61.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.77 0.319 . . . . 0.0 110.377 175.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.61 -42.92 95.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.612 179.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -72.72 -42.71 63.86 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.804 179.173 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 50.7 50.0 19.81 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.807 -176.339 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -123.56 16.45 7.94 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.218 -178.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 919' ' ' MET . . . . . 0.926 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -113.77 -113.18 0.34 Allowed 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 179.221 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 920' ' ' ASP . . . . . 0.608 ' HB2' ' O ' ' A' ' 919' ' ' MET . 5.3 t70 164.52 -58.48 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.482 0 O-C-N 124.199 0.937 . . . . 0.0 109.89 174.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . 0.446 ' HB2' HG12 ' A' ' 900' ' ' ILE . 57.9 m -113.87 164.59 13.56 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.035 177.805 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 922' ' ' CYS . . . . . 0.53 ' HA ' ' O ' ' A' ' 901' ' ' GLY . 0.1 OUTLIER -148.78 140.13 23.3 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.513 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 923' ' ' LEU . . . . . 0.812 HD12 ' HB ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -147.68 177.86 8.95 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.773 0.321 . . . . 0.0 110.439 178.184 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.87 146.18 24.61 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.991 -178.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 925' ' ' LYS . . . . . 0.722 ' HE2' ' HB2' ' A' ' 877' ' ' ASN . 3.7 tmtm? -45.73 -51.62 28.45 Favored Pre-proline 0 N--CA 1.47 0.572 0 O-C-N 123.67 0.606 . . . . 0.0 112.308 177.375 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -72.1 64.61 3.41 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 121.742 1.628 . . . . 0.0 112.169 175.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 2.1 p -71.65 148.94 9.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.043 0.449 . . . . 0.0 110.633 179.199 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.82 160.25 14.76 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.552 179.298 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 929' ' ' LEU . . . . . 0.431 HD23 ' HA ' ' A' ' 929' ' ' LEU . 0.0 OUTLIER -56.67 -45.36 81.74 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.107 -179.14 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -65.99 -44.61 84.34 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.824 0.345 . . . . 0.0 110.692 -176.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 931' ' ' VAL . . . . . 0.458 ' O ' ' HG3' ' A' ' 934' ' ' GLN . 74.4 t -63.65 -42.94 97.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.785 -178.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 932' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -66.7 -33.9 66.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.444 178.43 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.84 -48.67 58.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.002 -178.763 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 934' ' ' GLN . . . . . 0.458 ' HG3' ' O ' ' A' ' 931' ' ' VAL . 0.6 OUTLIER -65.7 -40.97 92.82 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 121.132 -0.227 . . . . 0.0 111.161 -177.573 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 12.4 m -64.41 -43.77 93.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.731 0.301 . . . . 0.0 111.087 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 936' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.78 -41.94 91.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.856 178.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 39.6 m -65.43 -44.46 87.29 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.229 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.15 -40.34 89.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.081 0.467 . . . . 0.0 110.503 178.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 939' ' ' TYR . . . . . 0.488 ' HD1' ' HA ' ' A' ' 939' ' ' TYR . 0.5 OUTLIER -72.85 -36.3 67.4 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.879 -178.902 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -62.15 -39.07 91.4 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.068 0.461 . . . . 0.0 110.905 177.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 941' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.31 -24.11 43.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.349 178.319 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 942' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.6 -47.75 68.8 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.418 178.512 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 943' ' ' VAL . . . . . 0.432 HG22 ' O ' ' A' ' 939' ' ' TYR . 5.8 m -69.51 -28.76 39.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.042 176.582 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -58.57 -33.52 70.05 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.195 173.763 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 3.3 mmtp -69.1 -48.77 61.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.842 177.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.1 -42.39 72.76 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.835 -0.62 . . . . 0.0 112.658 -175.174 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 11.1 mtm-85 -89.18 -33.74 16.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.755 0.312 . . . . 0.0 111.202 -175.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 1.2 t0 59.54 -168.4 0.15 Allowed 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.369 -177.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.795 -0.621 . . . . 0.0 110.057 178.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 3.1 ttp . . . . . 0 N--CA 1.48 1.031 0 CA-C-O 120.642 0.258 . . . . 0.0 110.506 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . -155.47 99.47 0.19 Allowed Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 121.158 -0.544 . . . . 0.0 112.009 177.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . 176.64 91.73 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 121.031 -0.604 . . . . 0.0 111.694 -179.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.87 -73.33 0.45 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.587 0.232 . . . . 0.0 111.104 -175.787 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . 93.06 -40.34 2.84 Favored Glycine 0 CA--C 1.519 0.309 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.621 -178.336 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 2.0 t 57.12 26.92 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 123.007 0.523 . . . . 0.0 111.554 177.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 702' ' ' GLU . . . . . 0.627 ' HA ' ' HB2' ' A' ' 796' ' ' ALA . 0.0 OUTLIER 54.97 31.31 15.74 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.515 -176.147 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . 130.18 146.57 6.0 Favored Glycine 0 N--CA 1.442 -0.956 0 C-N-CA 120.855 -0.688 . . . . 0.0 111.884 178.414 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.783 ' HB2' HD12 ' A' ' 801' ' ' ILE . 2.8 mm? -117.06 -141.37 0.37 Allowed 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 179.391 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -127.03 139.27 53.14 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.547 0.213 . . . . 0.0 111.034 179.224 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 80.99 45.84 7.41 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.848 -0.691 . . . . 0.0 113.473 173.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 4.4 tptt -145.59 153.74 41.39 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 176.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 708' ' ' ARG . . . . . 0.703 ' HG2' HG13 ' A' ' 732' ' ' VAL . 0.0 OUTLIER -118.59 156.39 29.26 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.216 0.532 . . . . 0.0 111.849 -172.716 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 709' ' ' CYS . . . . . 0.459 ' SG ' HD13 ' A' ' 726' ' ' LEU . 0.5 OUTLIER -142.19 145.25 33.95 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.794 173.741 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 710' ' ' TRP . . . . . . . . . . . . . 66.4 m95 -114.26 131.99 56.3 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 177.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 711' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -122.86 131.31 53.69 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.476 0.655 . . . . 0.0 111.658 -175.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -126.81 65.56 1.27 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.816 -1.084 . . . . 0.0 109.128 174.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 713' ' ' VAL . . . . . 0.865 ' HA ' ' HB2' ' A' ' 750' ' ' ASP . 13.4 t -113.1 134.3 56.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.681 -175.085 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -100.97 -27.6 13.2 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.68 -174.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 -74.57 124.97 27.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.942 173.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -70.37 -40.26 74.12 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.173 -173.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.66 -41.49 95.14 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.164 0.507 . . . . 0.0 110.479 178.63 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 718' ' ' LEU . . . . . 0.673 HD11 ' HD2' ' A' ' 765' ' ' PHE . 0.4 OUTLIER -71.87 -49.37 38.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.704 -179.41 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 719' ' ' CYS . . . . . 0.673 ' HB2' ' HB ' ' A' ' 713' ' ' VAL . 0.0 OUTLIER -60.25 -52.21 66.24 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.824 -177.752 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 720' ' ' GLN . . . . . 0.694 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 0.1 OUTLIER -63.49 -40.29 96.7 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -175.957 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -64.11 -43.48 95.22 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.808 0.337 . . . . 0.0 110.58 -179.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.4 -48.41 64.75 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.789 -179.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 723' ' ' GLU . . . . . 0.694 ' HG2' ' HA ' ' A' ' 720' ' ' GLN . 1.5 pt-20 -63.05 -42.49 99.74 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.379 -176.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 724' ' ' THR . . . . . 0.582 ' N ' ' HG3' ' A' ' 723' ' ' GLU . 20.1 m -70.84 -34.18 71.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.445 0.164 . . . . 0.0 111.359 -178.059 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 72.6 m -68.87 -37.76 79.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.775 0.321 . . . . 0.0 110.927 179.329 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 726' ' ' LEU . . . . . 0.524 HD21 HD12 ' A' ' 795' ' ' LEU . 14.1 mt -73.41 -42.49 62.02 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.081 0.467 . . . . 0.0 110.493 179.333 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -75.77 10.08 1.99 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.532 178.129 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.81 -35.14 64.85 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.809 0.338 . . . . 0.0 110.183 179.069 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 13.1 m -100.25 -94.22 0.27 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.677 177.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 730' ' ' GLY . . . . . . . . . . . . . . . -152.28 38.21 0.78 Allowed Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 111.336 -0.705 . . . . 0.0 111.336 -179.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 731' ' ' ILE . . . . . 0.619 HD11 ' H ' ' A' ' 704' ' ' LEU . 42.9 mm -101.42 128.31 53.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 178.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 732' ' ' VAL . . . . . 0.703 HG13 ' HG2' ' A' ' 708' ' ' ARG . 0.9 OUTLIER -98.02 114.73 36.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.368 0.604 . . . . 0.0 110.84 -176.403 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 733' ' ' VAL . . . . . . . . . . . . . 5.2 p -98.22 147.79 6.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.023 177.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 22.3 m -141.67 137.3 31.67 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.849 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -54.9 125.34 19.83 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.727 174.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 736' ' ' TYR . . . . . 0.414 ' CE2' ' HD3' ' A' ' 755' ' ' LYS . 21.8 t80 -74.74 83.76 2.12 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.172 0.51 . . . . 0.0 111.059 -179.294 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -70.24 -60.46 2.27 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.133 175.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 179.99 49.02 0.08 OUTLIER Glycine 0 N--CA 1.445 -0.734 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.513 179.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.89 147.07 23.97 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.86 0.362 . . . . 0.0 110.278 -178.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 34.7 mp0 -68.63 143.93 95.63 Favored Pre-proline 0 C--N 1.32 -0.71 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.765 -178.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 741' ' ' PRO . . . . . 0.483 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 40.4 Cg_endo -66.14 135.0 38.7 Favored 'Trans proline' 0 C--O 1.234 0.305 0 C-N-CA 122.931 2.421 . . . . 0.0 113.417 -176.429 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 742' ' ' THR . . . . . 0.547 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.0 OUTLIER -117.92 139.59 26.69 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.416 177.491 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 743' ' ' PRO . . . . . 0.578 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 33.5 Cg_endo -64.15 -17.12 58.55 Favored 'Trans proline' 0 N--CA 1.476 0.481 0 C-N-CA 123.042 2.495 . . . . 0.0 113.633 -176.076 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 744' ' ' GLU . . . . . 0.407 ' HG2' ' CG ' ' A' ' 834' ' ' PRO . 0.9 OUTLIER -97.97 -2.89 39.44 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.915 0.388 . . . . 0.0 110.645 179.492 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -109.56 155.28 21.59 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.232 -170.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 746' ' ' VAL . . . . . 0.883 HG21 HD11 ' A' ' 795' ' ' LEU . 17.3 m -120.09 148.16 23.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.518 -0.764 . . . . 0.0 110.878 -178.266 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 747' ' ' LEU . . . . . 0.501 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 0.2 OUTLIER -117.73 106.03 12.62 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.142 178.296 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 10.4 mt -95.28 108.84 21.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 177.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -114.31 147.38 39.18 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.168 0.509 . . . . 0.0 111.625 -171.433 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 750' ' ' ASP . . . . . 0.865 ' HB2' ' HA ' ' A' ' 713' ' ' VAL . 31.0 t0 -98.1 121.75 40.4 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.427 179.573 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 751' ' ' GLU . . . . . 0.408 ' HA ' ' HB3' ' A' ' 766' ' ' CYS . 1.0 OUTLIER 57.1 -150.54 0.44 Allowed 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.063 -176.677 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 752' ' ' VAL . . . . . 0.641 HG13 HG13 ' A' ' 772' ' ' ILE . 6.6 t -97.61 106.21 18.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 O-C-N 122.015 -0.428 . . . . 0.0 112.13 -173.571 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 2.1 t -103.42 -8.12 9.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.433 169.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 3.9 m 52.59 45.48 28.54 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.82 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 755' ' ' LYS . . . . . 0.414 ' HD3' ' CE2' ' A' ' 736' ' ' TYR . 0.0 OUTLIER -96.13 116.83 29.58 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.254 177.547 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 756' ' ' LYS . . . . . 0.458 ' HD3' ' HA ' ' A' ' 756' ' ' LYS . 1.8 mmpt? -81.98 81.78 7.83 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.445 0.641 . . . . 0.0 109.801 176.213 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 757' ' ' TRP . . . . . 0.623 ' HB3' ' HB ' ' A' ' 762' ' ' VAL . 74.2 t-105 -72.03 103.46 3.26 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.222 -177.469 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.62 87.94 7.53 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 175.514 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 759' ' ' GLY . . . . . 0.578 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -161.91 -139.18 2.58 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.159 -179.017 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 14.8 ttt85 -70.04 -59.49 2.88 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.809 0.338 . . . . 0.0 110.455 -179.308 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -163.86 144.43 8.57 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.264 -178.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 762' ' ' VAL . . . . . 0.623 ' HB ' ' HB3' ' A' ' 757' ' ' TRP . 2.0 p -118.66 119.53 61.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.519 174.671 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 763' ' ' VAL . . . . . 0.643 HG11 HD21 ' A' ' 791' ' ' LEU . 45.6 t -107.88 108.34 25.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.642 -178.475 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 764' ' ' THR . . . . . 0.825 ' HB ' HG12 ' A' ' 782' ' ' VAL . 84.9 m -96.89 116.35 29.03 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.511 179.113 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 765' ' ' PHE . . . . . 0.673 ' HD2' HD11 ' A' ' 718' ' ' LEU . 1.6 m-30 -99.74 93.7 5.95 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 177.343 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 766' ' ' CYS . . . . . 0.408 ' HB3' ' HA ' ' A' ' 751' ' ' GLU . 1.3 p -118.67 132.51 56.17 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.679 -177.271 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 767' ' ' ARG . . . . . 0.823 ' HA ' ' HB3' ' A' ' 784' ' ' SER . 0.4 OUTLIER -109.46 -58.94 1.97 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.753 0.311 . . . . 0.0 110.945 -173.278 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -102.33 -25.87 13.5 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.195 -178.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -109.59 92.77 4.18 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.034 0.445 . . . . 0.0 110.079 179.607 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 3.1 mp -101.09 109.08 24.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.607 -179.065 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -133.44 -9.92 1.98 Allowed Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.927 -179.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 772' ' ' ILE . . . . . 0.641 HG13 HG13 ' A' ' 752' ' ' VAL . 14.2 mt -104.84 138.39 19.49 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.741 0.27 . . . . 0.0 110.379 -178.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 773' ' ' PRO . . . . . 0.486 ' HD3' ' HA ' ' A' ' 772' ' ' ILE . 14.6 Cg_exo -69.14 162.81 40.23 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 123.315 2.677 . . . . 0.0 112.725 -179.854 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . 0.504 ' CB ' HG22 ' A' ' 782' ' ' VAL . 0.7 OUTLIER -98.89 -156.29 0.54 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.97 -178.399 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 775' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 1.4 mp0 -61.42 72.43 0.01 OUTLIER 'General case' 0 C--O 1.234 0.251 0 CA-C-O 122.161 0.981 . . . . 0.0 112.343 176.262 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 5.2 ptmt -131.4 -25.12 2.21 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 114.067 -1.424 . . . . 0.0 108.541 170.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 777' ' ' ALA . . . . . 0.686 ' HB3' ' HB2' ' A' ' 780' ' ' GLU . . . -95.81 163.98 19.88 Favored Pre-proline 0 C--O 1.235 0.34 0 CA-C-N 114.812 -1.086 . . . . 0.0 109.511 175.644 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 778' ' ' PRO . . . . . 0.579 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 43.2 Cg_endo -68.04 70.82 0.85 Allowed 'Trans proline' 0 CA--C 1.533 0.463 0 C-N-CA 122.726 2.284 . . . . 0.0 113.237 -178.289 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 117.44 18.08 5.46 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.672 -0.775 . . . . 0.0 113.162 175.704 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 780' ' ' GLU . . . . . 0.686 ' HB2' ' HB3' ' A' ' 777' ' ' ALA . 2.2 tt0 -94.28 125.83 39.15 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 179.608 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 22.4 m95 -133.38 136.77 45.51 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . 0.825 HG12 ' HB ' ' A' ' 764' ' ' THR . 27.9 m -134.35 161.71 40.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.824 174.523 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 783' ' ' HIS . . . . . . . . . . . . . 4.6 t-160 -172.98 146.34 1.5 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.582 174.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 784' ' ' SER . . . . . 0.823 ' HB3' ' HA ' ' A' ' 767' ' ' ARG . 0.9 OUTLIER -100.22 100.36 11.18 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 173.52 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 785' ' ' VAL . . . . . 0.411 HG11 ' HG3' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -162.65 177.43 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.53 -179.716 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -121.03 63.43 0.87 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.483 177.551 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 54.75 68.44 2.62 Favored Pre-proline 0 N--CA 1.468 0.427 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.75 178.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 788' ' ' PRO . . . . . 0.843 ' HG2' ' HG2' ' A' ' 790' ' ' GLU . 76.5 Cg_endo -89.08 41.24 0.54 Allowed 'Trans proline' 0 N--CA 1.46 -0.443 0 C-N-CA 122.936 2.424 . . . . 0.0 112.978 -177.601 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 73.78 -28.17 0.19 Allowed 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 175.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 790' ' ' GLU . . . . . 0.843 ' HG2' ' HG2' ' A' ' 788' ' ' PRO . 1.2 pt-20 -65.68 -37.88 87.7 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.084 0.402 . . . . 0.0 112.084 -176.295 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 791' ' ' LEU . . . . . 0.643 HD21 HG11 ' A' ' 763' ' ' VAL . 0.2 OUTLIER -67.04 -55.0 17.31 Favored Pre-proline 0 C--N 1.327 -0.375 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -177.491 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 792' ' ' PRO . . . . . 0.43 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 9.7 Cg_endo -55.35 -34.1 87.61 Favored 'Trans proline' 0 C--N 1.354 0.856 0 C-N-CA 121.854 1.703 . . . . 0.0 112.238 176.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -67.86 -44.45 77.06 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 120.96 0.41 . . . . 0.0 110.725 177.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 794' ' ' LEU . . . . . 0.405 ' O ' ' HB ' ' A' ' 798' ' ' ILE . 0.1 OUTLIER -63.36 -39.63 95.06 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.364 178.505 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 795' ' ' LEU . . . . . 0.883 HD11 HG21 ' A' ' 746' ' ' VAL . 0.0 OUTLIER -62.06 -34.68 76.71 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.812 179.646 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 796' ' ' ALA . . . . . 0.627 ' HB2' ' HA ' ' A' ' 702' ' ' GLU . . . -62.85 -53.42 54.4 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.297 179.052 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 797' ' ' ARG . . . . . 0.613 ' HA ' HD13 ' A' ' 800' ' ' LEU . 0.0 OUTLIER -72.04 -21.56 61.52 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.944 0.402 . . . . 0.0 111.2 -179.449 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 798' ' ' ILE . . . . . 0.405 ' HB ' ' O ' ' A' ' 794' ' ' LEU . 0.1 OUTLIER -69.25 -28.42 38.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 121.186 0.517 . . . . 0.0 109.893 175.758 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -80.85 -61.14 2.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.663 173.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 800' ' ' LEU . . . . . 0.613 HD13 ' HA ' ' A' ' 797' ' ' ARG . 2.5 tp 50.34 79.6 0.08 Allowed 'General case' 0 N--CA 1.468 0.432 0 O-C-N 124.233 0.958 . . . . 0.0 111.819 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 801' ' ' ILE . . . . . 0.783 HD12 ' HB2' ' A' ' 704' ' ' LEU . 13.5 mt -112.34 -38.17 2.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.837 177.4 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 802' ' ' GLU . . . . . 0.443 ' H ' ' HG ' ' A' ' 704' ' ' LEU . 0.5 OUTLIER 41.64 50.85 3.9 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 124.194 0.934 . . . . 0.0 111.467 177.681 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 803' ' ' MET . . . . . 0.66 ' HB2' HG22 ' A' ' 801' ' ' ILE . 0.8 OUTLIER -105.26 -178.4 3.64 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.232 -0.895 . . . . 0.0 111.288 -172.307 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 804' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 69.21 -167.28 0.18 Allowed 'General case' 0 C--O 1.233 0.233 0 O-C-N 123.819 0.699 . . . . 0.0 111.306 175.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -68.83 103.1 1.7 Allowed 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 121.076 0.465 . . . . 0.0 110.097 176.123 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -68.81 102.08 1.47 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.354 179.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -64.12 135.33 96.27 Favored Pre-proline 0 C--N 1.322 -0.594 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.718 177.014 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 808' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -72.71 48.59 1.37 Allowed 'Trans proline' 0 CA--C 1.529 0.257 0 C-N-CA 122.716 2.278 . . . . 0.0 112.84 -179.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -89.93 25.07 2.21 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.118 0.485 . . . . 0.0 110.556 179.215 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -62.2 125.27 23.31 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.833 -0.622 . . . . 0.0 110.038 178.308 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -69.41 158.43 35.14 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.211 -176.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -100.65 106.5 43.73 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.56 176.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -79.15 55.01 5.44 Favored 'Trans proline' 0 N--CA 1.459 -0.505 0 C-N-CA 123.31 2.674 . . . . 0.0 112.19 -177.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.07 77.22 2.24 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.26 0.552 . . . . 0.0 110.302 178.388 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 2.2 t -157.59 11.45 0.2 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.864 -179.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 816' ' ' ASP . . . . . 0.491 ' HB3' ' H ' ' A' ' 817' ' ' LYS . 0.8 OUTLIER 59.95 -101.58 0.12 Allowed 'General case' 0 C--O 1.233 0.218 0 CA-C-N 114.733 -1.121 . . . . 0.0 111.316 -178.217 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 817' ' ' LYS . . . . . 0.491 ' H ' ' HB3' ' A' ' 816' ' ' ASP . 0.3 OUTLIER 57.25 32.59 21.99 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.255 0.55 . . . . 0.0 111.156 -179.481 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -79.53 79.06 6.04 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.128 178.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -77.62 25.23 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.782 -177.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 1.2 m 52.75 73.23 0.36 Allowed 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.081 0.467 . . . . 0.0 110.418 -176.437 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -56.63 123.15 13.89 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.385 -178.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 19.6 t30 -68.81 -47.72 65.38 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.612 -173.085 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -116.87 148.27 41.44 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.262 0.553 . . . . 0.0 112.098 -172.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -144.9 30.22 1.18 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.777 -1.101 . . . . 0.0 108.849 171.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 9.3 ttt -88.04 111.77 21.9 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.591 178.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 826' ' ' MET . . . . . 0.57 ' HG2' ' O ' ' A' ' 868' ' ' HIS . 0.9 OUTLIER -94.82 122.76 37.77 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.516 0.674 . . . . 0.0 111.367 -172.192 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 827' ' ' ILE . . . . . 0.524 HG23 ' HB ' ' A' ' 871' ' ' ILE . 1.5 mm -115.11 125.39 72.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.529 176.018 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 828' ' ' LEU . . . . . 0.511 HD22 HG22 ' A' ' 830' ' ' VAL . 0.8 OUTLIER -93.42 115.95 28.49 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.625 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 829' ' ' VAL . . . . . 0.686 HG13 HD12 ' A' ' 873' ' ' LEU . 0.0 OUTLIER -103.02 97.51 5.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.93 179.944 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 830' ' ' VAL . . . . . 0.511 HG22 HD22 ' A' ' 828' ' ' LEU . 0.0 OUTLIER -113.54 112.65 41.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.17 -179.476 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 831' ' ' ASP . . . . . 0.688 ' HB2' ' HB3' ' A' ' 875' ' ' ASP . 0.0 OUTLIER -127.22 161.98 27.27 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.942 -175.534 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 832' ' ' ASP . . . . . 0.475 ' CG ' ' H ' ' A' ' 877' ' ' ASN . 1.6 p-10 -96.24 -13.64 23.27 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -175.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 833' ' ' HIS . . . . . 0.431 ' H ' ' CG ' ' A' ' 831' ' ' ASP . 0.0 OUTLIER -122.25 102.49 39.95 Favored Pre-proline 0 C--N 1.322 -0.601 0 O-C-N 122.343 -0.223 . . . . 0.0 110.778 -175.456 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 834' ' ' PRO . . . . . 0.491 ' HB2' ' HB2' ' A' ' 743' ' ' PRO . 92.7 Cg_exo -42.82 -37.31 5.83 Favored 'Trans proline' 0 CA--C 1.533 0.47 0 C-N-CA 124.054 3.169 . . . . 0.0 114.776 -172.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -65.18 -36.54 78.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-O 121.096 0.474 . . . . 0.0 110.904 179.265 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 836' ' ' ASN . . . . . 0.63 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 0.7 OUTLIER -74.86 -40.72 60.83 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 179.039 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 837' ' ' ARG . . . . . 0.61 ' HB2' ' OD1' ' A' ' 831' ' ' ASP . 3.9 ttt-85 -52.36 -41.25 62.92 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.431 177.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 1.3 tmm_? -67.4 -41.76 84.38 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.448 177.004 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 839' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 839' ' ' LEU . 2.7 mt -63.8 -50.82 67.46 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.351 -176.412 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 840' ' ' LEU . . . . . 0.63 ' HG ' ' O ' ' A' ' 836' ' ' ASN . 0.0 OUTLIER -69.15 -32.21 71.41 Favored 'General case' 0 CA--C 1.517 -0.302 0 O-C-N 121.997 -0.439 . . . . 0.0 110.623 -178.621 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 841' ' ' ALA . . . . . 0.822 ' HB2' HG21 ' A' ' 853' ' ' THR . . . -65.08 -45.99 83.0 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 120.957 0.408 . . . . 0.0 110.49 177.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -62.75 -42.43 99.67 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.403 178.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 843' ' ' GLN . . . . . 0.42 ' HG2' HD23 ' A' ' 929' ' ' LEU . 8.6 mt-30 -62.68 -40.97 98.76 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.886 178.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 844' ' ' LEU . . . . . 0.461 ' HA ' HD13 ' A' ' 844' ' ' LEU . 0.0 OUTLIER -65.52 -32.55 74.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.155 0.503 . . . . 0.0 109.762 176.667 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -66.9 -36.56 91.25 Favored Glycine 0 N--CA 1.446 -0.638 0 CA-C-N 115.489 -0.778 . . . . 0.0 112.027 174.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.24 -29.34 70.45 Favored 'General case' 0 N--CA 1.456 -0.138 0 CA-C-O 120.952 0.406 . . . . 0.0 110.494 176.748 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 5.8 mt -74.62 -52.01 12.9 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.214 -0.448 . . . . 0.0 109.938 174.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 103.6 42.82 1.93 Allowed Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.641 176.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 1.7 m-30 -113.32 165.94 11.95 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.74 129.75 38.56 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 176.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.61 147.86 41.68 Favored 'General case' 0 C--N 1.321 -0.665 0 C-N-CA 120.584 -0.446 . . . . 0.0 111.35 -176.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 852' ' ' LYS . . . . . 0.439 ' O ' HD23 ' A' ' 828' ' ' LEU . 0.1 OUTLIER -127.84 109.59 11.77 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 173.54 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 853' ' ' THR . . . . . 0.822 HG21 ' HB2' ' A' ' 841' ' ' ALA . 0.2 OUTLIER -102.42 114.73 29.17 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -173.053 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 854' ' ' ALA . . . . . . . . . . . . . . . -134.24 178.83 6.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.156 179.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 20.1 p-10 -139.52 75.26 1.5 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.804 0.812 . . . . 0.0 111.239 179.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 856' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -172.17 159.13 4.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.577 176.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -94.14 -44.66 3.49 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.421 -0.895 . . . . 0.0 113.098 -177.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 2.0 p -75.22 -34.03 30.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 117.173 0.487 . . . . 0.0 111.947 -173.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.51 -20.34 62.85 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 120.94 -0.304 . . . . 0.0 110.687 179.266 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -63.66 -38.65 91.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.02 0.438 . . . . 0.0 109.971 174.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 861' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' A' ' 861' ' ' LEU . 0.0 OUTLIER -69.13 -38.41 78.83 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.975 176.373 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 14.1 t30 -59.07 -52.88 63.82 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.028 177.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -65.73 -31.59 54.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.855 179.022 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 864' ' ' LEU . . . . . 0.753 HD23 HD12 ' A' ' 869' ' ' ILE . 0.8 OUTLIER -58.42 -34.32 70.65 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.176 0.512 . . . . 0.0 110.763 177.017 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 1.3 m -92.15 -17.06 25.44 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.604 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 1.1 mmmm -101.88 -2.76 29.2 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -174.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -162.04 161.04 28.22 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 -178.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 868' ' ' HIS . . . . . 0.57 ' O ' ' HG2' ' A' ' 826' ' ' MET . 0.0 OUTLIER -78.96 137.8 37.77 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 110.344 -0.243 . . . . 0.0 110.344 -178.306 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 869' ' ' ILE . . . . . 0.753 HD12 HD23 ' A' ' 864' ' ' LEU . 6.7 mt -135.27 142.47 39.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.525 178.572 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -99.6 -62.95 1.17 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.829 177.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 871' ' ' ILE . . . . . 0.524 ' HB ' HG23 ' A' ' 827' ' ' ILE . 18.0 mm -121.61 140.74 44.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.215 178.234 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 872' ' ' VAL . . . . . . . . . . . . . 55.5 t -119.13 122.04 68.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 175.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 873' ' ' LEU . . . . . 0.686 HD12 HG13 ' A' ' 829' ' ' VAL . 0.0 OUTLIER -112.15 122.49 47.89 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 178.982 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -109.83 104.19 13.1 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.05 179.729 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 875' ' ' ASP . . . . . 0.688 ' HB3' ' HB2' ' A' ' 831' ' ' ASP . 37.5 t0 -97.46 112.09 24.08 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.061 -176.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 876' ' ' VAL . . . . . 0.409 ' O ' ' HA ' ' A' ' 903' ' ' THR . 1.1 t -128.38 124.89 62.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.48 0.657 . . . . 0.0 112.223 -172.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 877' ' ' ASN . . . . . 0.475 ' H ' ' CG ' ' A' ' 832' ' ' ASP . 1.3 t30 -98.94 -38.87 8.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.098 -0.955 . . . . 0.0 109.24 171.631 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 878' ' ' MET . . . . . 0.884 ' HG2' ' HD2' ' A' ' 879' ' ' PRO . 0.1 OUTLIER -116.6 145.75 36.02 Favored Pre-proline 0 C--N 1.323 -0.571 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.642 177.31 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 879' ' ' PRO . . . . . 0.884 ' HD2' ' HG2' ' A' ' 878' ' ' MET . 18.1 Cg_endo -60.62 -7.99 8.28 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.869 2.38 . . . . 0.0 112.929 177.332 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 880' ' ' ASN . . . . . 0.46 ' HB3' ' O ' ' A' ' 879' ' ' PRO . 5.4 t30 75.29 -62.77 0.44 Allowed 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.493 0.717 . . . . 0.0 111.318 175.384 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 21.7 ttm -172.7 -69.07 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 -178.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -81.09 -117.94 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.368 175.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . 135.54 -3.46 3.93 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.353 -0.927 . . . . 0.0 113.173 173.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 23.2 p90 -126.51 -33.2 2.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 117.289 0.544 . . . . 0.0 111.077 -177.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 885' ' ' ARG . . . . . 0.695 ' O ' ' HB2' ' A' ' 889' ' ' ARG . 0.0 OUTLIER -60.22 -32.67 71.34 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.12 -178.777 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.32 -46.95 75.13 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.675 0.274 . . . . 0.0 110.694 -177.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.22 -37.48 61.08 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.063 0.459 . . . . 0.0 111.236 -176.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 -70.95 -47.24 60.1 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.823 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 889' ' ' ARG . . . . . 0.695 ' HB2' ' O ' ' A' ' 885' ' ' ARG . 0.0 OUTLIER -62.88 -39.12 93.49 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.394 -178.708 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 890' ' ' ILE . . . . . . . . . . . . . 4.3 tt -67.63 -40.38 83.99 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 C-N-CA 120.769 -0.373 . . . . 0.0 111.116 -178.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 891' ' ' ARG . . . . . 0.501 ' HA ' ' CB ' ' A' ' 895' ' ' LEU . 2.5 ptm180 -75.82 -23.87 55.81 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 120.74 0.305 . . . . 0.0 110.807 178.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -74.44 -44.3 52.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.868 -179.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 893' ' ' LEU . . . . . 0.435 HD23 ' HA ' ' A' ' 893' ' ' LEU . 1.2 mt -67.85 -44.52 76.94 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.953 -178.198 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 155.76 67.41 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.399 178.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 895' ' ' LEU . . . . . 0.501 ' CB ' ' HA ' ' A' ' 891' ' ' ARG . 3.6 tp -76.12 111.27 11.35 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.794 0.331 . . . . 0.0 110.556 179.296 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -134.62 25.01 3.73 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.244 0.545 . . . . 0.0 110.339 177.295 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 897' ' ' LEU . . . . . 0.41 ' HA ' ' HD3' ' A' ' 898' ' ' PRO . 0.4 OUTLIER -135.76 150.13 70.91 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.863 -177.857 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 898' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 897' ' ' LEU . 14.4 Cg_exo -69.47 118.4 5.66 Favored 'Trans proline' 0 C--O 1.236 0.396 0 C-N-CA 122.812 2.341 . . . . 0.0 112.742 -178.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 899' ' ' VAL . . . . . 0.803 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 94.6 t -104.15 117.8 50.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 121.087 0.47 . . . . 0.0 109.905 175.567 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 900' ' ' ILE . . . . . 0.684 HG23 ' HB2' ' A' ' 921' ' ' SER . 5.9 mt -90.69 107.58 18.69 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.241 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 901' ' ' GLY . . . . . 0.566 ' O ' ' HA ' ' A' ' 922' ' ' CYS . . . -91.19 113.95 4.4 Favored Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 120.835 -0.698 . . . . 0.0 111.828 179.38 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 902' ' ' VAL . . . . . 0.673 ' HB ' HD12 ' A' ' 923' ' ' LEU . 0.3 OUTLIER -113.47 130.63 67.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 -179.9 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 903' ' ' THR . . . . . 0.523 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.3 OUTLIER -131.08 160.97 33.11 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.7 -177.422 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 904' ' ' ALA . . . . . 0.727 ' HB2' ' HB2' ' A' ' 925' ' ' LYS . . . -121.58 105.28 10.3 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.68 0.276 . . . . 0.0 111.582 -178.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 8.3 t30 61.14 51.33 4.45 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.559 172.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 906' ' ' ALA . . . . . 0.494 ' HB3' ' HG3' ' A' ' 909' ' ' GLU . . . -90.46 -27.09 19.48 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 175.308 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER 65.57 20.48 11.64 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.883 174.26 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -161.63 30.76 0.13 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.246 -0.888 . . . . 0.0 108.785 178.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 909' ' ' GLU . . . . . 0.494 ' HG3' ' HB3' ' A' ' 906' ' ' ALA . 0.7 OUTLIER -64.31 -34.36 77.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.884 -1.053 . . . . 0.0 111.182 -173.279 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 910' ' ' GLU . . . . . 0.586 ' HG2' ' N ' ' A' ' 911' ' ' LYS . 1.6 pm0 -67.6 -45.0 76.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.978 0.418 . . . . 0.0 110.52 -179.434 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 911' ' ' LYS . . . . . 0.586 ' N ' ' HG2' ' A' ' 910' ' ' GLU . 0.1 OUTLIER -72.29 -31.85 66.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.914 -177.926 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.02 -43.23 79.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.106 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 913' ' ' ARG . . . . . 0.489 ' HG3' ' N ' ' A' ' 914' ' ' CYS . 0.0 OUTLIER -66.64 -35.3 79.84 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 121.144 -0.222 . . . . 0.0 110.747 -179.663 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 914' ' ' CYS . . . . . 0.489 ' N ' ' HG3' ' A' ' 913' ' ' ARG . 91.3 m -72.4 -35.93 68.54 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.868 0.366 . . . . 0.0 110.648 178.343 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 1.1 tp -65.87 -41.42 91.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.102 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -75.2 -40.1 59.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.019 -179.38 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 50.45 45.16 26.7 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.909 177.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -145.09 25.59 1.9 Allowed Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.422 -178.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 919' ' ' MET . . . . . 0.803 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -119.4 -111.46 0.34 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.559 0.179 . . . . 0.0 110.814 -177.832 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 920' ' ' ASP . . . . . 0.512 ' HB2' ' O ' ' A' ' 919' ' ' MET . 13.8 t70 167.0 -53.95 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.971 0.908 . . . . 0.0 109.673 176.653 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . 0.684 ' HB2' HG23 ' A' ' 900' ' ' ILE . 0.0 OUTLIER -118.32 172.13 7.66 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.052 -177.717 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 922' ' ' CYS . . . . . 0.566 ' HA ' ' O ' ' A' ' 901' ' ' GLY . 0.5 OUTLIER -154.18 139.1 17.2 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.019 -179.513 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 923' ' ' LEU . . . . . 0.673 HD12 ' HB ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -156.92 -175.47 5.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.772 175.178 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 924' ' ' SER . . . . . 0.523 ' HA ' ' O ' ' A' ' 903' ' ' THR . 0.5 OUTLIER -105.05 160.27 15.18 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.608 -179.059 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 925' ' ' LYS . . . . . 0.727 ' HB2' ' HB2' ' A' ' 904' ' ' ALA . 2.1 tttp -53.59 -48.36 93.34 Favored Pre-proline 0 CA--C 1.544 0.715 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 926' ' ' PRO . . . . . 0.532 ' HD3' ' HB3' ' A' ' 925' ' ' LYS . 31.8 Cg_exo -60.6 98.5 0.13 Allowed 'Trans proline' 0 C--N 1.357 0.981 0 C-N-CA 122.101 1.867 . . . . 0.0 112.53 175.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 927' ' ' VAL . . . . . 0.59 HG13 ' HB ' ' A' ' 931' ' ' VAL . 19.8 t -134.74 125.7 46.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.825 179.224 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -88.7 173.84 8.36 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.696 -0.229 . . . . 0.0 110.751 177.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 929' ' ' LEU . . . . . 0.42 HD23 ' HG2' ' A' ' 843' ' ' GLN . 0.5 OUTLIER -61.13 -32.67 72.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.621 0.248 . . . . 0.0 110.76 -179.129 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -70.9 -39.03 73.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.883 0.373 . . . . 0.0 110.38 -178.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 931' ' ' VAL . . . . . 0.59 ' HB ' HG13 ' A' ' 927' ' ' VAL . 46.8 t -70.59 -41.24 77.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.306 178.173 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 932' ' ' ILE . . . . . 0.494 HG12 HG11 ' A' ' 927' ' ' VAL . 0.3 OUTLIER -61.77 -41.46 90.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 109.97 -0.382 . . . . 0.0 109.97 177.308 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.87 -48.9 67.37 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.213 -177.776 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 934' ' ' GLN . . . . . 0.531 ' O ' ' HB2' ' A' ' 938' ' ' LEU . 0.0 OUTLIER -64.02 -31.71 73.0 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 121.22 -0.192 . . . . 0.0 111.225 -176.751 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 15.8 m -74.52 -46.41 39.36 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 120.687 0.279 . . . . 0.0 111.008 178.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 936' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' A' ' 936' ' ' LEU . 0.0 OUTLIER -63.5 -43.18 97.99 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.496 -179.943 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 37.6 m -66.61 -41.09 88.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.544 179.057 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 938' ' ' LEU . . . . . 0.531 ' HB2' ' O ' ' A' ' 934' ' ' GLN . 0.3 OUTLIER -59.53 -46.11 89.83 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.333 0.587 . . . . 0.0 110.607 179.251 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -77.76 -25.36 49.06 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.245 -177.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -62.86 -39.72 95.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.903 0.382 . . . . 0.0 110.386 174.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 941' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.26 -34.85 71.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.137 177.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 942' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.06 -47.89 75.72 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.772 179.133 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 35.4 m -71.25 -28.49 32.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.651 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.74 -50.54 71.92 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.827 177.359 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.31 -22.67 51.6 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.789 0.328 . . . . 0.0 111.392 -178.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 49.3 m -73.6 -29.86 62.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.921 0.391 . . . . 0.0 110.724 177.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -95.83 -61.51 1.44 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.675 -178.749 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -88.19 122.14 31.4 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.785 -178.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 3.4 m . . . . . 0 C--O 1.251 1.152 0 CA-C-O 118.326 -0.845 . . . . 0.0 110.229 -178.374 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.048 0 CA-C-O 120.905 0.383 . . . . 0.0 110.367 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 162.12 -167.21 36.68 Favored Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 120.998 -0.62 . . . . 0.0 112.156 177.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . -86.03 77.03 2.08 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.8 -0.714 . . . . 0.0 111.974 179.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.77 136.64 58.13 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.554 0.216 . . . . 0.0 110.894 179.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . -59.34 111.59 3.54 Favored Glycine 0 N--CA 1.451 -0.35 0 CA-C-N 115.969 -0.559 . . . . 0.0 112.553 -178.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 2.6 p -88.92 112.82 24.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.355 0.598 . . . . 0.0 110.902 -178.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -162.8 160.23 24.99 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.912 177.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . 158.01 -71.33 0.25 Allowed Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.928 -0.653 . . . . 0.0 111.615 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.444 HD22 HG12 ' A' ' 801' ' ' ILE . 13.7 mt 53.56 35.0 19.78 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 122.845 0.458 . . . . 0.0 111.582 178.613 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 705' ' ' SER . . . . . 0.439 ' HA ' ' HA3' ' A' ' 730' ' ' GLY . 0.5 OUTLIER -112.64 135.45 53.35 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.719 0.295 . . . . 0.0 110.665 -179.33 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 116.1 -25.94 9.07 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.148 177.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 707' ' ' LYS . . . . . 0.516 ' HA ' ' HD2' ' A' ' 707' ' ' LYS . 10.2 mmmt -69.78 132.75 46.56 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 176.51 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 708' ' ' ARG . . . . . 0.511 ' HA ' HG23 ' A' ' 732' ' ' VAL . 24.9 mtt85 -100.61 161.56 13.51 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.478 0.656 . . . . 0.0 111.33 -173.542 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 1.1 m -136.78 113.85 10.59 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.253 -0.885 . . . . 0.0 108.722 173.038 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 710' ' ' TRP . . . . . 0.463 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 87.8 m95 -90.5 112.57 24.28 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.401 0.619 . . . . 0.0 110.153 -173.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 711' ' ' LEU . . . . . 0.482 HD21 ' HB2' ' A' ' 719' ' ' CYS . 0.4 OUTLIER -111.83 119.84 39.93 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.109 -0.95 . . . . 0.0 111.061 -170.194 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -126.66 63.84 1.28 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.825 177.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 713' ' ' VAL . . . . . 0.78 HG13 ' HB3' ' A' ' 750' ' ' ASP . 90.4 t -117.27 121.42 67.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.273 -179.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 13.8 mtt85 -71.81 -34.0 68.98 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.589 -179.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -69.7 108.01 3.71 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.525 178.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 716' ' ' ALA . . . . . 0.6 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -65.15 -32.31 73.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.829 -174.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.11 -44.97 78.58 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.304 0.573 . . . . 0.0 110.344 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 718' ' ' LEU . . . . . 0.41 ' HB3' HG11 ' A' ' 713' ' ' VAL . 0.3 OUTLIER -67.93 -49.04 64.17 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.774 177.854 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 719' ' ' CYS . . . . . 0.6 ' SG ' ' HA ' ' A' ' 716' ' ' ALA . 3.0 p -63.73 -42.46 97.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.999 -175.744 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 720' ' ' GLN . . . . . 0.586 ' HB2' ' O ' ' A' ' 716' ' ' ALA . 0.1 OUTLIER -65.47 -36.73 84.76 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 111.568 0.21 . . . . 0.0 111.568 -179.26 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -55.44 -59.27 5.05 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.925 0.393 . . . . 0.0 110.508 178.641 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 722' ' ' LEU . . . . . 0.524 HD13 HG21 ' A' ' 748' ' ' ILE . 6.9 mt -65.38 -47.26 77.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.28 -178.443 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 723' ' ' GLU . . . . . 0.594 ' HA ' HG21 ' A' ' 733' ' ' VAL . 0.1 OUTLIER -60.11 -48.47 81.57 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.337 -174.411 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 724' ' ' THR . . . . . . . . . . . . . 45.7 m -67.36 -36.4 81.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.186 -177.109 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 42.9 m -68.27 -37.34 80.62 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.787 0.327 . . . . 0.0 111.297 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 726' ' ' LEU . . . . . . . . . . . . . 14.2 mt -76.51 -38.13 55.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.443 -175.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 2.5 pp0? -74.77 0.44 15.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.621 0.248 . . . . 0.0 111.531 -178.048 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 2.2 mtm180 -64.27 -35.18 80.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.824 0.345 . . . . 0.0 110.204 178.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 729' ' ' SER . . . . . 0.49 ' HB2' ' H ' ' A' ' 730' ' ' GLY . 0.0 OUTLIER -93.32 -100.24 0.14 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.26 177.418 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 730' ' ' GLY . . . . . 0.49 ' H ' ' HB2' ' A' ' 729' ' ' SER . . . -143.46 20.97 2.23 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.802 -0.713 . . . . 0.0 111.717 178.721 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 731' ' ' ILE . . . . . . . . . . . . . 20.6 mm -83.32 116.21 27.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.925 0.393 . . . . 0.0 110.226 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 732' ' ' VAL . . . . . 0.511 HG23 ' HA ' ' A' ' 708' ' ' ARG . 0.0 OUTLIER -87.19 97.29 6.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.118 0.485 . . . . 0.0 110.966 -176.64 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 733' ' ' VAL . . . . . 0.594 HG21 ' HA ' ' A' ' 723' ' ' GLU . 6.1 t -77.34 135.85 25.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.556 176.134 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -143.98 135.33 25.77 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.823 0.344 . . . . 0.0 111.219 -173.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.17 112.61 1.59 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.937 176.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 736' ' ' TYR . . . . . 0.463 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 66.7 t80 -90.24 99.33 12.37 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.984 -176.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.23 -51.21 3.29 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 173.167 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -160.41 75.57 0.19 Allowed Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.907 -0.663 . . . . 0.0 111.91 175.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 739' ' ' GLN . . . . . 0.44 ' HG2' ' CZ3' ' A' ' 710' ' ' TRP . 1.2 mp0 -111.93 -161.39 0.75 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.475 0.178 . . . . 0.0 110.74 -178.24 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -104.48 136.54 19.16 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.364 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 741' ' ' PRO . . . . . 0.433 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 64.8 Cg_endo -84.04 123.35 3.12 Favored 'Trans proline' 0 N--CA 1.454 -0.845 0 C-N-CA 122.473 2.115 . . . . 0.0 111.894 176.421 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 742' ' ' THR . . . . . 0.624 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.1 OUTLIER -96.77 140.64 22.24 Favored Pre-proline 0 C--N 1.316 -0.889 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.863 176.886 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 743' ' ' PRO . . . . . 0.624 ' HD2' HG22 ' A' ' 742' ' ' THR . 28.3 Cg_endo -61.87 -13.67 32.19 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 123.171 2.581 . . . . 0.0 113.306 -173.818 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 744' ' ' GLU . . . . . 0.551 ' HG2' ' H ' ' A' ' 819' ' ' VAL . 0.0 OUTLIER -116.36 5.87 13.6 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.031 178.888 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -102.09 153.78 19.6 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 120.979 0.419 . . . . 0.0 110.458 -177.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 746' ' ' VAL . . . . . 0.882 HG21 HD11 ' A' ' 795' ' ' LEU . 26.9 m -117.49 147.98 20.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 121.323 0.583 . . . . 0.0 111.927 -175.085 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 747' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -106.53 125.5 51.08 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.861 175.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 748' ' ' ILE . . . . . 0.524 HG21 HD13 ' A' ' 722' ' ' LEU . 2.5 mm -113.97 107.11 22.08 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 175.456 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 1.8 t -118.1 153.26 34.07 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.73 -0.214 . . . . 0.0 110.747 -176.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 750' ' ' ASP . . . . . 0.78 ' HB3' HG13 ' A' ' 713' ' ' VAL . 1.6 p-10 -100.9 146.76 26.94 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.587 -0.279 . . . . 0.0 110.475 175.146 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 61.88 -170.88 0.16 Allowed 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.768 178.263 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 752' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 769' ' ' HIS . 9.7 t -82.44 126.65 40.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.161 177.081 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 5.4 m -132.36 157.53 43.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.059 -179.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.57 76.09 10.21 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.911 0.386 . . . . 0.0 110.168 176.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.5 149.58 36.17 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.005 -177.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 11.6 tptt -121.55 -36.13 3.11 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.595 175.076 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 757' ' ' TRP . . . . . 0.433 ' CH2' ' HA ' ' A' ' 741' ' ' PRO . 68.0 t-105 69.27 95.89 0.07 Allowed 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.342 176.661 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -83.96 51.12 1.97 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.255 0.55 . . . . 0.0 110.402 177.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 759' ' ' GLY . . . . . . . . . . . . . . . -121.26 -135.07 4.72 Favored Glycine 0 N--CA 1.444 -0.778 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.667 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 3.3 ttt-85 -81.58 -60.94 2.08 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.94 0.4 . . . . 0.0 111.24 178.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -158.31 148.34 19.93 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.947 -176.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 4.5 p -117.9 127.47 75.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-O 121.41 0.624 . . . . 0.0 110.234 176.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 763' ' ' VAL . . . . . 0.562 HG11 HD21 ' A' ' 791' ' ' LEU . 46.2 t -111.27 122.23 65.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.761 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.722 177.443 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 764' ' ' THR . . . . . . . . . . . . . 3.9 m -107.7 116.54 32.13 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.436 -176.189 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 765' ' ' PHE . . . . . 0.653 ' HE1' HG23 ' A' ' 785' ' ' VAL . 12.3 m-85 -90.24 83.86 6.02 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.609 174.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -96.38 131.34 43.03 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 -177.431 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.25 -30.24 5.66 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.886 0.374 . . . . 0.0 110.787 -175.576 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 13.2 mmm180 -102.09 -59.02 1.77 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.928 -179.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . 0.411 ' O ' HG23 ' A' ' 752' ' ' VAL . 0.6 OUTLIER -116.56 133.35 56.12 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.87 -176.818 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 3.2 mp -117.71 91.27 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 121.203 0.525 . . . . 0.0 109.739 176.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -135.02 11.56 4.47 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.03 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 772' ' ' ILE . . . . . 0.653 HG12 ' HD2' ' A' ' 773' ' ' PRO . 0.1 OUTLIER -96.49 152.56 38.72 Favored Pre-proline 0 C--N 1.324 -0.521 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 -178.536 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 773' ' ' PRO . . . . . 0.653 ' HD2' HG12 ' A' ' 772' ' ' ILE . 84.7 Cg_exo -49.63 118.62 3.89 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 123.105 2.537 . . . . 0.0 113.005 178.521 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . 0.544 ' HB2' HG22 ' A' ' 782' ' ' VAL . 0.6 OUTLIER -98.19 -168.22 1.62 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.534 178.98 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 775' ' ' GLU . . . . . 0.569 ' HG3' ' HA ' ' A' ' 781' ' ' TRP . 1.3 mp0 -63.96 72.99 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 121.793 0.806 . . . . 0.0 112.874 178.339 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -129.62 6.09 5.16 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 114.751 -1.113 . . . . 0.0 108.532 169.199 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 777' ' ' ALA . . . . . 0.477 ' HB1' ' HD2' ' A' ' 778' ' ' PRO . . . -139.96 162.99 47.43 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 114.296 -1.32 . . . . 0.0 108.751 179.338 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 778' ' ' PRO . . . . . 0.477 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 88.0 Cg_endo -80.13 36.11 0.6 Allowed 'Trans proline' 0 CA--C 1.53 0.323 0 C-N-CA 122.414 2.076 . . . . 0.0 113.255 -175.117 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 177.32 31.53 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.246 -0.978 . . . . 0.0 112.72 -179.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 780' ' ' GLU . . . . . 0.49 ' HG2' ' HB2' ' A' ' 773' ' ' PRO . 0.9 OUTLIER -137.68 123.37 19.86 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 179.798 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 781' ' ' TRP . . . . . 0.569 ' HA ' ' HG3' ' A' ' 775' ' ' GLU . 25.2 m95 -137.55 143.86 41.79 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 123.188 0.305 . . . . 0.0 110.243 -177.336 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . 0.544 HG22 ' HB2' ' A' ' 774' ' ' LEU . 35.7 m -126.34 146.96 31.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 120.872 0.367 . . . . 0.0 110.516 171.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 783' ' ' HIS . . . . . 0.462 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 2.1 t-160 -160.64 138.73 9.79 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.828 0.347 . . . . 0.0 110.71 175.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 1.7 m -105.33 100.64 10.22 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.579 174.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 785' ' ' VAL . . . . . 0.653 HG23 ' HE1' ' A' ' 765' ' ' PHE . 0.0 OUTLIER -165.93 -176.76 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 178.323 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -111.66 31.65 6.01 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.867 0.365 . . . . 0.0 110.212 176.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 55.01 67.93 2.89 Favored Pre-proline 0 N--CA 1.467 0.383 0 CA-C-N 115.084 -0.962 . . . . 0.0 112.441 178.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 788' ' ' PRO . . . . . 0.564 ' HD2' ' OE1' ' A' ' 790' ' ' GLU . 16.9 Cg_exo -67.29 -66.21 0.04 OUTLIER 'Trans proline' 0 CA--C 1.529 0.255 0 C-N-CA 122.461 2.108 . . . . 0.0 111.955 179.096 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -170.39 24.32 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.937 0.399 . . . . 0.0 111.403 179.721 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 790' ' ' GLU . . . . . 0.564 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -104.45 -48.38 3.84 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.952 0.406 . . . . 0.0 110.212 -178.983 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 791' ' ' LEU . . . . . 0.562 HD21 HG11 ' A' ' 763' ' ' VAL . 0.4 OUTLIER -67.34 -47.54 48.6 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.622 179.794 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 792' ' ' PRO . . . . . 0.52 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 9.6 Cg_endo -57.98 -27.3 78.63 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 121.698 1.599 . . . . 0.0 111.952 175.192 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -76.19 -44.05 39.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.792 0.329 . . . . 0.0 110.599 177.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -60.54 -42.69 97.02 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 121.166 0.507 . . . . 0.0 110.136 176.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 795' ' ' LEU . . . . . 0.882 HD11 HG21 ' A' ' 746' ' ' VAL . 0.2 OUTLIER -63.87 -39.06 93.32 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.602 179.343 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 796' ' ' ALA . . . . . 0.563 ' HA ' HD12 ' A' ' 801' ' ' ILE . . . -61.41 -47.3 86.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.362 175.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 797' ' ' ARG . . . . . 0.419 ' CZ ' ' HB2' ' A' ' 797' ' ' ARG . 0.0 OUTLIER -59.43 -41.92 90.68 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.058 179.375 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -75.56 -17.72 15.75 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.709 -177.361 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 2.3 m-30 -103.6 9.8 37.23 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.677 0.275 . . . . 0.0 110.66 178.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 95.4 mt 62.28 32.13 17.2 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.452 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 801' ' ' ILE . . . . . 0.563 HD12 ' HA ' ' A' ' 796' ' ' ALA . 59.8 mt -89.78 96.76 6.44 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.661 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 176.671 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -72.27 84.11 1.05 Allowed 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.406 -179.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 803' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.79 -0.86 11.66 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.235 -178.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 804' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -71.03 126.39 29.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.746 0.308 . . . . 0.0 110.301 178.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.46 -55.37 6.43 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.121 0.486 . . . . 0.0 110.314 178.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -158.95 -36.31 0.06 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.671 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -44.75 113.09 1.63 Allowed Pre-proline 0 N--CA 1.465 0.323 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.622 177.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 808' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -77.68 58.68 6.5 Favored 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 123.454 2.77 . . . . 0.0 112.125 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -66.95 99.17 0.61 Allowed 'General case' 0 C--O 1.237 0.397 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.929 175.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -158.22 168.57 26.69 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.015 -175.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -145.99 -56.56 0.29 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.397 176.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 2.6 mt -130.49 116.95 17.51 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.321 174.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -63.35 89.7 0.14 Allowed 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.988 2.458 . . . . 0.0 112.176 -178.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 2.9 m -102.75 115.17 30.06 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.738 -179.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -124.08 94.06 4.11 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.047 178.731 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 816' ' ' ASP . . . . . 0.445 ' HB2' ' H ' ' A' ' 817' ' ' LYS . 1.0 OUTLIER -104.21 -140.04 0.36 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.736 -178.303 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 817' ' ' LYS . . . . . 0.445 ' H ' ' HB2' ' A' ' 816' ' ' ASP . 5.1 mptt -135.34 159.86 40.22 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 -175.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -150.03 152.66 35.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.722 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 819' ' ' VAL . . . . . 0.551 ' H ' ' HG2' ' A' ' 744' ' ' GLU . 1.0 OUTLIER -131.65 176.14 9.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 179.832 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 820' ' ' SER . . . . . 0.484 ' H ' HG22 ' A' ' 819' ' ' VAL . 0.0 OUTLIER -120.33 165.63 14.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.693 0.282 . . . . 0.0 110.812 179.965 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 48.3 t0 -73.62 159.32 33.25 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.412 178.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -78.46 -68.5 0.64 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.343 -178.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -159.83 154.69 24.54 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.27 176.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -130.03 77.56 1.79 Allowed 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.072 0.463 . . . . 0.0 110.357 -171.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 825' ' ' MET . . . . . 0.438 ' HA ' ' OD2' ' A' ' 870' ' ' ASP . 0.0 OUTLIER -105.26 139.73 39.47 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.516 -179.852 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 826' ' ' MET . . . . . 0.68 ' HB2' ' HA ' ' A' ' 869' ' ' ILE . 0.0 OUTLIER -123.31 135.51 54.24 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.904 0.383 . . . . 0.0 110.75 177.574 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 827' ' ' ILE . . . . . 0.885 ' HB ' HD21 ' A' ' 844' ' ' LEU . 2.3 mm -120.02 120.34 62.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 176.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 828' ' ' LEU . . . . . 0.487 ' HB2' HG21 ' A' ' 869' ' ' ILE . 0.9 OUTLIER -105.2 123.48 47.91 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.78 0.324 . . . . 0.0 110.705 -178.759 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 829' ' ' VAL . . . . . 0.603 HG21 HD12 ' A' ' 840' ' ' LEU . 1.0 OUTLIER -102.29 118.81 49.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.092 0.472 . . . . 0.0 110.441 177.332 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 830' ' ' VAL . . . . . 0.485 HG11 ' HB2' ' A' ' 860' ' ' ALA . 0.2 OUTLIER -109.22 86.98 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.75 177.594 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 831' ' ' ASP . . . . . 0.696 ' HA ' ' O ' ' A' ' 875' ' ' ASP . 0.1 OUTLIER -106.7 147.47 29.55 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.873 0.368 . . . . 0.0 110.883 -176.101 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -89.24 -25.64 21.62 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -175.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 833' ' ' HIS . . . . . 0.447 ' HA ' ' HD2' ' A' ' 834' ' ' PRO . 0.6 OUTLIER -114.71 106.21 52.39 Favored Pre-proline 0 N--CA 1.464 0.275 0 O-C-N 121.941 -0.475 . . . . 0.0 111.681 -174.167 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 834' ' ' PRO . . . . . 0.447 ' HD2' ' HA ' ' A' ' 833' ' ' HIS . 1.7 Cg_endo -40.75 -47.07 4.75 Favored 'Trans proline' 0 C--N 1.349 0.555 1 C-N-CA 125.319 4.013 . . . . 0.0 115.604 -169.59 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 1.1 pp -59.32 -38.78 76.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 CA-C-O 121.243 0.544 . . . . 0.0 111.164 -176.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 836' ' ' ASN . . . . . 0.575 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 3.2 m-80 -68.63 -46.46 69.18 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.669 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 837' ' ' ARG . . . . . 0.557 ' HB2' ' OD2' ' A' ' 831' ' ' ASP . 0.0 OUTLIER -52.49 -45.73 66.31 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.495 178.262 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -59.06 -41.81 88.83 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.166 -179.563 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.02 -53.55 25.02 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -176.484 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 840' ' ' LEU . . . . . 0.603 HD12 HG21 ' A' ' 829' ' ' VAL . 0.0 OUTLIER -73.78 -27.95 61.41 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.583 -175.824 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -69.45 -29.9 67.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.963 0.411 . . . . 0.0 110.091 177.076 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -69.49 -41.16 76.49 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.961 175.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 843' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -62.84 -39.15 93.47 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.849 176.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 844' ' ' LEU . . . . . 0.885 HD21 ' HB ' ' A' ' 827' ' ' ILE . 0.0 OUTLIER -63.61 -31.31 72.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.636 174.957 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -69.78 -27.35 73.33 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.154 176.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.06 -45.64 17.94 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.653 0.263 . . . . 0.0 110.683 177.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -152.77 84.5 1.23 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.122 0.487 . . . . 0.0 110.345 176.732 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . -155.03 23.57 0.6 Allowed Glycine 0 N--CA 1.443 -0.835 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.029 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 11.2 m-85 55.52 -128.06 2.12 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.67 108.42 18.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.801 0.334 . . . . 0.0 110.225 176.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -80.97 125.97 30.8 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.597 -177.526 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 852' ' ' LYS . . . . . 0.432 ' HB3' HD12 ' A' ' 828' ' ' LEU . 0.0 OUTLIER -122.42 146.75 47.07 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 174.827 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -131.51 142.81 50.03 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -173.687 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 854' ' ' ALA . . . . . 0.464 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -156.46 165.48 36.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.011 175.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 855' ' ' ASN . . . . . 0.434 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 0.9 OUTLIER -148.76 74.04 1.25 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.887 0.375 . . . . 0.0 111.23 176.598 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 856' ' ' ASP . . . . . 0.478 ' OD1' HG23 ' A' ' 858' ' ' VAL . 7.1 t70 172.73 145.27 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.916 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -66.0 -39.5 94.84 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.034 177.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 858' ' ' VAL . . . . . 0.478 HG23 ' OD1' ' A' ' 856' ' ' ASP . 1.5 t -73.53 -32.28 35.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 O-C-N 122.713 -0.287 . . . . 0.0 110.87 -178.737 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -70.52 -34.02 71.82 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.005 0.431 . . . . 0.0 110.271 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 860' ' ' ALA . . . . . 0.485 ' HB2' HG11 ' A' ' 830' ' ' VAL . . . -64.72 -37.42 87.52 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.192 176.117 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 861' ' ' LEU . . . . . . . . . . . . . 1.4 mt -71.18 -35.31 71.54 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.42 176.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 40.8 t30 -65.8 -49.81 66.93 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.105 -179.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 10.7 p -64.93 -32.26 57.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.361 178.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 864' ' ' LEU . . . . . 0.515 HD21 HD22 ' A' ' 897' ' ' LEU . 0.5 OUTLIER -64.59 -42.75 95.39 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.624 175.642 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 16.5 m -69.08 -22.19 64.02 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.859 -179.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -79.16 -27.77 42.72 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.924 175.419 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 19.4 t30 62.61 94.66 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.133 -0.94 . . . . 0.0 112.644 175.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -171.18 53.08 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.251 170.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 869' ' ' ILE . . . . . 0.68 ' HA ' ' HB2' ' A' ' 826' ' ' MET . 0.1 OUTLIER -152.11 154.66 7.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.525 179.316 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 870' ' ' ASP . . . . . 0.438 ' OD2' ' HA ' ' A' ' 825' ' ' MET . 13.7 m-20 -112.11 -49.46 2.97 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.568 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 871' ' ' ILE . . . . . . . . . . . . . 41.8 mm -118.62 133.86 64.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.023 177.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 872' ' ' VAL . . . . . 0.696 HG23 HD11 ' A' ' 897' ' ' LEU . 13.5 t -116.72 128.48 74.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.954 -0.388 . . . . 0.0 109.954 177.034 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 873' ' ' LEU . . . . . 0.413 HD12 ' HB ' ' A' ' 829' ' ' VAL . 0.2 OUTLIER -109.74 113.24 25.84 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.875 0.369 . . . . 0.0 110.686 179.835 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.81 96.32 9.71 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 175.408 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 875' ' ' ASP . . . . . 0.726 ' CG ' ' HZ3' ' A' ' 925' ' ' LYS . 48.0 t0 -105.83 117.9 35.21 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.005 -173.376 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 2.4 t -141.58 133.31 27.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.114 0.483 . . . . 0.0 111.517 -175.019 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 877' ' ' ASN . . . . . 0.459 ' HB2' ' CE ' ' A' ' 925' ' ' LYS . 40.4 t-20 -127.47 54.77 1.65 Allowed 'General case' 0 C--O 1.234 0.273 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 171.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -163.26 108.18 0.99 Allowed Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.915 -179.535 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 879' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -59.55 109.17 0.53 Allowed 'Trans proline' 0 C--O 1.231 0.144 0 C-N-CA 122.496 2.131 . . . . 0.0 111.406 176.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -146.09 169.94 17.67 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.031 -174.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 42.9 mtp -62.78 -34.31 77.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.545 178.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 882' ' ' ASP . . . . . 0.51 ' OD1' ' HB3' ' A' ' 885' ' ' ARG . 24.3 t0 -85.44 61.83 7.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.408 0.623 . . . . 0.0 111.233 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -123.2 22.84 7.01 Favored Glycine 0 N--CA 1.447 -0.614 0 N-CA-C 110.264 -1.134 . . . . 0.0 110.264 172.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -177.66 -24.05 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -173.212 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 885' ' ' ARG . . . . . 0.51 ' HB3' ' OD1' ' A' ' 882' ' ' ASP . 2.1 tmm_? -55.2 -49.6 71.53 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.989 -178.602 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 886' ' ' LEU . . . . . 0.515 ' HG ' ' N ' ' A' ' 887' ' ' THR . 0.2 OUTLIER -65.51 -34.22 77.75 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.359 -177.652 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 887' ' ' THR . . . . . 0.833 HG21 ' HG2' ' A' ' 919' ' ' MET . 0.0 OUTLIER -75.81 -33.33 60.1 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-O 120.742 0.306 . . . . 0.0 111.502 -178.413 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -57.26 -41.81 80.35 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 173.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.07 -33.53 72.04 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.2 177.344 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 890' ' ' ILE . . . . . 0.578 HG22 ' O ' ' A' ' 887' ' ' THR . 1.5 tp -68.09 -36.97 77.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 N-CA-C 111.798 0.295 . . . . 0.0 111.798 -177.654 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 891' ' ' ARG . . . . . 0.602 ' HA ' HD23 ' A' ' 895' ' ' LEU . 1.9 ptm180 -75.39 -28.58 59.52 Favored 'General case' 0 N--CA 1.46 0.067 0 C-N-CA 120.289 -0.564 . . . . 0.0 110.459 177.605 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -69.99 -34.61 73.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.061 0.458 . . . . 0.0 110.797 175.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 893' ' ' LEU . . . . . 0.488 HD23 ' HA ' ' A' ' 893' ' ' LEU . 2.7 mt -74.64 -45.72 42.91 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.808 179.423 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 122.61 70.23 0.25 Allowed Glycine 0 N--CA 1.448 -0.513 0 N-CA-C 111.386 -0.685 . . . . 0.0 111.386 -178.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 895' ' ' LEU . . . . . 0.602 HD23 ' HA ' ' A' ' 891' ' ' ARG . 0.6 OUTLIER -64.45 117.36 7.19 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.393 0.616 . . . . 0.0 110.843 -176.883 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.57 0.5 24.58 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.26 -178.257 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 897' ' ' LEU . . . . . 0.696 HD11 HG23 ' A' ' 872' ' ' VAL . 1.0 OUTLIER -126.81 154.02 75.98 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.788 -175.595 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -73.09 127.79 12.41 Favored 'Trans proline' 0 C--O 1.239 0.533 0 C-N-CA 123.084 2.522 . . . . 0.0 112.326 179.175 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 899' ' ' VAL . . . . . 0.812 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 3.2 t -108.42 116.07 50.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.365 178.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 900' ' ' ILE . . . . . 0.421 ' CG2' ' HG ' ' A' ' 923' ' ' LEU . 42.0 mt -95.09 106.67 18.48 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.887 178.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -86.94 93.32 1.87 Allowed Glycine 0 N--CA 1.445 -0.762 0 C-N-CA 120.867 -0.682 . . . . 0.0 112.341 -177.705 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 902' ' ' VAL . . . . . 0.617 ' O ' ' HA ' ' A' ' 875' ' ' ASP . 0.2 OUTLIER -91.0 108.76 20.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-O 121.663 0.744 . . . . 0.0 109.603 178.007 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -126.33 152.86 45.66 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.919 -179.014 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -71.23 105.39 3.42 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 168.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -48.31 110.76 0.37 Allowed 'General case' 0 CA--C 1.515 -0.376 0 O-C-N 124.073 0.858 . . . . 0.0 110.96 -171.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -85.52 -56.96 3.26 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.199 -175.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -166.84 -50.04 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 178.054 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -134.48 42.65 2.84 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.012 0.434 . . . . 0.0 111.335 -174.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.03 -31.72 72.44 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.394 -178.483 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 910' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -39.65 94.96 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.163 176.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.47 -36.61 79.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.109 178.293 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -60.39 -47.9 84.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.169 176.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.85 -43.77 90.86 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.147 179.761 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 75.6 m -63.99 -32.5 74.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.807 0.337 . . . . 0.0 110.794 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 2.5 tp -70.59 -51.57 27.42 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.454 -179.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.54 -44.08 45.38 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.708 -175.392 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 51.19 42.48 28.86 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.208 0.528 . . . . 0.0 111.143 -176.226 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -119.59 -25.75 2.55 Favored Glycine 0 N--CA 1.447 -0.629 0 CA-C-N 115.716 -0.674 . . . . 0.0 112.225 -177.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 919' ' ' MET . . . . . 0.833 ' HG2' HG21 ' A' ' 887' ' ' THR . 2.1 mtt -78.41 -102.83 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.774 0.321 . . . . 0.0 110.158 177.12 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 920' ' ' ASP . . . . . 0.498 ' HB2' ' O ' ' A' ' 919' ' ' MET . 19.6 t70 170.3 -65.31 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 123.699 0.8 . . . . 0.0 109.772 175.196 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -113.26 158.32 20.66 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.802 -177.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 922' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -116.72 118.99 34.08 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 175.553 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 923' ' ' LEU . . . . . 0.421 ' HG ' ' CG2' ' A' ' 900' ' ' ILE . 0.3 OUTLIER -116.02 161.23 19.17 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.119 -178.858 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 2.6 m -102.15 137.62 40.17 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.313 178.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 925' ' ' LYS . . . . . 0.726 ' HZ3' ' CG ' ' A' ' 875' ' ' ASP . 0.0 OUTLIER -52.0 -41.46 79.86 Favored Pre-proline 0 CA--C 1.541 0.597 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 177.726 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -67.78 65.94 0.88 Allowed 'Trans proline' 0 C--N 1.357 1.004 0 C-N-CA 121.975 1.783 . . . . 0.0 112.417 171.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 5.3 p -99.19 145.65 9.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.139 179.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 34.0 p -102.91 174.06 6.04 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.586 0.231 . . . . 0.0 110.441 179.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 929' ' ' LEU . . . . . 0.429 HD23 ' HA ' ' A' ' 929' ' ' LEU . 0.0 OUTLIER -60.85 -34.74 75.06 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 175.141 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -74.45 -45.62 45.17 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.209 -177.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 79.0 t -67.4 -38.99 81.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 120.905 0.383 . . . . 0.0 110.735 -179.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 932' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -63.47 -37.59 79.96 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 175.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 20.2 ttmt -63.66 -48.38 77.43 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.579 177.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -55.04 -54.97 36.2 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.346 178.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 1.5 m -62.11 -46.29 89.69 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.725 -176.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 936' ' ' LEU . . . . . 0.4 ' HA ' HD12 ' A' ' 936' ' ' LEU . 0.9 OUTLIER -62.7 -44.51 96.06 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.61 -0.268 . . . . 0.0 110.797 -179.507 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 56.1 m -64.33 -48.24 76.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.307 -179.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 3.1 tp -63.1 -37.38 86.97 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.433 -176.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -79.43 -34.2 41.87 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.779 -0.368 . . . . 0.0 111.034 -179.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 940' ' ' ALA . . . . . 0.454 ' O ' ' HB2' ' A' ' 944' ' ' ARG . . . -66.43 -38.85 88.35 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.841 178.085 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 941' ' ' GLU . . . . . 0.532 ' HG3' ' N ' ' A' ' 942' ' ' ARG . 0.0 OUTLIER -70.3 -33.82 72.0 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 177.001 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 942' ' ' ARG . . . . . 0.532 ' N ' ' HG3' ' A' ' 941' ' ' GLU . 1.6 tpm_? -64.84 -48.17 75.31 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.85 179.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 31.4 m -69.2 -29.57 43.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 178.118 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 944' ' ' ARG . . . . . 0.454 ' HB2' ' O ' ' A' ' 940' ' ' ALA . 0.0 OUTLIER -64.58 -35.13 79.98 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.78 176.814 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 945' ' ' LYS . . . . . 0.402 ' HG2' ' O ' ' A' ' 941' ' ' GLU . 1.1 mmtp -65.08 -42.34 94.22 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.296 0.57 . . . . 0.0 110.362 176.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 5.0 m -72.18 -17.68 61.92 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.297 179.069 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.4 -61.15 1.76 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.863 0.364 . . . . 0.0 110.972 -179.497 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -111.89 68.91 0.68 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.055 -177.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.758 -0.639 . . . . 0.0 110.787 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 0.992 0 CA-C-O 120.65 0.262 . . . . 0.0 110.341 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . -104.24 166.51 15.37 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.203 -179.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . -87.39 98.41 2.38 Favored Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 121.011 -0.614 . . . . 0.0 111.689 179.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -93.54 73.12 4.4 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.885 0.374 . . . . 0.0 111.17 -176.375 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . 172.91 120.5 0.57 Allowed Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.542 -0.837 . . . . 0.0 112.707 178.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 21.4 t -125.33 -47.22 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 177.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 62.39 -162.47 0.28 Allowed 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.837 177.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . 161.63 139.6 2.68 Favored Glycine 0 N--CA 1.45 -0.399 0 N-CA-C 111.084 -0.807 . . . . 0.0 111.084 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.519 HD13 HD13 ' A' ' 801' ' ' ILE . 0.1 OUTLIER -100.9 53.57 0.85 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.524 0.678 . . . . 0.0 111.565 -174.654 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -114.25 122.99 48.42 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.899 174.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 122.85 -11.23 8.84 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.482 -179.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 4.1 mmtt -74.41 147.0 42.46 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 178.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 708' ' ' ARG . . . . . 0.471 ' HA ' HG23 ' A' ' 732' ' ' VAL . 2.7 mtm180 -102.81 156.47 17.63 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.078 0.466 . . . . 0.0 111.754 -172.128 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 709' ' ' CYS . . . . . 0.431 ' SG ' ' HE2' ' A' ' 799' ' ' TYR . 1.0 OUTLIER -142.37 115.04 8.58 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.973 174.794 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 710' ' ' TRP . . . . . 0.491 ' CZ3' ' HB ' ' A' ' 734' ' ' THR . 91.1 m95 -91.41 118.12 30.27 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 -178.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 711' ' ' LEU . . . . . 0.573 HD22 HG12 ' A' ' 733' ' ' VAL . 1.9 pt? -118.72 127.61 53.72 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.496 0.665 . . . . 0.0 111.605 -177.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -127.05 58.73 1.43 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.541 175.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 713' ' ' VAL . . . . . 0.801 HG13 ' HB2' ' A' ' 750' ' ' ASP . 21.2 t -96.93 121.42 47.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.628 -179.547 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 714' ' ' ARG . . . . . 0.603 ' H ' ' HB3' ' A' ' 750' ' ' ASP . 38.0 mtp85 -66.96 -46.86 73.39 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.193 -175.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 715' ' ' ASN . . . . . 0.487 ' O ' ' HB2' ' A' ' 719' ' ' CYS . 7.6 p30 -78.96 133.39 36.88 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.236 179.131 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -77.69 -17.39 57.7 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.529 -175.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.43 -56.58 19.64 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.098 0.475 . . . . 0.0 110.182 178.382 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 718' ' ' LEU . . . . . 0.557 ' HB3' HG11 ' A' ' 713' ' ' VAL . 0.6 OUTLIER -72.58 -39.47 67.37 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.552 178.579 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 719' ' ' CYS . . . . . 0.734 ' SG ' ' HB ' ' A' ' 713' ' ' VAL . 0.1 OUTLIER -55.48 -52.64 62.97 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.12 -178.905 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 720' ' ' GLN . . . . . 0.525 ' O ' ' HG2' ' A' ' 723' ' ' GLU . 0.6 OUTLIER -67.85 -42.85 80.75 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.392 -177.705 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 721' ' ' PHE . . . . . 0.462 ' HE2' ' HG3' ' A' ' 792' ' ' PRO . 57.2 t80 -58.18 -54.76 43.31 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.734 0.302 . . . . 0.0 110.738 -179.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 722' ' ' LEU . . . . . 0.443 HD21 HD12 ' A' ' 791' ' ' LEU . 0.7 OUTLIER -60.09 -44.36 94.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.892 -177.72 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 723' ' ' GLU . . . . . 0.525 ' HG2' ' O ' ' A' ' 720' ' ' GLN . 6.3 pt-20 -62.64 -36.3 82.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.881 -178.233 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 724' ' ' THR . . . . . . . . . . . . . 87.8 m -65.12 -44.56 88.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.178 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.98 -37.66 85.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.987 0.422 . . . . 0.0 111.173 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 726' ' ' LEU . . . . . 0.5 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 23.7 mt -74.49 -48.09 29.34 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.988 -177.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.71 -5.74 44.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.733 -177.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.13 -27.65 59.87 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 175.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 729' ' ' SER . . . . . 0.445 ' HB2' ' H ' ' A' ' 730' ' ' GLY . 0.3 OUTLIER -90.03 -104.15 0.09 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.897 175.796 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 730' ' ' GLY . . . . . 0.445 ' H ' ' HB2' ' A' ' 729' ' ' SER . . . -148.26 31.24 1.3 Allowed Glycine 0 N--CA 1.446 -0.691 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 175.216 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 731' ' ' ILE . . . . . 0.5 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 15.3 mm -95.77 126.0 48.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.736 0.303 . . . . 0.0 110.369 -177.307 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 732' ' ' VAL . . . . . 0.471 HG23 ' HA ' ' A' ' 708' ' ' ARG . 0.0 OUTLIER -85.86 98.53 6.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 121.275 0.559 . . . . 0.0 110.553 179.629 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 733' ' ' VAL . . . . . 0.573 HG12 HD22 ' A' ' 711' ' ' LEU . 0.1 OUTLIER -71.59 113.33 8.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.159 177.867 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 734' ' ' THR . . . . . 0.491 ' HB ' ' CZ3' ' A' ' 710' ' ' TRP . 0.2 OUTLIER -118.46 127.03 53.26 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.19 0.519 . . . . 0.0 110.824 -178.408 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -55.66 124.61 17.97 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.972 174.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 736' ' ' TYR . . . . . 0.663 ' HE2' ' HD3' ' A' ' 755' ' ' LYS . 9.4 t80 -81.19 70.07 7.95 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.622 0.725 . . . . 0.0 109.846 177.063 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 737' ' ' GLU . . . . . 0.482 ' H ' ' HG3' ' A' ' 737' ' ' GLU . 3.5 mt-10 -75.51 -25.04 56.91 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.788 -177.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 154.3 60.9 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.344 0 N-CA-C 111.431 -0.668 . . . . 0.0 111.431 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 26.7 mp0 -112.55 -178.84 3.5 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.77 0.319 . . . . 0.0 110.89 -175.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 740' ' ' GLU . . . . . 0.432 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 0.0 OUTLIER -81.6 143.99 51.96 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.941 -177.497 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 741' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 740' ' ' GLU . 1.3 Cg_endo -82.32 123.17 3.84 Favored 'Trans proline' 0 N--CA 1.452 -0.925 0 C-N-CA 122.644 2.229 . . . . 0.0 111.701 175.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 742' ' ' THR . . . . . 0.419 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.1 OUTLIER -110.73 136.18 20.71 Favored Pre-proline 0 C--N 1.32 -0.703 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.755 178.966 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 743' ' ' PRO . . . . . 0.419 ' HD2' HG22 ' A' ' 742' ' ' THR . 37.8 Cg_endo -66.5 -1.91 6.46 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 123.053 2.502 . . . . 0.0 112.883 -179.279 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.27 -9.63 18.44 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.498 178.279 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -109.27 152.18 25.56 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.415 -0.812 . . . . 0.0 111.204 -170.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 16.2 m -116.68 147.85 19.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.429 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 747' ' ' LEU . . . . . 0.665 HD22 HG23 ' A' ' 749' ' ' THR . 0.4 OUTLIER -108.14 135.22 49.85 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.001 177.813 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 1.7 mt -117.77 118.09 57.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 173.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 749' ' ' THR . . . . . 0.665 HG23 HD22 ' A' ' 747' ' ' LEU . 2.5 p -125.18 150.19 47.19 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -167.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 750' ' ' ASP . . . . . 0.801 ' HB2' HG13 ' A' ' 713' ' ' VAL . 34.8 t0 -113.54 116.59 29.78 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.773 175.005 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 751' ' ' GLU . . . . . 0.678 ' HG3' ' H ' ' A' ' 752' ' ' VAL . 1.8 tp10 68.17 -177.85 0.21 Allowed 'General case' 0 CA--C 1.536 0.432 0 O-C-N 123.868 0.73 . . . . 0.0 111.063 -177.173 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 752' ' ' VAL . . . . . 0.678 ' H ' ' HG3' ' A' ' 751' ' ' GLU . 15.2 t -75.19 100.2 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.298 -176.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 753' ' ' VAL . . . . . 0.422 HG21 HG21 ' A' ' 749' ' ' THR . 19.5 m -90.33 -0.29 8.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.483 176.38 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 58.31 41.35 23.38 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.351 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 755' ' ' LYS . . . . . 0.663 ' HD3' ' HE2' ' A' ' 736' ' ' TYR . 0.1 OUTLIER -120.03 126.97 52.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.318 180.0 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 2.1 tmtm? -81.43 -42.27 20.63 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.06 -179.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 76.0 t-105 62.46 90.44 0.07 Allowed 'General case' 0 CA--C 1.53 0.21 0 O-C-N 123.71 0.631 . . . . 0.0 111.657 179.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -83.23 58.82 4.66 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.148 0.499 . . . . 0.0 109.822 175.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 759' ' ' GLY . . . . . . . . . . . . . . . -117.62 -144.28 7.68 Favored Glycine 0 N--CA 1.444 -0.791 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.901 -178.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 760' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 760' ' ' ARG . 0.7 OUTLIER -75.81 -53.27 8.74 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.96 0.41 . . . . 0.0 110.242 179.217 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -161.49 156.56 23.7 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.386 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 762' ' ' VAL . . . . . 0.597 HG23 ' HB3' ' A' ' 747' ' ' LEU . 3.0 p -140.75 126.87 20.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-O 121.126 0.489 . . . . 0.0 109.852 179.004 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 18.6 t -111.65 105.29 18.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.05 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 764' ' ' THR . . . . . 0.482 ' HA ' ' OG1' ' A' ' 749' ' ' THR . 33.4 m -97.66 119.68 36.66 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.219 0.533 . . . . 0.0 110.607 178.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 765' ' ' PHE . . . . . 0.757 ' HZ ' ' HG ' ' A' ' 791' ' ' LEU . 33.0 m-85 -76.98 123.88 26.97 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.633 175.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 766' ' ' CYS . . . . . 0.494 ' SG ' ' HB ' ' A' ' 782' ' ' VAL . 0.0 OUTLIER -95.58 131.64 41.57 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 176.925 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.72 -69.34 0.74 Allowed 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.902 0.382 . . . . 0.0 110.672 -177.034 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 768' ' ' ARG . . . . . 0.439 ' HA ' ' HD2' ' A' ' 768' ' ' ARG . 0.0 OUTLIER -118.69 -30.09 5.21 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.261 -177.988 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -114.77 134.06 55.41 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.312 0.577 . . . . 0.0 110.965 -178.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 2.7 mp -97.51 156.28 3.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 173.131 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . 175.45 -43.37 0.12 Allowed Glycine 0 CA--C 1.505 -0.571 0 N-CA-C 110.612 -0.995 . . . . 0.0 110.612 -177.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 772' ' ' ILE . . . . . 0.456 ' HA ' ' HD3' ' A' ' 773' ' ' PRO . 17.5 mm -87.03 123.4 70.3 Favored Pre-proline 0 C--N 1.321 -0.643 0 N-CA-C 108.374 -0.972 . . . . 0.0 108.374 169.358 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 773' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' A' ' 772' ' ' ILE . 23.7 Cg_exo -62.63 -85.62 0.01 OUTLIER 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.982 2.455 . . . . 0.0 112.673 -175.371 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . 0.603 ' O ' ' HB3' ' A' ' 780' ' ' GLU . 0.9 OUTLIER 171.53 -155.41 0.01 OUTLIER 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 -179.901 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 775' ' ' GLU . . . . . 0.575 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 2.6 mp0 -60.3 75.13 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 122.082 0.944 . . . . 0.0 112.269 174.242 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 12.5 mmmt -119.19 -45.71 2.54 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 114.17 -1.377 . . . . 0.0 109.008 171.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 777' ' ' ALA . . . . . 0.689 ' HB1' ' HD2' ' A' ' 778' ' ' PRO . . . -91.57 165.88 19.66 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 115.333 -0.848 . . . . 0.0 110.233 179.771 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 778' ' ' PRO . . . . . 0.689 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 24.0 Cg_endo -60.91 91.81 0.1 OUTLIER 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.829 2.352 . . . . 0.0 113.18 -178.325 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 99.05 15.06 34.37 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.797 176.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 780' ' ' GLU . . . . . 0.603 ' HB3' ' O ' ' A' ' 774' ' ' LEU . 2.2 tt0 -84.23 122.01 28.29 Favored 'General case' 0 C--O 1.218 -0.589 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 -179.138 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 17.6 m95 -133.49 143.54 48.85 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.626 0.25 . . . . 0.0 110.344 178.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . 0.578 HG13 ' HA ' ' A' ' 774' ' ' LEU . 17.1 m -134.66 156.57 40.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 172.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 783' ' ' HIS . . . . . 0.466 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.1 OUTLIER -176.22 144.34 0.56 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.725 0.298 . . . . 0.0 110.896 178.228 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 4.9 m -105.74 102.77 12.19 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.354 175.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 785' ' ' VAL . . . . . 0.517 HG23 ' HE2' ' A' ' 765' ' ' PHE . 0.1 OUTLIER -150.57 155.28 7.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.67 0.271 . . . . 0.0 110.543 178.191 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -86.73 7.41 26.86 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.428 174.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 787' ' ' ALA . . . . . 0.469 ' H ' ' HB ' ' A' ' 785' ' ' VAL . . . 57.8 63.6 4.51 Favored Pre-proline 0 N--CA 1.464 0.251 0 CA-C-N 115.22 -0.9 . . . . 0.0 112.2 179.109 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 788' ' ' PRO . . . . . 0.42 ' HD3' ' N ' ' A' ' 787' ' ' ALA . 21.2 Cg_exo -66.58 -54.84 0.41 Allowed 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.135 1.89 . . . . 0.0 111.725 176.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 7.3 p-80 -161.05 -22.12 0.05 Allowed 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 176.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 790' ' ' GLU . . . . . 0.428 ' CD ' ' H ' ' A' ' 790' ' ' GLU . 2.0 pm0 -72.83 -38.6 67.08 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -175.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 791' ' ' LEU . . . . . 0.757 ' HG ' ' HZ ' ' A' ' 765' ' ' PHE . 1.2 tm? -62.21 -54.62 47.96 Favored Pre-proline 0 CA--C 1.536 0.438 0 N-CA-C 111.65 0.241 . . . . 0.0 111.65 -178.067 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 792' ' ' PRO . . . . . 0.462 ' HG3' ' HE2' ' A' ' 721' ' ' PHE . 11.2 Cg_endo -58.37 -26.6 78.17 Favored 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 121.523 1.482 . . . . 0.0 112.201 176.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -71.79 -40.56 69.15 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.789 176.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 794' ' ' LEU . . . . . 0.435 HD22 ' HD2' ' A' ' 797' ' ' ARG . 1.9 tm? -59.62 -47.17 86.66 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.107 0.48 . . . . 0.0 109.784 176.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 795' ' ' LEU . . . . . 0.496 ' HA ' ' HB ' ' A' ' 798' ' ' ILE . 0.2 OUTLIER -70.89 -29.7 65.85 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.13 -178.755 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 796' ' ' ALA . . . . . 0.447 ' HB1' ' HB ' ' A' ' 801' ' ' ILE . . . -62.67 -46.51 87.84 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 174.581 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 797' ' ' ARG . . . . . 0.435 ' HD2' HD22 ' A' ' 794' ' ' LEU . 0.1 OUTLIER -64.3 -33.51 76.0 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.06 177.054 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 798' ' ' ILE . . . . . 0.496 ' HB ' ' HA ' ' A' ' 795' ' ' LEU . 0.3 OUTLIER -62.01 -32.28 53.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.879 178.771 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 799' ' ' TYR . . . . . 0.435 ' HD1' ' HA ' ' A' ' 799' ' ' TYR . 0.6 OUTLIER -103.91 15.54 28.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.155 179.6 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 9.7 mt 61.04 41.15 14.27 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 115.878 -0.601 . . . . 0.0 112.127 176.34 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 801' ' ' ILE . . . . . 0.58 HG22 ' HG2' ' A' ' 803' ' ' MET . 2.6 mm -88.33 66.78 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.58 0.705 . . . . 0.0 109.134 176.07 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 802' ' ' GLU . . . . . 0.418 ' H ' ' HG3' ' A' ' 802' ' ' GLU . 0.2 OUTLIER -74.71 72.47 1.99 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.082 -0.963 . . . . 0.0 111.148 -175.992 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 803' ' ' MET . . . . . 0.58 ' HG2' HG22 ' A' ' 801' ' ' ILE . 12.0 ptp -134.58 33.73 3.24 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.193 0.521 . . . . 0.0 110.818 176.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 804' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -150.97 179.37 8.3 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.546 179.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 1.2 m -75.84 42.94 0.25 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.126 0.488 . . . . 0.0 111.118 177.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 806' ' ' ASP . . . . . 0.414 ' OD2' ' HB2' ' A' ' 797' ' ' ARG . 24.2 t70 -75.32 112.57 11.76 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.097 -0.501 . . . . 0.0 109.69 179.324 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 807' ' ' ASP . . . . . 0.498 ' HA ' ' HD3' ' A' ' 808' ' ' PRO . 0.0 OUTLIER -79.17 120.96 82.48 Favored Pre-proline 0 C--N 1.317 -0.833 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.868 -179.104 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 808' ' ' PRO . . . . . 0.498 ' HD3' ' HA ' ' A' ' 807' ' ' ASP . 13.3 Cg_exo -69.93 68.97 1.76 Allowed 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 123.323 2.682 . . . . 0.0 112.483 -177.089 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -144.98 138.14 26.59 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.563 176.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 2.4 t30 62.97 43.73 6.48 Favored 'General case' 0 C--N 1.33 -0.253 0 O-C-N 123.698 0.624 . . . . 0.0 110.075 -175.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -151.13 73.89 1.12 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.38 -178.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -80.38 115.34 54.22 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.22 178.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -74.79 140.21 25.81 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.488 2.126 . . . . 0.0 112.185 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -80.14 162.77 24.56 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.47 178.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.48 105.46 0.52 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.902 0.382 . . . . 0.0 110.999 179.024 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.31 60.06 4.84 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.183 -176.036 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.51 43.97 1.67 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.49 -179.568 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -148.63 172.89 13.82 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.994 0.426 . . . . 0.0 111.204 -178.124 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 3.7 p -127.97 158.27 39.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.293 177.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -88.38 -64.38 1.15 Allowed 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -175.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -159.6 -165.84 1.63 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.075 0.464 . . . . 0.0 111.236 -173.288 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 21.3 t30 -127.51 -43.82 1.57 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.875 177.116 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 30.3 t70 59.83 103.71 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.709 0 O-C-N 123.888 0.743 . . . . 0.0 111.107 -176.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 824' ' ' ASP . . . . . 0.436 ' HB3' ' H ' ' A' ' 825' ' ' MET . 0.9 OUTLIER -122.66 -123.53 0.27 Allowed 'General case' 0 N--CA 1.445 -0.686 0 CA-C-O 121.14 0.495 . . . . 0.0 111.13 -174.274 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 825' ' ' MET . . . . . 0.436 ' H ' ' HB3' ' A' ' 824' ' ' ASP . 2.7 ttm -151.53 140.86 21.44 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.004 -175.336 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 826' ' ' MET . . . . . 0.736 ' HG3' ' HA ' ' A' ' 869' ' ' ILE . 1.6 ptp -135.05 123.34 23.09 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.155 0.502 . . . . 0.0 110.841 178.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 827' ' ' ILE . . . . . 0.534 HG23 ' HB ' ' A' ' 871' ' ' ILE . 5.5 mm -108.25 140.72 25.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.816 -179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 828' ' ' LEU . . . . . 0.422 HD23 HG22 ' A' ' 872' ' ' VAL . 16.2 tp -106.55 118.33 36.39 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.139 0.495 . . . . 0.0 110.615 -178.179 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 829' ' ' VAL . . . . . 0.673 HG12 HD11 ' A' ' 873' ' ' LEU . 0.0 OUTLIER -106.27 109.88 29.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.257 -179.803 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 830' ' ' VAL . . . . . 0.487 HG22 ' HB3' ' A' ' 854' ' ' ALA . 13.4 t -109.54 100.39 10.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.232 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 831' ' ' ASP . . . . . 0.497 ' HA ' ' O ' ' A' ' 875' ' ' ASP . 7.2 t0 -112.34 149.2 32.79 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 -177.75 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -91.02 -22.13 20.93 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.841 179.76 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 833' ' ' HIS . . . . . 0.417 ' HA ' ' HD2' ' A' ' 834' ' ' PRO . 1.7 m80 -111.93 113.68 52.19 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.553 -176.053 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 834' ' ' PRO . . . . . 0.417 ' HD2' ' HA ' ' A' ' 833' ' ' HIS . 5.4 Cg_endo -48.22 -46.46 22.65 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 124.106 3.204 . . . . 0.0 114.173 -174.385 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -56.35 -46.6 81.86 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 120.961 0.41 . . . . 0.0 111.395 -178.868 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 836' ' ' ASN . . . . . 0.615 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 3.0 m120 -75.75 -35.13 60.28 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 -178.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 837' ' ' ARG . . . . . 0.464 HH11 ' HB ' ' A' ' 853' ' ' THR . 0.8 OUTLIER -53.09 -46.26 68.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.44 176.996 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 1.7 tmm_? -65.66 -39.95 91.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.448 177.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.71 -53.57 55.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.112 -176.655 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 840' ' ' LEU . . . . . 0.615 ' HG ' ' O ' ' A' ' 836' ' ' ASN . 0.0 OUTLIER -73.64 -33.31 64.46 Favored 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 120.603 -0.439 . . . . 0.0 111.144 -177.281 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -63.75 -45.43 89.89 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.967 0.413 . . . . 0.0 110.866 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -65.99 -38.99 89.91 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.52 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 843' ' ' GLN . . . . . 0.443 ' HG3' ' CD2' ' A' ' 929' ' ' LEU . 0.0 OUTLIER -70.67 -32.41 69.66 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.985 -178.514 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 844' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.2 -37.12 81.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.037 0.446 . . . . 0.0 109.842 173.631 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -64.57 -37.33 94.28 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.303 176.041 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -67.07 -26.69 66.86 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.953 0.406 . . . . 0.0 111.044 178.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.25 -13.17 61.09 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.572 177.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 84.68 30.04 27.86 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.877 -0.677 . . . . 0.0 112.849 176.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -124.61 144.45 50.16 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 20.6 mm-40 -65.92 134.75 53.65 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.903 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.06 133.63 55.73 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.131 -172.744 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.05 126.17 51.76 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 174.17 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 853' ' ' THR . . . . . 0.464 ' HB ' HH11 ' A' ' 837' ' ' ARG . 0.0 OUTLIER -106.66 138.62 42.5 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.926 0.393 . . . . 0.0 111.747 -174.593 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 854' ' ' ALA . . . . . 0.487 ' HB3' HG22 ' A' ' 830' ' ' VAL . . . -140.4 145.22 36.79 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.277 175.558 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 855' ' ' ASN . . . . . 0.467 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 0.6 OUTLIER -121.89 72.63 1.04 Allowed 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 176.146 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 856' ' ' ASP . . . . . 0.517 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 35.0 t70 164.25 141.06 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.007 0.923 . . . . 0.0 109.544 178.195 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 857' ' ' GLY . . . . . 0.514 ' HA3' ' HB2' ' A' ' 886' ' ' LEU . . . -67.18 -49.61 51.72 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.972 -0.632 . . . . 0.0 113.228 -177.516 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -73.73 -31.31 31.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.135 0.493 . . . . 0.0 110.728 -177.021 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 859' ' ' ASP . . . . . 0.517 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 18.9 t0 -58.91 -31.16 68.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.824 177.425 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 860' ' ' ALA . . . . . 0.408 ' O ' HG12 ' A' ' 863' ' ' VAL . . . -62.85 -33.79 75.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.79 177.329 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 861' ' ' LEU . . . . . 0.677 HD21 ' HA ' ' A' ' 890' ' ' ILE . 0.3 OUTLIER -69.01 -40.77 78.5 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.022 0.439 . . . . 0.0 110.261 178.794 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -59.35 -49.67 76.91 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.634 177.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 863' ' ' VAL . . . . . 0.408 HG12 ' O ' ' A' ' 860' ' ' ALA . 0.8 OUTLIER -66.42 -31.66 54.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.778 179.789 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 864' ' ' LEU . . . . . 0.476 HD22 ' HA ' ' A' ' 864' ' ' LEU . 0.6 OUTLIER -63.38 -41.93 98.81 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.012 0.434 . . . . 0.0 110.52 177.13 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 3.5 m -76.02 -22.68 55.51 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.578 -176.453 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.46 -44.61 9.51 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.388 -178.595 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -96.11 -133.03 0.2 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.405 -177.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 3.5 m170 -136.69 -76.9 0.42 Allowed 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 178.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 869' ' ' ILE . . . . . 0.736 ' HA ' ' HG3' ' A' ' 826' ' ' MET . 3.0 mt 69.35 134.6 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 O-C-N 123.792 0.682 . . . . 0.0 111.405 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -98.28 -47.95 5.25 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.485 -178.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 871' ' ' ILE . . . . . 0.611 HD12 ' HD2' ' A' ' 939' ' ' TYR . 36.3 mm -121.62 131.51 72.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.298 -179.607 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 872' ' ' VAL . . . . . 0.752 HG23 HD11 ' A' ' 897' ' ' LEU . 17.0 t -111.82 135.38 51.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 110.125 -0.324 . . . . 0.0 110.125 177.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 873' ' ' LEU . . . . . 0.673 HD11 HG12 ' A' ' 829' ' ' VAL . 1.2 pp -139.99 141.72 36.35 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.937 0.399 . . . . 0.0 110.382 174.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -119.72 102.06 8.34 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.639 -179.024 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 875' ' ' ASP . . . . . 0.595 ' OD1' ' HG2' ' A' ' 925' ' ' LYS . 0.4 OUTLIER -89.1 106.28 18.33 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.896 -179.583 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -119.16 125.7 74.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-O 121.165 0.507 . . . . 0.0 111.654 -173.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 877' ' ' ASN . . . . . 0.425 ' CB ' ' HD2' ' A' ' 925' ' ' LYS . 0.1 OUTLIER -96.47 -35.61 11.08 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 172.418 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -119.74 133.18 23.85 Favored Pre-proline 0 C--N 1.319 -0.749 0 CA-C-N 114.882 -1.054 . . . . 0.0 108.741 172.427 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 879' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -55.0 -14.63 8.63 Favored 'Trans proline' 0 CA--C 1.532 0.379 0 C-N-CA 123.156 2.571 . . . . 0.0 113.864 -177.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 61.64 70.67 0.58 Allowed 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 -179.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 72.19 -62.68 0.46 Allowed 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.344 -171.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -152.91 130.7 11.65 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.073 178.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -95.97 38.07 3.23 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.859 -175.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -131.15 -28.07 1.96 Allowed 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 177.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.51 -39.82 67.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.704 -178.538 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 886' ' ' LEU . . . . . 0.604 ' HG ' ' N ' ' A' ' 887' ' ' THR . 0.0 OUTLIER -70.8 -44.19 67.11 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 121.123 -0.231 . . . . 0.0 110.949 -176.852 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 887' ' ' THR . . . . . 0.604 ' N ' ' HG ' ' A' ' 886' ' ' LEU . 0.0 OUTLIER -67.14 -41.78 85.49 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.972 0.415 . . . . 0.0 110.46 -178.964 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 888' ' ' GLN . . . . . 0.47 ' O ' ' HB2' ' A' ' 892' ' ' GLN . 8.6 tp60 -58.18 -41.01 82.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.15 176.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 11.0 mmt-85 -70.99 -35.03 71.93 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.941 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 890' ' ' ILE . . . . . 0.677 ' HA ' HD21 ' A' ' 861' ' ' LEU . 0.0 OUTLIER -66.75 -41.5 88.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 C-N-CA 121.175 -0.21 . . . . 0.0 110.914 -179.018 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 891' ' ' ARG . . . . . 0.492 ' HD2' ' HA3' ' A' ' 918' ' ' GLY . 0.0 OUTLIER -75.32 -24.11 57.37 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 120.711 -0.396 . . . . 0.0 110.502 175.843 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 892' ' ' GLN . . . . . 0.47 ' HB2' ' O ' ' A' ' 888' ' ' GLN . 0.0 OUTLIER -65.45 -38.87 91.12 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.796 178.274 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -83.81 -11.47 57.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.664 -179.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 87.04 85.92 1.11 Allowed Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.798 -0.715 . . . . 0.0 111.778 -178.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 895' ' ' LEU . . . . . 0.595 ' HG ' ' O ' ' A' ' 895' ' ' LEU . 0.5 OUTLIER -71.83 111.59 7.22 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.46 0.648 . . . . 0.0 110.827 -177.388 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -88.15 -12.61 43.5 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.011 179.74 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 897' ' ' LEU . . . . . 0.752 HD11 HG23 ' A' ' 872' ' ' VAL . 1.8 pt? -124.34 147.83 56.25 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.121 -177.634 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 898' ' ' PRO . . . . . 0.78 ' HB2' ' HE2' ' A' ' 939' ' ' TYR . 57.2 Cg_endo -71.28 141.19 38.65 Favored 'Trans proline' 0 C--O 1.242 0.701 0 C-N-CA 122.648 2.232 . . . . 0.0 112.748 -178.105 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 899' ' ' VAL . . . . . 0.877 HG13 ' HA ' ' A' ' 919' ' ' MET . 0.2 OUTLIER -127.28 144.74 36.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.409 0.623 . . . . 0.0 110.548 179.783 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 900' ' ' ILE . . . . . . . . . . . . . 2.5 mt -108.61 119.05 57.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.155 177.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -94.74 98.78 2.34 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.858 -0.686 . . . . 0.0 111.542 179.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 902' ' ' VAL . . . . . 0.843 ' HB ' HD12 ' A' ' 923' ' ' LEU . 0.1 OUTLIER -99.56 101.46 12.12 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 CA-C-O 121.717 0.77 . . . . 0.0 109.203 178.769 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 903' ' ' THR . . . . . 0.493 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.1 OUTLIER -105.12 173.73 6.18 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.812 -174.269 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -79.76 103.84 9.94 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.807 -0.357 . . . . 0.0 110.713 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 45.7 t30 18.82 91.78 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.76 0 O-C-N 125.219 1.574 . . . . 0.0 114.787 177.031 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -95.29 8.46 43.05 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.246 -0.434 . . . . 0.0 109.884 172.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 3.1 tp 69.25 -67.89 0.21 Allowed 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.596 -176.447 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -99.22 67.89 1.61 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.128 0.49 . . . . 0.0 109.814 176.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.42 -27.88 67.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.676 -178.44 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 910' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.84 -40.87 94.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.638 176.359 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 3.9 tttt -70.53 -32.83 70.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.269 -179.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.5 -44.29 94.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.715 174.641 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 913' ' ' ARG . . . . . 0.839 ' HA ' ' HE1' ' A' ' 919' ' ' MET . 1.0 OUTLIER -59.93 -42.54 94.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.905 177.211 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 66.6 m -68.38 -34.73 76.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.282 -179.03 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.47 -44.69 74.27 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.817 -178.78 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 916' ' ' GLU . . . . . 0.573 ' OE1' ' HB ' ' A' ' 887' ' ' THR . 0.3 OUTLIER -77.14 -50.93 11.9 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.505 -177.701 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 2.1 m 50.24 47.88 23.04 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.568 -174.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 918' ' ' GLY . . . . . 0.492 ' HA3' ' HD2' ' A' ' 891' ' ' ARG . . . -132.67 7.37 5.24 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.166 -1.016 . . . . 0.0 112.965 -179.165 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 919' ' ' MET . . . . . 0.877 ' HA ' HG13 ' A' ' 899' ' ' VAL . 0.0 OUTLIER -121.89 -89.32 0.6 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.734 0.302 . . . . 0.0 110.296 -178.143 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 920' ' ' ASP . . . . . 0.527 ' HB2' ' O ' ' A' ' 919' ' ' MET . 25.5 t70 165.74 -54.79 0.0 OUTLIER 'General case' 0 CA--C 1.516 -0.347 0 O-C-N 124.404 1.065 . . . . 0.0 108.562 176.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . 0.519 ' HA ' ' NH1' ' A' ' 913' ' ' ARG . 20.7 m -129.68 166.61 19.45 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.348 177.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 922' ' ' CYS . . . . . 0.405 ' HB2' ' HB2' ' A' ' 913' ' ' ARG . 0.8 OUTLIER -144.74 147.63 33.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.829 -178.898 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 923' ' ' LEU . . . . . 0.843 HD12 ' HB ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -150.2 -176.82 5.61 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 175.176 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 924' ' ' SER . . . . . 0.493 ' HA ' ' O ' ' A' ' 903' ' ' THR . 1.5 m -108.67 147.49 31.83 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 121.255 -0.178 . . . . 0.0 110.553 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 925' ' ' LYS . . . . . 0.595 ' HG2' ' OD1' ' A' ' 875' ' ' ASP . 0.0 OUTLIER -51.56 -40.79 72.67 Favored Pre-proline 0 CA--C 1.54 0.558 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 -175.577 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 926' ' ' PRO . . . . . 0.554 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 10.9 Cg_endo -57.18 84.86 0.04 OUTLIER 'Trans proline' 0 C--N 1.358 1.035 0 C-N-CA 121.915 1.744 . . . . 0.0 112.1 171.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 927' ' ' VAL . . . . . 0.621 HG13 ' HB ' ' A' ' 931' ' ' VAL . 2.3 t -122.55 129.2 75.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.341 -177.09 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.86 172.12 10.32 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.97 178.379 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 929' ' ' LEU . . . . . 0.443 ' CD2' ' HG3' ' A' ' 843' ' ' GLN . 1.0 OUTLIER -60.93 -41.9 97.11 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.416 -175.837 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.67 -29.07 68.26 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.989 0.424 . . . . 0.0 110.584 -179.105 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 931' ' ' VAL . . . . . 0.621 ' HB ' HG13 ' A' ' 927' ' ' VAL . 60.2 t -70.55 -51.11 40.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.956 -178.507 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 932' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -63.45 -37.52 79.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-O 120.842 0.353 . . . . 0.0 110.107 179.075 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.36 -45.76 92.35 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.32 175.78 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 934' ' ' GLN . . . . . 0.514 ' O ' ' HB2' ' A' ' 938' ' ' LEU . 47.5 mt-30 -67.54 -32.88 73.97 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.086 -178.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 8.6 m -64.67 -48.03 76.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.801 0.334 . . . . 0.0 110.438 178.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 936' ' ' LEU . . . . . . . . . . . . . 1.4 mp -62.93 -48.23 79.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.569 178.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 28.3 m -60.56 -44.83 95.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.548 -178.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 938' ' ' LEU . . . . . 0.514 ' HB2' ' O ' ' A' ' 934' ' ' GLN . 0.1 OUTLIER -58.5 -43.17 88.98 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.253 -177.989 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 939' ' ' TYR . . . . . 0.78 ' HE2' ' HB2' ' A' ' 898' ' ' PRO . 4.5 m-85 -79.17 -35.95 41.12 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.097 -177.37 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -62.3 -44.32 96.79 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.864 0.364 . . . . 0.0 110.717 178.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 941' ' ' GLU . . . . . 0.486 ' O ' ' HE2' ' A' ' 945' ' ' LYS . 4.1 pt-20 -70.41 -33.36 71.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.448 178.515 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 942' ' ' ARG . . . . . 0.428 ' N ' ' HG3' ' A' ' 941' ' ' GLU . 0.3 OUTLIER -64.34 -48.19 76.51 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.822 -179.336 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 28.6 m -71.15 -29.71 37.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.828 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.85 -47.15 86.36 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.237 178.679 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 945' ' ' LYS . . . . . 0.486 ' HE2' ' O ' ' A' ' 941' ' ' GLU . 0.1 OUTLIER -77.23 -22.47 52.22 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.901 -0.32 . . . . 0.0 111.124 -177.685 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 69.5 m -76.71 -32.84 58.11 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.809 0.338 . . . . 0.0 110.621 175.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.4 -42.59 18.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.079 -178.733 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -101.75 104.48 15.28 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.235 0.541 . . . . 0.0 110.312 178.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.252 1.198 0 CA-C-O 117.858 -1.068 . . . . 0.0 109.512 177.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.943 0 CA-C-O 121.001 0.429 . . . . 0.0 110.588 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . -112.36 143.33 17.55 Favored Glycine 0 N--CA 1.447 -0.624 0 C-N-CA 120.894 -0.669 . . . . 0.0 111.601 178.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . -160.3 120.6 0.97 Allowed Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.317 -0.944 . . . . 0.0 112.742 -177.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -115.56 -42.82 3.09 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.1 0.476 . . . . 0.0 110.103 175.336 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . 72.89 -113.64 4.45 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.422 178.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 5.7 t 58.12 68.21 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.249 0 CA-C-O 121.354 0.597 . . . . 0.0 110.361 -178.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 702' ' ' GLU . . . . . 0.428 ' CD ' ' H ' ' A' ' 702' ' ' GLU . 0.0 OUTLIER -79.36 -82.71 0.1 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.489 -179.459 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . 147.8 40.86 0.04 OUTLIER Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.575 -0.821 . . . . 0.0 112.838 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.861 HD21 ' HA ' ' A' ' 801' ' ' ILE . 0.2 OUTLIER -96.18 -172.23 2.5 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 176.44 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 52.02 77.27 0.15 Allowed 'General case' 0 N--CA 1.464 0.253 0 O-C-N 123.698 0.624 . . . . 0.0 111.976 176.077 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 145.24 -11.9 1.82 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.199 -1.001 . . . . 0.0 112.644 -178.244 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 11.3 mmtt -67.27 140.03 57.34 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 175.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 708' ' ' ARG . . . . . 0.448 ' HG2' HG23 ' A' ' 732' ' ' VAL . 0.8 OUTLIER -105.31 141.89 36.04 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.037 0.446 . . . . 0.0 111.464 -174.759 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 1.5 m -121.94 110.24 15.61 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.275 174.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 710' ' ' TRP . . . . . 0.583 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 70.0 m95 -91.85 134.21 34.97 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 -178.467 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 711' ' ' LEU . . . . . 0.483 HD22 HG23 ' A' ' 733' ' ' VAL . 2.2 pt? -131.79 137.94 48.35 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 121.355 0.598 . . . . 0.0 111.264 -177.465 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -126.05 37.38 4.35 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.902 -1.044 . . . . 0.0 109.161 175.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 713' ' ' VAL . . . . . 0.832 ' HB ' ' HB3' ' A' ' 719' ' ' CYS . 2.1 t -87.75 116.34 29.69 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.833 177.751 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 714' ' ' ARG . . . . . 0.427 ' NH2' ' HB2' ' A' ' 751' ' ' GLU . 15.4 mtm180 -84.41 -16.2 43.57 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.439 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 54.9 t-20 -70.57 105.71 3.21 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.214 172.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 716' ' ' ALA . . . . . 0.644 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -60.92 -41.92 97.08 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.677 -174.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.69 -41.3 94.87 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.31 0.576 . . . . 0.0 110.376 179.21 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 718' ' ' LEU . . . . . 0.416 ' HB3' HG11 ' A' ' 713' ' ' VAL . 0.3 OUTLIER -73.74 -49.19 26.79 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.347 -177.891 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 719' ' ' CYS . . . . . 0.832 ' HB3' ' HB ' ' A' ' 713' ' ' VAL . 31.8 p -68.42 -40.68 81.11 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.013 -175.487 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 720' ' ' GLN . . . . . 0.587 ' O ' ' HG3' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -66.44 -39.75 89.09 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.46 -178.947 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -63.17 -46.58 86.43 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 121.165 0.507 . . . . 0.0 110.586 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.72 -47.42 78.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.921 -179.408 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 723' ' ' GLU . . . . . 0.587 ' HG3' ' O ' ' A' ' 720' ' ' GLN . 0.3 OUTLIER -60.12 -42.17 94.2 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.151 -176.75 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 724' ' ' THR . . . . . 0.61 ' O ' ' HG3' ' A' ' 728' ' ' ARG . 91.8 m -64.12 -36.87 85.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.881 0.372 . . . . 0.0 110.784 -179.553 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 725' ' ' SER . . . . . 0.441 ' HA ' ' HE ' ' A' ' 728' ' ' ARG . 19.5 m -70.47 -48.02 57.79 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.665 -179.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 726' ' ' LEU . . . . . 0.444 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 16.3 mt -66.35 -38.92 88.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.905 0.383 . . . . 0.0 111.548 -176.888 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 727' ' ' GLN . . . . . 0.438 ' HG2' ' O ' ' A' ' 723' ' ' GLU . 6.8 pt20 -72.58 -7.39 49.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.545 -177.629 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 728' ' ' ARG . . . . . 0.61 ' HG3' ' O ' ' A' ' 724' ' ' THR . 33.4 mtm180 -79.16 -34.63 42.98 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.112 0.482 . . . . 0.0 110.467 178.681 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -86.25 -24.52 25.98 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.658 -176.57 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 730' ' ' GLY . . . . . . . . . . . . . . . 120.36 14.9 5.22 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.525 -0.845 . . . . 0.0 111.855 -177.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 731' ' ' ILE . . . . . 0.444 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 9.6 mm -91.49 114.11 28.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 175.603 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 732' ' ' VAL . . . . . 0.448 HG23 ' HG2' ' A' ' 708' ' ' ARG . 0.0 OUTLIER -77.93 100.52 3.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 121.309 0.575 . . . . 0.0 110.963 -176.492 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 733' ' ' VAL . . . . . 0.483 HG23 HD22 ' A' ' 711' ' ' LEU . 1.3 p -74.31 133.12 32.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.056 176.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 734' ' ' THR . . . . . 0.414 ' O ' ' HA ' ' A' ' 710' ' ' TRP . 7.7 m -141.96 132.16 24.84 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.936 0.398 . . . . 0.0 110.399 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.22 124.89 20.96 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.754 176.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 736' ' ' TYR . . . . . 0.583 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 31.7 t80 -85.39 81.53 8.71 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.058 0.456 . . . . 0.0 110.536 -179.252 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -58.05 -45.76 86.49 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.503 174.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 149.33 41.83 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.547 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.944 178.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.19 -87.52 0.06 Allowed 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 120.396 0.141 . . . . 0.0 111.263 -176.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 740' ' ' GLU . . . . . 0.483 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 1.1 mt-10 -149.59 141.38 14.95 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-O 120.546 0.212 . . . . 0.0 111.23 -175.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 741' ' ' PRO . . . . . 0.587 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 5.3 Cg_endo -88.25 123.32 1.61 Allowed 'Trans proline' 0 N--CA 1.455 -0.744 0 C-N-CA 123.424 2.749 . . . . 0.0 112.239 175.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 742' ' ' THR . . . . . 0.493 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.2 OUTLIER -104.27 138.65 19.58 Favored Pre-proline 0 C--N 1.322 -0.622 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.929 179.073 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 743' ' ' PRO . . . . . 0.493 ' HD2' HG22 ' A' ' 742' ' ' THR . 37.0 Cg_endo -67.43 -7.13 18.24 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.882 2.388 . . . . 0.0 112.764 179.595 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -102.87 -8.72 20.5 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.114 0.483 . . . . 0.0 110.455 177.052 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -111.8 158.97 18.75 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.774 -171.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 746' ' ' VAL . . . . . 0.655 HG21 HD11 ' A' ' 795' ' ' LEU . 27.3 m -120.76 148.55 23.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.173 -176.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 747' ' ' LEU . . . . . 0.568 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 1.0 OUTLIER -117.64 112.24 20.24 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.036 177.766 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 748' ' ' ILE . . . . . 0.825 HG23 ' HB ' ' A' ' 763' ' ' VAL . 0.2 OUTLIER -99.37 107.15 20.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.906 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 176.151 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 12.6 t -107.39 158.33 17.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.289 0.566 . . . . 0.0 112.079 -173.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 750' ' ' ASP . . . . . 0.455 ' HB2' HG13 ' A' ' 713' ' ' VAL . 3.5 t70 -106.22 129.05 54.34 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.027 175.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 751' ' ' GLU . . . . . 0.427 ' HB2' ' NH2' ' A' ' 714' ' ' ARG . 3.8 mm-40 66.94 -175.75 0.19 Allowed 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.514 0.726 . . . . 0.0 111.988 178.337 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 752' ' ' VAL . . . . . 0.561 HG23 ' HB2' ' A' ' 769' ' ' HIS . 55.9 t -69.88 130.43 34.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.743 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -123.01 158.47 27.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.68 -178.543 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.89 -36.34 25.43 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.208 0.527 . . . . 0.0 110.185 178.533 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 755' ' ' LYS . . . . . 0.471 ' HE2' ' HE2' ' A' ' 736' ' ' TYR . 0.0 OUTLIER -113.24 110.38 20.29 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 176.937 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 756' ' ' LYS . . . . . 0.496 ' O ' ' HB2' ' A' ' 757' ' ' TRP . 0.0 OUTLIER -73.2 -57.59 3.91 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.432 -178.815 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 757' ' ' TRP . . . . . 0.667 ' HB2' ' HB ' ' A' ' 762' ' ' VAL . 2.3 t-105 164.31 162.58 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.459 -169.351 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -147.1 53.27 1.08 Allowed 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 174.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 759' ' ' GLY . . . . . 0.414 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -146.53 -133.98 2.54 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.884 -175.621 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.22 -57.69 5.02 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.722 0.296 . . . . 0.0 111.316 -176.531 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -162.61 145.89 11.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.032 0.444 . . . . 0.0 111.298 -178.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 762' ' ' VAL . . . . . 0.667 ' HB ' ' HB2' ' A' ' 757' ' ' TRP . 2.0 p -118.58 123.23 71.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.838 175.472 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 763' ' ' VAL . . . . . 0.825 ' HB ' HG23 ' A' ' 748' ' ' ILE . 48.0 t -103.74 108.99 25.82 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-O 121.058 0.456 . . . . 0.0 109.812 178.457 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 764' ' ' THR . . . . . . . . . . . . . 5.5 m -93.14 112.53 24.51 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.156 -178.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 765' ' ' PHE . . . . . 0.489 ' CZ ' ' HG ' ' A' ' 791' ' ' LEU . 34.0 m-85 -83.97 125.99 32.59 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 175.071 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 766' ' ' CYS . . . . . 0.412 ' HB3' HG12 ' A' ' 770' ' ' ILE . 0.0 OUTLIER -95.28 133.85 38.71 Favored 'General case' 0 C--N 1.314 -0.944 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.106 -179.453 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.76 -74.3 0.64 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.37 -0.377 . . . . 0.0 109.986 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 1.7 mmt85 -106.86 -35.38 6.96 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 175.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . 0.561 ' HB2' HG23 ' A' ' 752' ' ' VAL . 5.7 m80 -117.77 155.38 30.14 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.382 175.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 770' ' ' ILE . . . . . 0.449 ' O ' HG22 ' A' ' 752' ' ' VAL . 52.1 mt -107.8 -55.01 5.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 176.026 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . 70.7 -74.28 0.6 Allowed Glycine 0 C--N 1.33 0.231 0 CA-C-N 115.749 -0.659 . . . . 0.0 112.373 177.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 772' ' ' ILE . . . . . 0.417 ' HA ' ' HD3' ' A' ' 773' ' ' PRO . 14.6 mm -65.24 122.78 81.78 Favored Pre-proline 0 C--N 1.324 -0.53 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 177.419 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 773' ' ' PRO . . . . . 0.508 ' HB2' ' HG3' ' A' ' 776' ' ' LYS . 41.6 Cg_exo -56.91 -72.06 0.03 OUTLIER 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 122.679 2.252 . . . . 0.0 112.672 -176.107 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . 0.604 ' O ' ' HB3' ' A' ' 780' ' ' GLU . 1.1 pt? 169.83 -153.12 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.277 0 N-CA-C 108.65 -0.871 . . . . 0.0 108.65 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 775' ' ' GLU . . . . . 0.566 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 1.5 mp0 -59.47 69.14 0.01 OUTLIER 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.306 0.574 . . . . 0.0 111.869 170.47 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . 0.508 ' HG3' ' HB2' ' A' ' 773' ' ' PRO . 0.0 OUTLIER -106.28 -38.38 6.25 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.1 174.863 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -103.0 153.21 38.45 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.398 171.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -61.3 98.4 0.15 Allowed 'Trans proline' 0 CA--C 1.529 0.252 0 C-N-CA 122.494 2.129 . . . . 0.0 112.258 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 116.63 -1.24 20.19 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.265 179.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 780' ' ' GLU . . . . . 0.604 ' HB3' ' O ' ' A' ' 774' ' ' LEU . 0.9 OUTLIER -87.69 122.77 31.78 Favored 'General case' 0 C--O 1.219 -0.519 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 -179.546 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 28.2 m95 -132.82 146.78 52.12 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 177.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . 0.558 HG13 ' HA ' ' A' ' 774' ' ' LEU . 33.6 m -136.34 158.26 37.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 176.375 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 783' ' ' HIS . . . . . 0.46 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.0 OUTLIER -172.86 120.27 0.37 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.746 175.044 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.63 101.52 14.2 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 172.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 785' ' ' VAL . . . . . 0.675 HG13 ' H ' ' A' ' 787' ' ' ALA . 4.9 p -175.42 158.01 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.191 -176.55 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -86.85 9.66 18.48 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.038 178.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 787' ' ' ALA . . . . . 0.675 ' H ' HG13 ' A' ' 785' ' ' VAL . . . 58.33 71.87 0.95 Allowed Pre-proline 0 N--CA 1.468 0.427 0 CA-C-N 115.647 -0.706 . . . . 0.0 112.262 177.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 788' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -66.27 -61.8 0.08 OUTLIER 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.35 2.033 . . . . 0.0 111.589 178.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -141.25 -31.68 0.57 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.937 0.399 . . . . 0.0 111.153 176.105 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 790' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -61.8 -44.49 96.77 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.802 -0.636 . . . . 0.0 112.659 -170.322 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 791' ' ' LEU . . . . . 0.489 ' HG ' ' CZ ' ' A' ' 765' ' ' PHE . 0.6 OUTLIER -68.93 -53.47 14.47 Favored Pre-proline 0 C--N 1.326 -0.437 0 C-N-CA 120.601 -0.44 . . . . 0.0 111.67 -176.87 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 792' ' ' PRO . . . . . 0.43 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 9.6 Cg_endo -57.03 -32.47 93.23 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 121.554 1.503 . . . . 0.0 112.048 175.736 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -69.58 -40.99 76.4 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.784 0.326 . . . . 0.0 110.85 177.072 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -59.63 -44.76 93.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.152 0.501 . . . . 0.0 109.751 177.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 795' ' ' LEU . . . . . 0.655 HD11 HG21 ' A' ' 746' ' ' VAL . 0.7 OUTLIER -63.32 -48.56 77.53 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.904 -179.768 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -61.99 -41.61 98.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.352 -179.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.17 -33.92 76.52 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.88 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -69.31 -32.97 55.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.695 179.57 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -96.29 3.16 53.22 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.4 -179.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 800' ' ' LEU . . . . . 0.436 ' O ' ' HB ' ' A' ' 801' ' ' ILE . 1.2 mp 70.99 -62.83 0.44 Allowed 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.611 0.764 . . . . 0.0 112.482 175.36 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 801' ' ' ILE . . . . . 0.861 ' HA ' HD21 ' A' ' 704' ' ' LEU . 1.7 mp 73.89 -51.47 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 123.454 0.702 . . . . 0.0 111.255 -177.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 73.19 -49.96 0.7 Allowed 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 172.084 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 803' ' ' MET . . . . . . . . . . . . . 6.4 mmt -61.23 -61.56 2.47 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.374 -174.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 804' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -90.6 121.87 32.9 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.261 -0.427 . . . . 0.0 109.909 178.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.92 134.61 44.85 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.837 -176.259 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -76.76 -22.62 53.5 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 174.137 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 21.5 t70 72.27 111.25 0.03 OUTLIER Pre-proline 0 N--CA 1.463 0.183 0 CA-C-N 114.578 -1.192 . . . . 0.0 112.701 171.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 808' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -93.04 24.2 0.47 Allowed 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 123.389 2.726 . . . . 0.0 111.611 173.425 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . 62.76 49.14 3.85 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.747 -177.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -120.38 89.82 3.2 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.9 179.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -83.83 108.96 17.17 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.57 -179.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -162.32 108.55 1.11 Allowed Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.385 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -81.53 143.02 13.36 Favored 'Trans proline' 0 N--CA 1.461 -0.392 0 C-N-CA 122.494 2.129 . . . . 0.0 112.263 179.125 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.1 115.72 3.98 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.082 176.655 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -118.38 104.65 10.94 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 112.115 0.413 . . . . 0.0 112.115 -173.589 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -138.34 110.81 7.49 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 173.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -134.68 53.77 1.98 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.025 0.441 . . . . 0.0 110.082 -179.528 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -74.04 -35.52 64.33 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.162 -179.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 76.5 t -88.34 115.01 27.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.457 -177.339 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -157.69 150.72 23.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.87 174.751 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 6.1 t0 58.39 71.36 0.59 Allowed 'General case' 0 N--CA 1.466 0.351 0 O-C-N 123.605 0.565 . . . . 0.0 111.914 174.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -103.03 62.73 0.8 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.13 0.49 . . . . 0.0 110.286 178.528 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -115.88 111.03 19.85 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.764 179.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -127.48 -57.12 1.29 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.806 -176.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 825' ' ' MET . . . . . 0.517 ' HE1' HG12 ' A' ' 871' ' ' ILE . 0.0 OUTLIER -100.19 109.1 21.35 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.747 178.198 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 826' ' ' MET . . . . . 0.567 ' HG3' ' HA ' ' A' ' 869' ' ' ILE . 0.0 OUTLIER -115.37 129.17 56.51 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.113 0.482 . . . . 0.0 110.952 -176.071 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 827' ' ' ILE . . . . . . . . . . . . . 2.9 mm -118.02 127.29 75.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.58 -0.737 . . . . 0.0 109.52 179.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 828' ' ' LEU . . . . . 0.507 ' HB2' HG12 ' A' ' 869' ' ' ILE . 7.7 tp -104.53 130.19 52.5 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.523 0.202 . . . . 0.0 110.748 -177.672 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 829' ' ' VAL . . . . . 0.58 HG21 HD11 ' A' ' 840' ' ' LEU . 0.3 OUTLIER -112.92 121.78 65.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.98 177.452 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 830' ' ' VAL . . . . . 0.56 HG11 ' HB2' ' A' ' 860' ' ' ALA . 0.2 OUTLIER -115.74 86.85 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.112 178.552 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 831' ' ' ASP . . . . . 0.887 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 55.0 t0 -108.94 134.02 52.16 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.434 -176.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -73.99 -13.72 60.91 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.866 178.547 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 1.1 m80 -109.24 92.65 11.66 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.179 177.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 834' ' ' PRO . . . . . 0.577 ' HA ' ' HD3' ' A' ' 837' ' ' ARG . 2.5 Cg_endo -46.33 -37.66 19.36 Favored 'Trans proline' 0 CA--C 1.534 0.521 0 C-N-CA 123.733 2.955 . . . . 0.0 114.167 -175.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 1.1 pp -65.3 -42.7 94.44 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 CA-C-O 120.921 0.391 . . . . 0.0 111.74 -178.168 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 836' ' ' ASN . . . . . 0.614 ' HB3' ' OD2' ' A' ' 831' ' ' ASP . 0.3 OUTLIER -69.62 -43.87 71.81 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.506 -0.554 . . . . 0.0 109.506 179.856 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 837' ' ' ARG . . . . . 0.887 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 1.1 ttt-85 -55.64 -40.6 72.41 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.872 -1.058 . . . . 0.0 111.032 177.077 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 838' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 838' ' ' ARG . 0.0 OUTLIER -64.75 -39.85 94.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.586 178.768 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.48 -49.16 67.53 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.211 -177.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 840' ' ' LEU . . . . . 0.58 HD11 HG21 ' A' ' 829' ' ' VAL . 2.3 pp -73.95 -27.68 61.13 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.933 -0.307 . . . . 0.0 111.173 -177.138 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -66.15 -32.69 74.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.987 0.422 . . . . 0.0 110.061 174.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -63.62 -45.73 88.95 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.928 176.119 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 843' ' ' GLN . . . . . 0.63 ' HG2' HD23 ' A' ' 929' ' ' LEU . 3.1 mt-30 -60.25 -42.21 94.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.283 175.564 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 844' ' ' LEU . . . . . . . . . . . . . 1.2 mp -58.88 -44.61 91.18 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.004 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -63.72 -41.43 98.97 Favored Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.905 -0.588 . . . . 0.0 112.326 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 68.8 m -73.19 -13.74 61.22 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.687 0.279 . . . . 0.0 111.331 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 847' ' ' LEU . . . . . 0.565 HD21 ' HA ' ' A' ' 933' ' ' LYS . 0.1 OUTLIER -83.62 -4.93 59.0 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.872 0.368 . . . . 0.0 110.691 176.828 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 87.86 17.06 58.72 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.943 -0.646 . . . . 0.0 112.884 177.091 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 849' ' ' TYR . . . . . 0.415 ' CD2' HD23 ' A' ' 936' ' ' LEU . 30.1 m-85 -112.11 144.06 42.11 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.726 0.298 . . . . 0.0 110.475 -178.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -75.69 108.25 8.4 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.108 0.48 . . . . 0.0 109.726 -179.723 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -87.61 122.03 30.8 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.55 -174.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 852' ' ' LYS . . . . . 0.4 ' O ' HD12 ' A' ' 828' ' ' LEU . 7.0 mptt -107.73 120.58 42.63 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 174.543 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -99.77 137.79 37.76 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 120.904 0.383 . . . . 0.0 111.852 -173.42 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 854' ' ' ALA . . . . . 0.411 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -150.41 157.97 43.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.056 176.294 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -149.19 75.56 1.29 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.708 179.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 856' ' ' ASP . . . . . . . . . . . . . 24.4 t70 175.16 136.95 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.828 179.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 857' ' ' GLY . . . . . 0.45 ' HA2' HD13 ' A' ' 886' ' ' LEU . . . -65.1 -44.4 94.23 Favored Glycine 0 CA--C 1.519 0.309 0 C-N-CA 120.985 -0.626 . . . . 0.0 113.307 -179.001 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 37.7 t -73.91 -44.98 50.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.029 0.442 . . . . 0.0 110.597 -177.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -66.36 -19.72 65.88 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.154 -176.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 860' ' ' ALA . . . . . 0.56 ' HB2' HG11 ' A' ' 830' ' ' VAL . . . -61.72 -39.56 91.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.905 0.383 . . . . 0.0 110.403 174.324 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 861' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.52 -34.07 65.07 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.226 178.006 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 19.9 t30 -63.28 -41.99 99.06 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.247 176.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -70.92 -31.48 45.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.374 177.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 864' ' ' LEU . . . . . 0.691 HD21 HD11 ' A' ' 897' ' ' LEU . 0.9 OUTLIER -58.89 -36.0 73.93 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.776 176.151 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -83.58 -38.27 21.87 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.847 179.828 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.69 -52.73 63.88 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.078 0.466 . . . . 0.0 110.645 179.274 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 867' ' ' ASN . . . . . 0.552 ' HB3' ' H ' ' A' ' 868' ' ' HIS . 0.1 OUTLIER -106.19 -127.35 0.25 Allowed 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.798 -0.816 . . . . 0.0 108.798 176.292 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 868' ' ' HIS . . . . . 0.552 ' H ' ' HB3' ' A' ' 867' ' ' ASN . 0.2 OUTLIER -165.19 -56.17 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 110.07 -0.345 . . . . 0.0 110.07 174.371 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 869' ' ' ILE . . . . . 0.567 ' HA ' ' HG3' ' A' ' 826' ' ' MET . 2.4 mp 74.24 140.55 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 O-C-N 123.758 0.661 . . . . 0.0 111.562 174.73 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -87.43 -57.99 2.75 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.417 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 871' ' ' ILE . . . . . 0.517 HG12 ' HE1' ' A' ' 825' ' ' MET . 41.4 mm -111.82 126.99 69.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.323 -179.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 872' ' ' VAL . . . . . 0.659 ' HB ' ' HB ' ' A' ' 899' ' ' VAL . 0.1 OUTLIER -105.11 137.02 36.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.788 -178.689 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 873' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -125.0 124.76 42.68 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 173.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -121.89 101.79 7.78 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 120.989 0.423 . . . . 0.0 109.993 178.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 875' ' ' ASP . . . . . 0.67 ' HB2' ' HE2' ' A' ' 925' ' ' LYS . 0.5 OUTLIER -107.48 115.67 30.56 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 122.013 0.911 . . . . 0.0 110.907 -178.673 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 3.1 p -137.33 128.87 41.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 114.951 -1.022 . . . . 0.0 110.213 -176.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 877' ' ' ASN . . . . . 0.582 ' ND2' ' HB3' ' A' ' 904' ' ' ALA . 1.8 t30 -155.96 64.28 0.58 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.43 0.633 . . . . 0.0 110.393 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 6.8 mmt -154.9 164.12 22.1 Favored Pre-proline 0 C--N 1.32 -0.699 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 176.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 879' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -65.3 66.54 0.33 Allowed 'Trans proline' 0 CA--C 1.532 0.395 0 C-N-CA 122.59 2.194 . . . . 0.0 112.016 174.168 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -78.08 -41.76 34.32 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.694 -0.684 . . . . 0.0 109.742 179.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 10.1 mtp 66.97 11.74 8.55 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.447 176.223 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -113.76 16.24 18.55 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.248 0.546 . . . . 0.0 110.485 179.139 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -81.79 39.9 2.59 Favored Glycine 0 N--CA 1.451 -0.34 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.406 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 884' ' ' TYR . . . . . 0.432 ' O ' ' HB2' ' A' ' 888' ' ' GLN . 2.7 t80 -138.5 -50.91 0.56 Allowed 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 177.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -66.05 -46.54 77.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.64 179.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 886' ' ' LEU . . . . . 0.524 ' HG ' ' N ' ' A' ' 887' ' ' THR . 0.0 OUTLIER -62.97 -45.94 90.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.67 -177.974 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 887' ' ' THR . . . . . 0.524 ' N ' ' HG ' ' A' ' 886' ' ' LEU . 0.0 OUTLIER -65.39 -42.37 92.72 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.075 -179.469 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 888' ' ' GLN . . . . . 0.432 ' HB2' ' O ' ' A' ' 884' ' ' TYR . 0.3 OUTLIER -64.69 -47.3 78.87 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.889 -178.712 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 889' ' ' ARG . . . . . 0.532 ' HD3' ' OE1' ' A' ' 892' ' ' GLN . 13.1 mmt180 -66.54 -32.41 73.75 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.532 -0.303 . . . . 0.0 111.074 -177.537 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 890' ' ' ILE . . . . . 0.499 HG23 HD13 ' A' ' 895' ' ' LEU . 5.3 mt -60.55 -51.17 76.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.964 0.412 . . . . 0.0 110.718 178.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 891' ' ' ARG . . . . . 0.632 ' HB3' ' HA2' ' A' ' 918' ' ' GLY . 0.1 OUTLIER -74.67 -31.16 61.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.859 -178.997 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 892' ' ' GLN . . . . . 0.532 ' OE1' ' HD3' ' A' ' 889' ' ' ARG . 7.5 mt-30 -65.61 -41.99 92.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.589 179.313 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.14 -29.21 68.86 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.009 177.218 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 92.7 64.03 1.11 Allowed Glycine 0 N--CA 1.443 -0.842 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.736 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 895' ' ' LEU . . . . . 0.499 HD13 HG23 ' A' ' 890' ' ' ILE . 0.3 OUTLIER -67.26 111.09 3.79 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 178.173 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.66 0.58 56.28 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.14 -176.167 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 897' ' ' LEU . . . . . 0.691 HD11 HD21 ' A' ' 864' ' ' LEU . 0.0 OUTLIER -107.95 135.78 19.82 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.436 176.806 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -67.96 124.78 12.23 Favored 'Trans proline' 0 C--O 1.235 0.338 0 C-N-CA 122.653 2.235 . . . . 0.0 112.32 -177.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 899' ' ' VAL . . . . . 0.659 ' HB ' ' HB ' ' A' ' 872' ' ' VAL . 0.2 OUTLIER -113.62 131.8 64.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 121.573 0.702 . . . . 0.0 110.526 179.783 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 900' ' ' ILE . . . . . 0.679 HG23 ' HB2' ' A' ' 921' ' ' SER . 0.4 OUTLIER -101.09 117.85 46.95 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.161 178.873 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -91.68 117.06 5.13 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.809 -0.71 . . . . 0.0 111.496 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 902' ' ' VAL . . . . . 0.713 ' HB ' ' HB2' ' A' ' 923' ' ' LEU . 0.5 OUTLIER -105.66 134.4 47.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.717 0 CA-C-O 121.425 0.631 . . . . 0.0 110.699 -175.921 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -139.73 159.32 42.44 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.344 -175.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 904' ' ' ALA . . . . . 0.612 ' HB2' ' HB2' ' A' ' 925' ' ' LYS . . . -109.95 114.33 27.79 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 122.35 -0.219 . . . . 0.0 110.485 179.157 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 61.02 54.66 3.31 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.667 -178.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -104.33 93.28 4.73 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.36 177.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.37 125.66 21.76 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.598 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . 59.59 48.08 9.97 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.143 -178.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.22 -30.03 70.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.153 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 910' ' ' GLU . . . . . 0.49 ' HA ' ' SG ' ' A' ' 922' ' ' CYS . 0.0 OUTLIER -65.01 -43.99 90.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.014 175.646 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -63.33 -43.25 98.28 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.341 177.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -61.46 -42.38 98.69 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.977 179.17 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.97 -41.52 91.07 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.145 -179.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 69.4 m -69.5 -31.67 70.05 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.862 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.65 -46.25 89.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.94 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 916' ' ' GLU . . . . . 0.546 ' HG2' ' H ' ' A' ' 918' ' ' GLY . 0.0 OUTLIER -77.71 -32.29 52.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.557 178.615 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 917' ' ' SER . . . . . 0.488 ' N ' ' HG2' ' A' ' 916' ' ' GLU . 0.1 OUTLIER 47.03 46.82 16.06 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.383 -178.664 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 918' ' ' GLY . . . . . 0.632 ' HA2' ' HB3' ' A' ' 891' ' ' ARG . . . -122.56 -32.2 0.98 Allowed Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.605 -178.361 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 919' ' ' MET . . . . . 0.651 ' HA ' HG13 ' A' ' 899' ' ' VAL . 3.3 mtt -83.16 -86.87 0.1 Allowed 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 121.206 -0.198 . . . . 0.0 110.5 179.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 920' ' ' ASP . . . . . 0.555 ' HB2' ' O ' ' A' ' 919' ' ' MET . 43.8 t0 161.18 -67.72 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.616 0 O-C-N 124.183 0.927 . . . . 0.0 109.276 177.295 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . 0.679 ' HB2' HG23 ' A' ' 900' ' ' ILE . 66.3 m -127.06 -177.87 4.21 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.502 -178.578 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 922' ' ' CYS . . . . . 0.49 ' SG ' ' HA ' ' A' ' 910' ' ' GLU . 0.5 OUTLIER -139.59 145.44 38.58 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.897 0.379 . . . . 0.0 111.094 -177.021 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 923' ' ' LEU . . . . . 0.713 ' HB2' ' HB ' ' A' ' 902' ' ' VAL . 58.4 mt -130.04 166.73 19.53 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.041 179.346 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 924' ' ' SER . . . . . 0.508 ' O ' HG23 ' A' ' 927' ' ' VAL . 0.7 OUTLIER -91.52 144.75 25.23 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.016 173.971 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 925' ' ' LYS . . . . . 0.67 ' HE2' ' HB2' ' A' ' 875' ' ' ASP . 2.7 tmtt? -58.72 -46.71 99.55 Favored Pre-proline 0 N--CA 1.467 0.38 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 926' ' ' PRO . . . . . 0.496 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 46.7 Cg_endo -69.69 55.38 1.24 Allowed 'Trans proline' 0 C--N 1.355 0.908 0 C-N-CA 122.055 1.837 . . . . 0.0 112.592 174.296 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 927' ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' ' 924' ' ' SER . 0.9 OUTLIER -67.97 129.19 32.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.789 176.786 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.57 167.89 10.86 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.824 179.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 929' ' ' LEU . . . . . 0.63 HD23 ' HG2' ' A' ' 843' ' ' GLN . 0.0 OUTLIER -54.9 -45.38 74.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.872 0.367 . . . . 0.0 110.764 179.201 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -64.06 -40.22 95.8 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.912 0.387 . . . . 0.0 110.721 -178.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 13.6 t -65.27 -49.98 75.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.802 -178.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 932' ' ' ILE . . . . . 0.591 ' O ' ' HB2' ' A' ' 936' ' ' LEU . 2.9 tp -66.23 -31.4 53.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.812 0.339 . . . . 0.0 110.659 -179.123 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 933' ' ' LYS . . . . . 0.565 ' HA ' HD21 ' A' ' 847' ' ' LEU . 0.3 OUTLIER -66.21 -49.17 68.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.983 178.936 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 934' ' ' GLN . . . . . 0.467 ' HG3' ' N ' ' A' ' 935' ' ' THR . 0.1 OUTLIER -75.22 -42.31 55.75 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.648 -174.375 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 935' ' ' THR . . . . . 0.467 ' N ' ' HG3' ' A' ' 934' ' ' GLN . 3.3 m -70.14 -42.2 72.89 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.531 0.197 . . . . 0.0 111.531 -175.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 936' ' ' LEU . . . . . 0.591 ' HB2' ' O ' ' A' ' 932' ' ' ILE . 0.7 OUTLIER -67.17 -44.54 79.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.695 0.283 . . . . 0.0 110.788 -179.985 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 80.4 m -68.17 -38.66 82.3 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.226 -178.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 938' ' ' LEU . . . . . 0.505 ' O ' ' HB2' ' A' ' 942' ' ' ARG . 0.0 OUTLIER -63.52 -42.18 98.46 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.907 0.384 . . . . 0.0 110.423 178.078 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 939' ' ' TYR . . . . . 0.492 ' O ' HG22 ' A' ' 943' ' ' VAL . 0.4 OUTLIER -69.28 -40.91 77.48 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.91 179.311 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -59.15 -47.83 83.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.588 -178.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 941' ' ' GLU . . . . . 0.441 ' HG3' ' N ' ' A' ' 942' ' ' ARG . 3.8 pt-20 -71.53 -32.96 68.74 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.759 0.314 . . . . 0.0 110.598 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 942' ' ' ARG . . . . . 0.505 ' HB2' ' O ' ' A' ' 938' ' ' LEU . 2.3 ttp180 -65.23 -48.26 73.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.315 -178.016 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 943' ' ' VAL . . . . . 0.492 HG22 ' O ' ' A' ' 939' ' ' TYR . 18.1 m -70.92 -36.67 64.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 120.962 0.411 . . . . 0.0 111.367 -178.112 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.3 -38.68 63.27 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.494 -176.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 8.5 pttp -70.76 -35.39 72.6 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.657 0.265 . . . . 0.0 110.669 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 19.8 m -73.03 -23.26 60.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.13 0.491 . . . . 0.0 110.423 177.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.22 -21.57 33.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.371 176.647 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 32.3 t0 55.36 50.82 14.07 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 123.874 0.733 . . . . 0.0 110.826 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 2.1 m . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.532 -0.747 . . . . 0.0 109.807 178.717 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.863 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 109.45 -94.84 0.85 Allowed Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.831 -0.7 . . . . 0.0 112.39 178.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . 90.32 18.57 48.95 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.503 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -119.86 114.15 21.66 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.897 0.38 . . . . 0.0 110.603 -179.31 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 700' ' ' GLY . . . . . 0.406 ' HA2' ' SD ' ' A' ' 803' ' ' MET . . . -108.31 135.3 12.75 Favored Glycine 0 N--CA 1.444 -0.798 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.943 -178.242 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 1.5 t -92.91 -32.26 4.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 174.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 702' ' ' GLU . . . . . 0.409 ' HB3' ' H ' ' A' ' 703' ' ' GLY . 26.4 mp0 -125.91 -158.74 0.86 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.237 -0.892 . . . . 0.0 109.219 175.394 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 703' ' ' GLY . . . . . 0.409 ' H ' ' HB3' ' A' ' 702' ' ' GLU . . . 81.55 -58.19 4.89 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.444 -0.884 . . . . 0.0 111.726 -177.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.418 ' H ' ' HG ' ' A' ' 704' ' ' LEU . 0.0 OUTLIER -78.95 92.2 4.91 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 175.017 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -137.0 94.4 2.95 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.547 -174.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 88.8 3.31 77.26 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.832 -0.699 . . . . 0.0 113.402 171.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.87 137.83 57.46 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 178.326 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 708' ' ' ARG . . . . . . . . . . . . . 3.8 mtt85 -103.02 156.29 17.78 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.215 0.531 . . . . 0.0 111.615 -177.354 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -138.74 128.78 25.34 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.02 -0.991 . . . . 0.0 108.741 174.167 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 710' ' ' TRP . . . . . 0.823 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 96.5 m95 -92.26 129.31 38.24 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.408 0.623 . . . . 0.0 110.468 -176.263 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 711' ' ' LEU . . . . . 0.636 HD21 ' HB2' ' A' ' 719' ' ' CYS . 0.9 OUTLIER -118.1 125.95 51.3 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.668 -172.657 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -126.15 52.7 1.67 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.311 0.577 . . . . 0.0 110.045 177.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 713' ' ' VAL . . . . . 0.699 ' HA ' ' HB3' ' A' ' 750' ' ' ASP . 87.5 t -111.95 120.96 63.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.917 179.434 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 714' ' ' ARG . . . . . 0.471 ' NH2' ' HB3' ' A' ' 751' ' ' GLU . 1.9 mtm180 -81.34 -19.57 42.52 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.081 0.467 . . . . 0.0 110.461 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -75.62 100.17 4.54 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.853 176.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 716' ' ' ALA . . . . . 0.622 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -61.68 -35.29 77.57 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.714 -173.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -65.07 -46.79 79.74 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.008 0.433 . . . . 0.0 110.44 177.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 2.3 tt -69.27 -45.17 70.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.762 -179.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 719' ' ' CYS . . . . . 0.636 ' HB2' HD21 ' A' ' 711' ' ' LEU . 8.3 p -66.82 -40.68 88.12 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.941 -177.325 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 720' ' ' GLN . . . . . 0.456 ' HB2' ' O ' ' A' ' 716' ' ' ALA . 0.1 OUTLIER -59.95 -41.33 91.63 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-O 120.586 0.232 . . . . 0.0 110.811 177.925 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -56.71 -52.82 63.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.899 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 722' ' ' LEU . . . . . 0.443 HD13 HG21 ' A' ' 748' ' ' ILE . 3.2 mt -67.08 -47.46 71.17 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.094 -178.44 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 723' ' ' GLU . . . . . 0.909 ' HA ' HG21 ' A' ' 733' ' ' VAL . 0.3 OUTLIER -61.42 -39.29 90.25 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.278 -174.386 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 724' ' ' THR . . . . . 0.558 ' HA ' ' CG ' ' A' ' 727' ' ' GLN . 88.3 m -73.01 -34.2 66.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.693 0.282 . . . . 0.0 111.155 -178.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 50.4 m -61.98 -36.15 80.62 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.761 0.315 . . . . 0.0 110.933 177.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 726' ' ' LEU . . . . . 0.554 HD21 HD12 ' A' ' 795' ' ' LEU . 1.1 mt -78.42 -41.36 33.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.271 -178.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 727' ' ' GLN . . . . . 0.558 ' CG ' ' HA ' ' A' ' 724' ' ' THR . 1.7 pt20 -74.2 -4.82 38.23 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.973 0.416 . . . . 0.0 111.111 -179.287 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.4 -22.26 65.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.171 175.102 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 729' ' ' SER . . . . . 0.51 ' HB2' ' H ' ' A' ' 730' ' ' GLY . 0.1 OUTLIER -104.38 -107.98 0.28 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.227 177.358 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 730' ' ' GLY . . . . . 0.51 ' H ' ' HB2' ' A' ' 729' ' ' SER . . . -138.93 25.55 2.79 Favored Glycine 0 CA--C 1.51 -0.239 0 N-CA-C 110.922 -0.871 . . . . 0.0 110.922 179.134 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 731' ' ' ILE . . . . . 0.44 ' O ' ' HA ' ' A' ' 727' ' ' GLN . 1.0 OUTLIER -107.47 146.68 13.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 -178.067 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 732' ' ' VAL . . . . . . . . . . . . . 2.1 p -123.36 131.57 72.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.043 0.449 . . . . 0.0 110.981 -176.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 733' ' ' VAL . . . . . 0.909 HG21 ' HA ' ' A' ' 723' ' ' GLU . 3.7 t -101.44 147.56 8.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 177.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -149.01 141.61 24.41 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.816 0.341 . . . . 0.0 111.057 -173.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -59.48 118.21 5.77 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.829 178.325 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 736' ' ' TYR . . . . . 0.823 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 36.5 t80 -85.31 91.01 8.06 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.189 0.519 . . . . 0.0 110.833 -179.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 737' ' ' GLU . . . . . 0.491 ' H ' ' HG3' ' A' ' 737' ' ' GLU . 0.0 OUTLIER -93.46 -128.66 0.12 Allowed 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.312 172.061 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 738' ' ' GLY . . . . . 0.482 ' H ' ' HB2' ' A' ' 737' ' ' GLU . . . -80.93 59.33 4.75 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.615 -0.803 . . . . 0.0 112.398 178.155 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 739' ' ' GLN . . . . . 0.495 ' HG2' ' CH2' ' A' ' 710' ' ' TRP . 0.9 OUTLIER -107.37 176.24 5.22 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 -179.049 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 740' ' ' GLU . . . . . 0.441 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 1.1 mt-10 -87.0 141.02 32.91 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.788 -177.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 741' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 740' ' ' GLU . 5.4 Cg_endo -87.69 121.39 1.55 Allowed 'Trans proline' 0 N--CA 1.453 -0.888 0 C-N-CA 123.023 2.482 . . . . 0.0 111.585 175.031 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 742' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.16 136.24 20.5 Favored Pre-proline 0 C--N 1.32 -0.708 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.444 -174.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 743' ' ' PRO . . . . . 0.752 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 31.8 Cg_endo -65.89 -9.62 23.79 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 123.045 2.497 . . . . 0.0 112.644 177.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -101.84 -1.1 32.97 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.657 175.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 37.2 m-20 -110.79 150.85 28.52 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.894 0.378 . . . . 0.0 110.911 -174.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 2.4 p -117.23 136.75 53.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.449 -178.057 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 747' ' ' LEU . . . . . 0.408 HD23 ' O ' ' A' ' 710' ' ' TRP . 0.4 OUTLIER -100.45 136.8 39.76 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.015 -0.538 . . . . 0.0 109.984 177.707 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 748' ' ' ILE . . . . . 0.443 HG21 HD13 ' A' ' 722' ' ' LEU . 18.0 mt -120.12 107.69 21.52 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 171.22 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.05 164.79 11.69 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.813 -0.631 . . . . 0.0 112.159 -170.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 750' ' ' ASP . . . . . 0.699 ' HB3' ' HA ' ' A' ' 713' ' ' VAL . 0.0 OUTLIER -129.01 129.34 45.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.936 173.751 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 751' ' ' GLU . . . . . 0.968 ' HG2' ' H ' ' A' ' 752' ' ' VAL . 20.7 tt0 65.3 -178.44 0.18 Allowed 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.682 0.753 . . . . 0.0 111.697 -179.741 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 752' ' ' VAL . . . . . 0.968 ' H ' ' HG2' ' A' ' 751' ' ' GLU . 4.5 p -61.66 132.55 27.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 114.917 -1.038 . . . . 0.0 111.294 178.176 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 8.1 p -129.69 153.77 39.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.168 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -96.54 40.95 1.12 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.758 0.313 . . . . 0.0 111.559 -177.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.08 154.29 40.02 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 177.722 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 756' ' ' LYS . . . . . 0.429 ' O ' ' HB3' ' A' ' 757' ' ' TRP . 3.7 tptp -102.24 -37.6 8.03 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 121.316 -0.154 . . . . 0.0 111.271 -177.182 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 757' ' ' TRP . . . . . 0.525 ' CD1' ' HB ' ' A' ' 762' ' ' VAL . 63.5 t-105 72.1 105.34 0.07 Allowed 'General case' 0 N--CA 1.468 0.432 0 O-C-N 123.88 0.737 . . . . 0.0 111.312 179.273 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 4.9 mm100 -100.27 84.4 2.81 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.061 177.177 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 759' ' ' GLY . . . . . 0.752 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -144.71 -149.08 4.97 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.574 -0.822 . . . . 0.0 113.134 -177.534 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.97 -53.74 45.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.238 0.542 . . . . 0.0 109.872 -179.566 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -164.04 156.3 17.1 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.068 178.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 762' ' ' VAL . . . . . 0.525 ' HB ' ' CD1' ' A' ' 757' ' ' TRP . 2.4 p -134.39 113.71 17.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 175.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -111.67 105.87 19.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.22 -177.65 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 764' ' ' THR . . . . . 0.783 ' HB ' HG12 ' A' ' 782' ' ' VAL . 68.1 m -99.23 120.48 39.61 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.546 -177.218 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 765' ' ' PHE . . . . . 0.527 ' CE1' HG23 ' A' ' 785' ' ' VAL . 8.8 m-85 -76.64 130.34 37.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.138 175.424 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 766' ' ' CYS . . . . . 0.545 ' O ' ' HA ' ' A' ' 784' ' ' SER . 3.2 m -105.25 131.45 52.69 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-O 120.968 0.413 . . . . 0.0 109.964 176.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.6 22.54 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 178.687 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 768' ' ' ARG . . . . . 0.436 ' HB3' ' H ' ' A' ' 769' ' ' HIS . 0.0 OUTLIER -157.66 -104.24 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.8 -1.091 . . . . 0.0 108.424 -177.088 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . 0.436 ' H ' ' HB3' ' A' ' 768' ' ' ARG . 0.2 OUTLIER -111.13 147.77 34.15 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 109.921 -0.399 . . . . 0.0 109.921 171.409 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 4.6 mt -106.81 154.05 7.86 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.802 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.867 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 771' ' ' GLY . . . . . 0.72 ' HA3' HG23 ' A' ' 752' ' ' VAL . . . -151.09 -39.65 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.871 -0.68 . . . . 0.0 111.765 -179.451 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 772' ' ' ILE . . . . . 0.443 ' HA ' ' HD3' ' A' ' 773' ' ' PRO . 32.9 mm -88.42 131.26 42.76 Favored Pre-proline 0 C--N 1.324 -0.503 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 176.608 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 773' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 772' ' ' ILE . 12.1 Cg_exo -70.64 172.98 12.45 Favored 'Trans proline' 0 N--CA 1.463 -0.316 0 C-N-CA 122.759 2.306 . . . . 0.0 111.936 178.43 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . 0.554 ' HB3' HG22 ' A' ' 782' ' ' VAL . 0.7 OUTLIER -90.16 -152.57 0.26 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.734 -179.045 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 775' ' ' GLU . . . . . 0.534 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 1.2 mp0 -62.21 72.42 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.61 -21.47 30.33 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 168.177 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 777' ' ' ALA . . . . . 0.46 ' HB3' ' HG3' ' A' ' 780' ' ' GLU . . . -143.1 155.35 62.02 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 114.321 -1.309 . . . . 0.0 109.102 179.623 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -65.22 78.08 0.23 Allowed 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.891 2.394 . . . . 0.0 111.731 175.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 163.59 -28.31 0.23 Allowed Glycine 0 N--CA 1.447 -0.604 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.54 -178.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 780' ' ' GLU . . . . . 0.534 ' O ' ' HG3' ' A' ' 775' ' ' GLU . 3.5 mt-10 -89.04 121.95 31.89 Favored 'General case' 0 C--O 1.222 -0.39 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 179.385 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 34.4 m95 -139.38 139.0 37.06 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.929 0.395 . . . . 0.0 110.647 -178.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . 0.783 HG12 ' HB ' ' A' ' 764' ' ' THR . 28.5 m -138.37 153.52 26.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 169.334 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 783' ' ' HIS . . . . . . . . . . . . . 4.9 t-160 -155.88 120.7 4.71 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.765 0.317 . . . . 0.0 110.454 176.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 784' ' ' SER . . . . . 0.545 ' HA ' ' O ' ' A' ' 766' ' ' CYS . 0.4 OUTLIER -84.73 100.86 11.77 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.059 178.268 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 785' ' ' VAL . . . . . 0.527 HG23 ' CE1' ' A' ' 765' ' ' PHE . 0.0 OUTLIER -162.01 -178.51 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.53 178.548 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -113.8 31.87 6.23 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.79 0.329 . . . . 0.0 110.572 178.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 59.46 73.19 0.7 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.009 178.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 788' ' ' PRO . . . . . 0.676 ' HD2' ' OE1' ' A' ' 790' ' ' GLU . 12.0 Cg_exo -71.8 -67.91 0.02 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.711 2.274 . . . . 0.0 110.947 173.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 1.4 p-80 176.45 28.48 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 122.784 0.434 . . . . 0.0 110.816 175.246 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 790' ' ' GLU . . . . . 0.676 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -101.25 -43.83 5.85 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.02 0.438 . . . . 0.0 110.265 -177.923 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 791' ' ' LEU . . . . . 0.486 HD22 ' CE2' ' A' ' 765' ' ' PHE . 0.2 OUTLIER -66.66 -47.47 56.21 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 115.822 -0.627 . . . . 0.0 111.788 179.07 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 792' ' ' PRO . . . . . 0.437 ' HG3' HD23 ' A' ' 722' ' ' LEU . 39.8 Cg_exo -57.25 -33.65 96.4 Favored 'Trans proline' 0 C--N 1.359 1.102 0 C-N-CA 121.701 1.6 . . . . 0.0 111.58 175.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -68.61 -41.76 79.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.584 177.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.57 -28.43 65.96 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.878 178.431 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 795' ' ' LEU . . . . . 0.554 HD12 HD21 ' A' ' 726' ' ' LEU . 0.2 OUTLIER -63.88 -40.5 96.69 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.959 -0.386 . . . . 0.0 109.959 177.521 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 796' ' ' ALA . . . . . 0.451 ' HB1' HD11 ' A' ' 801' ' ' ILE . . . -68.71 -34.61 75.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.025 0.44 . . . . 0.0 110.764 176.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.9 -49.05 64.15 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.666 179.681 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -66.09 -31.17 52.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.595 177.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -62.16 -34.4 76.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.024 177.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 4.6 mt 58.47 74.62 0.43 Allowed 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.409 -178.253 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 801' ' ' ILE . . . . . 0.451 HD11 ' HB1' ' A' ' 796' ' ' ALA . 3.4 mt -62.74 -36.47 75.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.722 -179.3 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 60.83 45.06 10.2 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.745 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 803' ' ' MET . . . . . 0.406 ' SD ' ' HA2' ' A' ' 700' ' ' GLY . 0.4 OUTLIER -140.16 139.18 35.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.061 176.541 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 804' ' ' GLU . . . . . 0.488 ' H ' ' HG3' ' A' ' 804' ' ' GLU . 0.0 OUTLIER -82.05 -100.86 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 121.008 -0.277 . . . . 0.0 111.082 -177.155 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -164.75 172.65 12.74 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.286 0.565 . . . . 0.0 111.911 -176.313 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -130.11 114.62 15.97 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.305 -0.861 . . . . 0.0 108.793 174.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -136.93 101.22 9.54 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-O 120.688 0.28 . . . . 0.0 110.997 -174.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 808' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -80.47 39.21 0.82 Allowed 'Trans proline' 0 N--CA 1.463 -0.312 0 C-N-CA 123.378 2.718 . . . . 0.0 112.155 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -76.75 92.44 3.57 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.952 0.406 . . . . 0.0 111.091 -178.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -161.56 144.72 12.36 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.706 178.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -152.17 169.9 21.29 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.83 0.347 . . . . 0.0 111.394 -177.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -150.53 131.1 7.08 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.732 177.659 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -80.1 164.18 22.36 Favored 'Trans proline' 0 CA--C 1.53 0.298 0 C-N-CA 122.87 2.38 . . . . 0.0 113.367 -177.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -115.36 132.89 56.47 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.898 176.63 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -149.43 129.9 13.9 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.733 -0.212 . . . . 0.0 110.98 -179.026 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -150.01 126.86 11.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.893 0.378 . . . . 0.0 111.211 177.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.24 157.04 44.16 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.549 176.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -160.57 117.57 2.41 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.983 0.421 . . . . 0.0 111.822 -178.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 43.7 t -91.66 119.14 38.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 172.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -117.2 103.35 10.11 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.881 0.372 . . . . 0.0 111.351 -175.055 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -151.79 112.8 4.25 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.069 175.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 822' ' ' ASN . . . . . 0.412 ' HB3' ' H ' ' A' ' 823' ' ' ASP . 10.8 t-20 -94.46 -104.87 0.14 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.303 -176.433 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 823' ' ' ASP . . . . . 0.412 ' H ' ' HB3' ' A' ' 822' ' ' ASN . 12.0 t0 -167.35 162.75 14.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.854 0.359 . . . . 0.0 110.311 -177.404 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -138.31 47.27 2.0 Allowed 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 178.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 2.6 mtt -76.41 120.45 21.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.237 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 826' ' ' MET . . . . . . . . . . . . . 37.0 ttm -94.02 121.36 35.42 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.288 0.566 . . . . 0.0 111.579 -177.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 827' ' ' ILE . . . . . 0.613 HG21 HD11 ' A' ' 936' ' ' LEU . 13.6 mm -112.91 130.74 66.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 114.966 -1.015 . . . . 0.0 109.087 175.292 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 828' ' ' LEU . . . . . 0.637 ' HB3' HG22 ' A' ' 872' ' ' VAL . 34.6 tp -95.21 114.41 26.2 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.196 0.522 . . . . 0.0 110.024 -179.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 829' ' ' VAL . . . . . 0.882 ' HB ' ' HD2' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -103.09 107.31 21.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.033 -178.94 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 830' ' ' VAL . . . . . 0.656 HG22 ' HB3' ' A' ' 854' ' ' ALA . 8.9 t -109.2 130.85 61.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.197 179.59 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 831' ' ' ASP . . . . . 0.757 ' HB2' ' NE ' ' A' ' 837' ' ' ARG . 8.6 t0 -135.97 146.01 46.79 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 175.036 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.49 -17.9 62.32 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.234 0.54 . . . . 0.0 109.802 173.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 7.6 m80 -108.25 103.43 50.51 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.393 175.247 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_exo -57.34 -48.85 15.73 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 123.123 2.548 . . . . 0.0 113.984 -173.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 835' ' ' ILE . . . . . 0.428 HD13 ' HA ' ' A' ' 835' ' ' ILE . 0.3 OUTLIER -63.94 -35.62 74.0 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-O 120.957 0.408 . . . . 0.0 110.185 -178.164 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 836' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -62.46 -49.02 77.09 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.62 177.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 837' ' ' ARG . . . . . 0.882 ' HD2' ' HB ' ' A' ' 829' ' ' VAL . 0.0 OUTLIER -60.27 -47.0 87.87 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.633 -178.915 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 838' ' ' ARG . . . . . 0.41 ' HG2' HD13 ' A' ' 835' ' ' ILE . 0.0 OUTLIER -63.79 -31.11 72.18 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 123.112 0.258 . . . . 0.0 111.144 -176.256 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.82 -47.43 21.48 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.388 -176.19 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 840' ' ' LEU . . . . . . . . . . . . . 2.6 pp -73.36 -26.1 60.87 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.537 178.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -67.61 -29.7 69.1 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 173.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -64.57 -43.34 94.2 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 174.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 843' ' ' GLN . . . . . 0.407 ' HB3' ' CD2' ' A' ' 929' ' ' LEU . 8.1 mm-40 -61.24 -41.23 96.53 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.413 175.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 844' ' ' LEU . . . . . 0.501 HD11 HD12 ' A' ' 932' ' ' ILE . 0.1 OUTLIER -58.88 -35.14 72.52 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.373 175.397 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -71.27 -35.22 63.83 Favored Glycine 0 N--CA 1.449 -0.468 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.053 177.072 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.62 -16.73 63.44 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 120.958 0.408 . . . . 0.0 110.431 176.715 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 24.3 mt -80.19 -12.42 59.64 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.588 176.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 92.4 19.8 37.28 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 121.018 -0.61 . . . . 0.0 112.784 178.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 31.1 m-85 -110.82 163.28 13.95 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.632 0.253 . . . . 0.0 110.611 -179.022 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.81 108.06 20.66 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.255 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -98.77 135.74 39.81 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.669 -178.08 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.71 128.06 55.6 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 173.537 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.66 131.86 40.0 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.291 0.567 . . . . 0.0 112.19 -173.237 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 854' ' ' ALA . . . . . 0.656 ' HB3' HG22 ' A' ' 830' ' ' VAL . . . -140.01 156.95 46.38 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.631 175.379 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 855' ' ' ASN . . . . . 0.579 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 0.1 OUTLIER -146.04 71.77 1.27 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.229 0.537 . . . . 0.0 111.667 -179.149 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 856' ' ' ASP . . . . . 0.579 ' HB2' ' O ' ' A' ' 855' ' ' ASN . 3.9 t70 162.96 174.52 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.209 1.004 . . . . 0.0 108.769 175.191 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 857' ' ' GLY . . . . . 0.401 ' HA3' ' HB2' ' A' ' 886' ' ' LEU . . . -83.93 -39.19 9.58 Favored Glycine 0 N--CA 1.446 -0.684 0 N-CA-C 110.878 -0.889 . . . . 0.0 110.878 175.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 858' ' ' VAL . . . . . 0.433 ' O ' ' HB2' ' A' ' 862' ' ' ASN . 6.7 m -73.41 -31.56 33.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.811 0.338 . . . . 0.0 110.297 177.488 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 859' ' ' ASP . . . . . 0.404 ' H ' ' HB3' ' A' ' 856' ' ' ASP . 25.5 t0 -65.59 -48.72 71.37 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.521 178.358 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -62.66 -42.42 99.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.411 -179.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 861' ' ' LEU . . . . . 0.578 HD21 ' HG ' ' A' ' 893' ' ' LEU . 56.3 tp -69.26 -38.19 78.29 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.877 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 862' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' A' ' 858' ' ' VAL . 33.7 t30 -57.83 -54.93 41.35 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.9 -179.29 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 8.1 p -63.09 -31.49 52.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.646 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 864' ' ' LEU . . . . . 0.522 HD11 HD21 ' A' ' 897' ' ' LEU . 0.6 OUTLIER -64.39 -36.69 84.96 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.02 178.673 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -76.3 -24.73 54.38 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.263 0.554 . . . . 0.0 110.255 179.627 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.44 -53.21 8.44 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.015 179.413 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -135.31 144.57 46.81 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.207 -175.786 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -70.4 138.24 51.13 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.184 0.516 . . . . 0.0 111.792 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 869' ' ' ILE . . . . . 0.623 HG21 ' HB2' ' A' ' 828' ' ' LEU . 5.6 mt -131.69 139.42 50.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 175.514 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -77.06 -59.39 2.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.863 0.363 . . . . 0.0 111.197 -173.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 871' ' ' ILE . . . . . 0.434 HG22 HG23 ' A' ' 827' ' ' ILE . 1.1 mp -117.95 130.46 72.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 CA-C-O 120.908 0.385 . . . . 0.0 110.141 -179.442 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 872' ' ' VAL . . . . . 0.637 HG22 ' HB3' ' A' ' 828' ' ' LEU . 53.8 t -123.42 125.11 71.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.21 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 873' ' ' LEU . . . . . 0.667 HD11 HG12 ' A' ' 829' ' ' VAL . 0.1 OUTLIER -118.74 131.63 56.13 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.9 0.381 . . . . 0.0 110.268 178.391 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -109.8 101.2 10.09 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.699 -178.125 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 875' ' ' ASP . . . . . 0.522 ' HB3' ' HE2' ' A' ' 925' ' ' LYS . 0.3 OUTLIER -90.48 118.15 29.73 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.466 -179.368 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -131.58 117.04 33.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-O 120.883 0.373 . . . . 0.0 111.229 179.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -62.61 -61.03 2.71 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 172.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.43 123.9 15.68 Favored Pre-proline 0 C--N 1.319 -0.749 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 168.202 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 879' ' ' PRO . . . . . 0.626 ' HB2' ' HA3' ' A' ' 883' ' ' GLY . 57.9 Cg_endo -72.16 49.8 1.41 Allowed 'Trans proline' 0 CA--C 1.532 0.385 0 C-N-CA 122.781 2.321 . . . . 0.0 113.419 -176.3 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 880' ' ' ASN . . . . . 0.41 ' HB3' ' H ' ' A' ' 881' ' ' MET . 60.4 t30 63.14 -84.04 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.309 0.644 . . . . 0.0 111.119 178.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 881' ' ' MET . . . . . 0.41 ' H ' ' HB3' ' A' ' 880' ' ' ASN . 0.1 OUTLIER -179.22 -36.59 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 -179.869 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 882' ' ' ASP . . . . . 0.488 ' O ' ' HB3' ' A' ' 885' ' ' ARG . 5.1 p-10 -101.68 28.41 5.63 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.53 -1.214 . . . . 0.0 110.08 176.706 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 883' ' ' GLY . . . . . 0.626 ' HA3' ' HB2' ' A' ' 879' ' ' PRO . . . -59.46 -17.83 41.55 Favored Glycine 0 C--N 1.333 0.367 0 CA-C-N 115.593 -0.73 . . . . 0.0 113.717 -174.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -59.27 -28.89 67.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.5 0.667 . . . . 0.0 109.562 176.68 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 885' ' ' ARG . . . . . 0.488 ' HB3' ' O ' ' A' ' 882' ' ' ASP . 0.0 OUTLIER -61.02 -31.68 71.3 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.144 -0.934 . . . . 0.0 110.728 -179.275 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 886' ' ' LEU . . . . . 0.478 ' N ' ' HD2' ' A' ' 885' ' ' ARG . 0.0 OUTLIER -67.7 -47.63 68.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.748 0.308 . . . . 0.0 110.299 -178.768 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 887' ' ' THR . . . . . 0.427 ' N ' ' HG ' ' A' ' 886' ' ' LEU . 0.0 OUTLIER -69.53 -38.46 77.52 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.311 0.577 . . . . 0.0 110.655 -178.704 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -62.83 -51.29 67.6 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.745 177.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 889' ' ' ARG . . . . . 0.465 ' HB2' ' O ' ' A' ' 885' ' ' ARG . 0.0 OUTLIER -62.48 -42.78 99.72 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.988 -174.432 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 890' ' ' ILE . . . . . . . . . . . . . 1.4 tt -67.96 -41.27 84.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 120.857 -0.337 . . . . 0.0 111.411 -176.298 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 891' ' ' ARG . . . . . 0.649 ' HA ' HD23 ' A' ' 895' ' ' LEU . 0.1 OUTLIER -75.31 -27.03 59.14 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.675 0.274 . . . . 0.0 111.26 179.717 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 30.4 tp60 -77.63 -37.16 50.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.046 -179.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 893' ' ' LEU . . . . . 0.578 ' HG ' HD21 ' A' ' 861' ' ' LEU . 0.5 OUTLIER -73.97 -32.35 63.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.751 179.764 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 121.91 83.11 0.67 Allowed Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.877 176.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 895' ' ' LEU . . . . . 0.649 HD23 ' HA ' ' A' ' 891' ' ' ARG . 0.2 OUTLIER -89.09 135.99 33.26 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 110.236 -0.283 . . . . 0.0 110.236 178.035 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -131.48 26.5 4.76 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.919 0.39 . . . . 0.0 111.532 -177.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 897' ' ' LEU . . . . . 0.522 HD21 HD11 ' A' ' 864' ' ' LEU . 0.0 OUTLIER -145.56 154.65 52.8 Favored Pre-proline 0 C--N 1.323 -0.56 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.311 -175.784 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -63.67 110.6 1.3 Allowed 'Trans proline' 0 C--O 1.236 0.41 0 C-N-CA 122.72 2.28 . . . . 0.0 112.16 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 899' ' ' VAL . . . . . . . . . . . . . 26.7 t -100.95 112.94 35.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.44 0.638 . . . . 0.0 110.643 177.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 900' ' ' ILE . . . . . 0.674 HG23 ' HB2' ' A' ' 921' ' ' SER . 2.0 mt -90.45 106.63 17.55 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.812 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.303 179.512 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 901' ' ' GLY . . . . . 0.583 ' O ' ' HA ' ' A' ' 922' ' ' CYS . . . -85.91 119.09 5.01 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 120.755 -0.736 . . . . 0.0 111.511 178.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 902' ' ' VAL . . . . . 0.667 ' HB ' HD12 ' A' ' 923' ' ' LEU . 0.1 OUTLIER -124.12 119.5 56.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-O 121.084 0.468 . . . . 0.0 110.251 -178.203 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 903' ' ' THR . . . . . 0.445 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.0 OUTLIER -120.02 160.05 23.56 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.981 -176.193 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 904' ' ' ALA . . . . . 0.601 ' HA ' ' HB2' ' A' ' 925' ' ' LYS . . . -72.48 139.41 47.63 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 173.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -64.68 105.36 0.97 Allowed 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.091 0.472 . . . . 0.0 110.451 -177.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -117.99 -42.93 2.78 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.509 -0.769 . . . . 0.0 111.195 -174.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -158.76 -73.97 0.08 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.363 -176.136 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -161.58 55.22 0.27 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.308 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 909' ' ' GLU . . . . . 0.439 ' H ' ' HG3' ' A' ' 909' ' ' GLU . 0.0 OUTLIER -65.88 -29.84 70.34 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.456 -177.232 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 910' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.67 -37.49 76.13 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.537 174.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -67.77 -41.57 83.06 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.303 178.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -62.28 -37.14 84.35 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.405 177.414 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 913' ' ' ARG . . . . . 0.406 HH11 ' HD3' ' A' ' 913' ' ' ARG . 0.0 OUTLIER -66.17 -37.37 85.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.508 177.288 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 76.9 m -65.97 -33.54 76.05 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.321 176.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.97 -39.69 75.82 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.637 176.451 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -66.22 -52.02 51.93 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.138 -178.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 46.6 48.18 14.34 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -133.0 -33.41 0.37 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.937 176.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 919' ' ' MET . . . . . 0.537 ' O ' ' HB2' ' A' ' 920' ' ' ASP . 12.8 mtt -65.76 -80.96 0.03 OUTLIER 'General case' 0 C--O 1.236 0.394 0 CA-C-O 120.654 0.264 . . . . 0.0 111.386 179.254 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 920' ' ' ASP . . . . . 0.537 ' HB2' ' O ' ' A' ' 919' ' ' MET . 12.4 t70 168.54 -85.53 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.788 177.067 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . 0.674 ' HB2' HG23 ' A' ' 900' ' ' ILE . 0.0 OUTLIER -109.33 175.79 5.32 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.151 -173.562 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 922' ' ' CYS . . . . . 0.583 ' HA ' ' O ' ' A' ' 901' ' ' GLY . 0.0 OUTLIER -146.43 137.54 24.34 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 120.753 0.311 . . . . 0.0 111.501 -179.925 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 923' ' ' LEU . . . . . 0.667 HD12 ' HB ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -143.0 -175.81 4.66 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.846 175.387 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 924' ' ' SER . . . . . 0.609 ' HB3' ' HD2' ' A' ' 926' ' ' PRO . 0.5 OUTLIER -114.35 150.53 34.43 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.744 0.307 . . . . 0.0 110.776 -179.644 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 925' ' ' LYS . . . . . 0.601 ' HB2' ' HA ' ' A' ' 904' ' ' ALA . 0.0 OUTLIER -50.56 -40.29 59.5 Favored Pre-proline 0 CA--C 1.54 0.579 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 -175.515 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 926' ' ' PRO . . . . . 0.609 ' HD2' ' HB3' ' A' ' 924' ' ' SER . 40.8 Cg_exo -61.08 72.33 0.08 OUTLIER 'Trans proline' 0 C--N 1.361 1.187 0 C-N-CA 121.892 1.728 . . . . 0.0 113.286 174.503 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 927' ' ' VAL . . . . . 0.686 HG13 HG12 ' A' ' 931' ' ' VAL . 3.8 t -107.44 124.75 63.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.92 177.08 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 928' ' ' THR . . . . . 0.546 ' OG1' ' HB ' ' A' ' 931' ' ' VAL . 3.0 p -88.89 171.0 10.23 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.162 -179.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 929' ' ' LEU . . . . . 0.48 HD22 ' O ' ' A' ' 929' ' ' LEU . 1.3 tm? -63.47 -46.33 86.68 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.864 0.364 . . . . 0.0 110.087 176.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -63.76 -42.15 97.86 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.832 0.348 . . . . 0.0 110.858 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 931' ' ' VAL . . . . . 0.686 HG12 HG13 ' A' ' 927' ' ' VAL . 0.8 OUTLIER -68.37 -32.41 55.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.656 179.618 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 932' ' ' ILE . . . . . 0.638 ' O ' ' HB2' ' A' ' 936' ' ' LEU . 0.4 OUTLIER -64.68 -40.06 87.77 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.255 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 175.565 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 5.2 ttmt -66.17 -45.95 79.09 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.545 178.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -61.5 -53.81 51.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.24 -179.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 3.6 m -65.07 -39.35 93.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.189 -177.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 936' ' ' LEU . . . . . 0.638 ' HB2' ' O ' ' A' ' 932' ' ' ILE . 4.9 tp -60.85 -48.15 83.14 Favored 'General case' 0 C--O 1.223 -0.308 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.316 177.368 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 93.2 m -62.93 -41.58 99.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.169 -179.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.66 -46.89 87.67 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.105 0.478 . . . . 0.0 111.456 -179.362 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -78.51 -32.84 48.31 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.218 -177.443 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 940' ' ' ALA . . . . . 0.491 ' O ' ' HB2' ' A' ' 944' ' ' ARG . . . -66.94 -41.41 87.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.945 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 941' ' ' GLU . . . . . 0.569 ' HG3' ' N ' ' A' ' 942' ' ' ARG . 0.2 OUTLIER -66.94 -35.78 80.74 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.84 -0.429 . . . . 0.0 109.84 176.795 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 942' ' ' ARG . . . . . 0.569 ' N ' ' HG3' ' A' ' 941' ' ' GLU . 0.0 OUTLIER -60.23 -48.43 81.78 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.855 -179.764 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 13.7 m -76.11 -30.21 20.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.021 -179.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 944' ' ' ARG . . . . . 0.491 ' HB2' ' O ' ' A' ' 940' ' ' ALA . 0.0 OUTLIER -65.47 -41.26 93.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.178 179.67 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 945' ' ' LYS . . . . . 0.475 ' HG2' ' O ' ' A' ' 942' ' ' ARG . 4.4 pttt -71.9 -31.31 66.27 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.706 179.615 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 15.0 m -68.96 -35.51 76.84 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 120.879 0.371 . . . . 0.0 110.952 174.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 3.1 ttm180 -77.52 -19.89 55.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.531 178.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 15.3 t0 63.04 54.34 2.15 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.129 177.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.074 -0.965 . . . . 0.0 109.772 178.046 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 1.7 ttm . . . . . 0 N--CA 1.478 0.953 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 126.24 -35.37 2.98 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.15 -179.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . 84.06 -166.91 43.06 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.696 178.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 4.2 m -119.55 152.37 37.1 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.775 0.321 . . . . 0.0 110.288 -178.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . -92.82 -145.64 17.23 Favored Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.726 -177.646 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -90.98 165.25 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.137 0.494 . . . . 0.0 111.135 -176.437 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -141.6 -74.47 0.31 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.646 -0.707 . . . . 0.0 109.286 175.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . -176.63 157.05 22.13 Favored Glycine 0 N--CA 1.446 -0.689 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 177.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -103.71 6.52 36.96 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 121.184 0.516 . . . . 0.0 110.471 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 705' ' ' SER . . . . . 0.411 ' HA ' ' O ' ' A' ' 730' ' ' GLY . 0.0 OUTLIER -74.95 72.4 2.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.854 178.06 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 706' ' ' GLY . . . . . 0.52 ' HA2' ' HD3' ' A' ' 808' ' ' PRO . . . -157.31 -0.66 0.1 OUTLIER Glycine 0 N--CA 1.445 -0.702 0 C-N-CA 120.295 -0.955 . . . . 0.0 113.428 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 707' ' ' LYS . . . . . 0.598 ' HZ2' ' HB3' ' A' ' 707' ' ' LYS . 0.0 OUTLIER -131.88 154.75 48.89 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 117.487 0.644 . . . . 0.0 110.039 179.699 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 708' ' ' ARG . . . . . 0.486 ' N ' ' HG2' ' A' ' 707' ' ' LYS . 0.0 OUTLIER -108.92 154.87 21.54 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.687 -175.18 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 709' ' ' CYS . . . . . 0.434 ' O ' ' HA ' ' A' ' 733' ' ' VAL . 74.6 m -142.73 143.93 32.45 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.773 175.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 710' ' ' TRP . . . . . 0.552 ' CZ3' ' HG3' ' A' ' 739' ' ' GLN . 86.0 m95 -111.36 143.79 41.6 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 120.939 0.4 . . . . 0.0 110.577 -179.868 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 711' ' ' LEU . . . . . 0.441 ' CD1' ' HB2' ' A' ' 719' ' ' CYS . 0.3 OUTLIER -133.51 132.86 41.47 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.46 0.648 . . . . 0.0 110.806 179.178 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -127.24 60.22 1.4 Allowed 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.326 176.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 713' ' ' VAL . . . . . 0.747 HG13 ' HB3' ' A' ' 750' ' ' ASP . 28.8 t -108.47 120.8 60.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.745 179.588 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 4.0 mtm180 -79.7 -27.47 40.72 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.06 -177.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -72.43 111.8 7.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.907 175.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 716' ' ' ALA . . . . . 0.547 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -66.42 -35.37 80.13 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.55 -174.197 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.78 -45.1 87.74 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.063 0.459 . . . . 0.0 110.631 178.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 718' ' ' LEU . . . . . 0.648 HD11 ' HA ' ' A' ' 786' ' ' ALA . 0.3 OUTLIER -71.03 -45.1 64.51 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.868 179.805 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 719' ' ' CYS . . . . . 0.547 ' SG ' ' HA ' ' A' ' 716' ' ' ALA . 2.4 p -65.5 -43.61 89.6 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.821 -177.011 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 720' ' ' GLN . . . . . 0.632 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 19.0 tp60 -63.3 -39.74 95.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.942 -179.589 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -55.91 -54.85 39.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.895 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 6.7 mt -68.17 -48.35 65.53 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.19 -178.28 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 723' ' ' GLU . . . . . 0.638 ' HB2' HG11 ' A' ' 733' ' ' VAL . 0.2 OUTLIER -64.07 -38.13 89.96 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.675 -173.439 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 724' ' ' THR . . . . . 0.566 ' N ' ' HG3' ' A' ' 723' ' ' GLU . 4.1 m -71.77 -40.27 69.38 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 120.601 0.239 . . . . 0.0 110.728 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 20.1 m -62.06 -38.57 89.27 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.465 178.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 726' ' ' LEU . . . . . 0.425 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 49.5 mt -67.55 -48.95 65.47 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.454 177.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -59.65 -27.28 66.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.233 -179.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 728' ' ' ARG . . . . . 0.406 ' HD3' HH11 ' A' ' 728' ' ' ARG . 0.1 OUTLIER -64.42 -24.57 67.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.542 -179.321 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 72.1 m -103.19 7.09 38.63 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.946 0.403 . . . . 0.0 111.23 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 730' ' ' GLY . . . . . 0.411 ' O ' ' HA ' ' A' ' 705' ' ' SER . . . 92.26 1.46 69.37 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.774 177.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 731' ' ' ILE . . . . . 0.425 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 11.9 mm -66.91 127.21 28.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 120.647 0.261 . . . . 0.0 110.33 177.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 732' ' ' VAL . . . . . 0.484 ' O ' ' HG2' ' A' ' 708' ' ' ARG . 0.7 OUTLIER -88.73 104.59 14.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.461 0.648 . . . . 0.0 109.856 179.888 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 733' ' ' VAL . . . . . 0.638 HG11 ' HB2' ' A' ' 723' ' ' GLU . 1.6 p -99.53 141.7 16.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.385 -179.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 734' ' ' THR . . . . . 0.447 ' HB ' ' CZ3' ' A' ' 710' ' ' TRP . 0.2 OUTLIER -136.93 138.49 40.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.493 178.974 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.6 136.18 52.63 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.418 176.137 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -78.49 79.98 4.9 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.224 -176.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -70.18 -79.36 0.06 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.768 177.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -151.77 61.0 0.4 Allowed Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 121.149 -0.548 . . . . 0.0 111.828 179.216 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 739' ' ' GLN . . . . . 0.552 ' HG3' ' CZ3' ' A' ' 710' ' ' TRP . 1.1 mm-40 -114.45 176.24 5.13 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.824 0.345 . . . . 0.0 110.557 -177.413 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 740' ' ' GLU . . . . . 0.449 ' HG3' ' HD2' ' A' ' 741' ' ' PRO . 0.8 OUTLIER -93.42 141.13 23.52 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.866 -179.683 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 741' ' ' PRO . . . . . 0.567 ' HA ' ' CZ3' ' A' ' 757' ' ' TRP . 15.7 Cg_endo -58.45 132.38 48.2 Favored 'Trans proline' 0 C--O 1.234 0.291 0 C-N-CA 123.014 2.476 . . . . 0.0 112.219 176.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 742' ' ' THR . . . . . 0.537 ' HB ' ' HB2' ' A' ' 745' ' ' ASP . 0.2 OUTLIER -105.92 131.8 21.43 Favored Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.611 179.631 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -66.12 -17.99 55.72 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 123.363 2.709 . . . . 0.0 113.391 -175.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -105.41 4.15 30.42 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.691 0.281 . . . . 0.0 110.531 178.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 745' ' ' ASP . . . . . 0.537 ' HB2' ' HB ' ' A' ' 742' ' ' THR . 14.0 m-20 -115.37 156.86 24.77 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.158 -174.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 29.4 m -119.97 148.11 23.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.922 -177.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 747' ' ' LEU . . . . . 0.556 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 0.0 OUTLIER -112.76 118.48 35.09 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.627 -0.261 . . . . 0.0 110.367 178.062 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 4.3 mt -104.47 107.24 21.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 173.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 1.5 t -117.42 163.8 15.83 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.59 0.233 . . . . 0.0 110.851 -175.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 750' ' ' ASP . . . . . 0.747 ' HB3' HG13 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -121.02 130.21 53.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.172 0.51 . . . . 0.0 110.902 -179.797 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 67.06 177.93 0.23 Allowed 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 114.656 -1.156 . . . . 0.0 111.297 -175.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 752' ' ' VAL . . . . . 0.607 HG22 HG12 ' A' ' 772' ' ' ILE . 69.9 t -80.68 91.82 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.411 0.624 . . . . 0.0 110.939 -176.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 2.0 t -86.9 -6.62 10.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.421 176.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 3.6 m 59.26 39.81 22.15 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.635 179.172 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.83 133.91 44.6 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.257 -0.428 . . . . 0.0 109.988 176.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 756' ' ' LYS . . . . . 0.498 ' HA ' ' HD2' ' A' ' 756' ' ' LYS . 4.9 mmmt -100.8 81.4 2.28 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.138 0.494 . . . . 0.0 110.326 -179.682 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 757' ' ' TRP . . . . . 0.567 ' CZ3' ' HA ' ' A' ' 741' ' ' PRO . 65.7 t-105 -75.96 95.5 3.58 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.378 178.628 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -94.6 59.83 2.51 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.336 0.588 . . . . 0.0 110.025 175.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 759' ' ' GLY . . . . . . . . . . . . . . . -108.07 -127.01 5.55 Favored Glycine 0 N--CA 1.446 -0.647 0 N-CA-C 111.187 -0.765 . . . . 0.0 111.187 176.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 32.0 ttt85 -77.47 -58.83 3.06 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.15 0.5 . . . . 0.0 109.83 175.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -156.64 152.95 27.78 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.525 -0.762 . . . . 0.0 109.749 179.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 762' ' ' VAL . . . . . 0.466 ' HB ' ' HB3' ' A' ' 757' ' ' TRP . 2.1 p -131.82 123.41 51.6 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-O 121.171 0.51 . . . . 0.0 110.421 178.359 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 763' ' ' VAL . . . . . 0.571 HG11 HD11 ' A' ' 791' ' ' LEU . 84.3 t -105.92 115.15 47.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.091 178.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 764' ' ' THR . . . . . 0.455 ' O ' ' HA ' ' A' ' 782' ' ' VAL . 9.2 m -106.99 110.87 23.12 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.175 -178.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 765' ' ' PHE . . . . . 0.499 ' HE1' HG23 ' A' ' 785' ' ' VAL . 40.5 m-85 -70.73 152.72 43.51 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 171.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 766' ' ' CYS . . . . . 0.469 ' SG ' ' HB ' ' A' ' 782' ' ' VAL . 0.0 OUTLIER -157.5 133.56 9.49 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 178.32 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 767' ' ' ARG . . . . . 0.417 ' HB2' ' HE ' ' A' ' 767' ' ' ARG . 0.0 OUTLIER -126.1 -8.97 6.51 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.775 177.105 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 768' ' ' ARG . . . . . 0.525 ' HA ' ' HD2' ' A' ' 768' ' ' ARG . 2.3 mmm-85 -122.45 -72.89 0.66 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.013 0.435 . . . . 0.0 110.983 179.441 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -103.29 129.94 50.42 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.222 -0.658 . . . . 0.0 109.222 -178.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 770' ' ' ILE . . . . . 0.469 ' O ' HG23 ' A' ' 770' ' ' ILE . 0.2 OUTLIER -114.65 12.51 8.02 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 CA-C-O 121.645 0.736 . . . . 0.0 111.328 -173.241 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -76.15 41.83 1.58 Allowed Glycine 0 CA--C 1.521 0.411 0 CA-C-N 115.542 -0.753 . . . . 0.0 113.291 -177.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 772' ' ' ILE . . . . . 0.607 HG12 HG22 ' A' ' 752' ' ' VAL . 1.1 mm -105.84 145.01 30.04 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 174.514 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 773' ' ' PRO . . . . . 0.498 ' HB2' ' HG2' ' A' ' 780' ' ' GLU . 54.3 Cg_exo -51.11 107.77 0.19 Allowed 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.165 1.91 . . . . 0.0 111.817 173.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . 0.61 ' HG ' ' HG2' ' A' ' 776' ' ' LYS . 0.5 OUTLIER -101.99 -155.37 0.52 Allowed 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.255 179.618 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 775' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 1.8 mp0 -66.35 10.0 0.14 Allowed 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -179.085 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . 0.61 ' HG2' ' HG ' ' A' ' 774' ' ' LEU . 8.9 ptpt -71.03 -18.32 62.58 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 166.272 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -121.06 136.23 25.49 Favored Pre-proline 0 N--CA 1.451 -0.421 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.325 174.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -65.28 111.82 1.91 Allowed 'Trans proline' 0 CA--C 1.529 0.24 0 C-N-CA 122.587 2.191 . . . . 0.0 112.59 -177.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 110.14 -8.66 31.21 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.907 -0.663 . . . . 0.0 112.024 179.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 780' ' ' GLU . . . . . 0.498 ' HG2' ' HB2' ' A' ' 773' ' ' PRO . 0.1 OUTLIER -107.59 134.76 50.12 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 179.954 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 30.4 m95 -135.79 148.73 48.87 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.245 -0.28 . . . . 0.0 110.245 -178.086 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . 0.469 ' HB ' ' SG ' ' A' ' 766' ' ' CYS . 19.3 m -132.1 165.23 32.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 168.215 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 783' ' ' HIS . . . . . 0.416 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.2 OUTLIER -171.29 134.16 0.88 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.973 0.416 . . . . 0.0 111.502 177.038 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 784' ' ' SER . . . . . 0.487 ' O ' HG13 ' A' ' 785' ' ' VAL . 0.0 OUTLIER -98.81 99.25 10.31 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.515 178.208 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 785' ' ' VAL . . . . . 0.499 HG23 ' HE1' ' A' ' 765' ' ' PHE . 0.0 OUTLIER -171.39 -179.3 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 C-N-CA 122.796 0.438 . . . . 0.0 110.17 178.816 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 786' ' ' ALA . . . . . 0.648 ' HA ' HD11 ' A' ' 718' ' ' LEU . . . -107.95 22.24 16.23 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.696 -0.683 . . . . 0.0 109.92 171.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 787' ' ' ALA . . . . . 0.407 ' HB2' ' CZ ' ' A' ' 765' ' ' PHE . . . 58.98 63.11 3.9 Favored Pre-proline 0 N--CA 1.468 0.43 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.973 -178.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 788' ' ' PRO . . . . . 0.459 ' HD3' ' HB ' ' A' ' 785' ' ' VAL . 24.3 Cg_exo -63.71 -53.46 1.32 Allowed 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.569 2.179 . . . . 0.0 112.844 -178.151 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 8.2 p-80 -172.13 25.71 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 790' ' ' GLU . . . . . 0.451 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -121.9 -46.81 2.2 Favored 'General case' 0 C--N 1.323 -0.578 0 O-C-N 122.034 -0.416 . . . . 0.0 111.091 -179.963 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 791' ' ' LEU . . . . . 0.571 HD11 HG11 ' A' ' 763' ' ' VAL . 0.5 OUTLIER -57.85 -54.61 53.59 Favored Pre-proline 0 CA--C 1.537 0.48 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -178.826 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 792' ' ' PRO . . . . . 0.406 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 12.7 Cg_endo -60.59 -26.74 83.51 Favored 'Trans proline' 0 C--N 1.355 0.915 0 C-N-CA 121.432 1.421 . . . . 0.0 112.019 178.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -70.43 -43.54 69.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.955 0.407 . . . . 0.0 110.264 177.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 794' ' ' LEU . . . . . 0.528 ' O ' ' HB ' ' A' ' 798' ' ' ILE . 0.1 OUTLIER -61.91 -37.82 86.08 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.332 177.537 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 795' ' ' LEU . . . . . 0.422 HD21 HG21 ' A' ' 763' ' ' VAL . 1.3 mm? -63.04 -49.9 72.78 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.156 0.503 . . . . 0.0 110.816 179.477 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -59.99 -48.33 82.16 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.185 -179.227 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 797' ' ' ARG . . . . . 0.446 ' HG2' ' HA ' ' A' ' 794' ' ' LEU . 0.3 OUTLIER -71.99 -20.83 61.66 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.667 -178.288 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 798' ' ' ILE . . . . . 0.528 ' HB ' ' O ' ' A' ' 794' ' ' LEU . 0.1 OUTLIER -72.01 -31.19 39.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.959 0.409 . . . . 0.0 110.247 178.442 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -85.37 -56.22 3.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.216 175.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 800' ' ' LEU . . . . . 0.432 ' HG ' ' HA ' ' A' ' 797' ' ' ARG . 4.8 mt 47.26 60.53 3.39 Favored 'General case' 0 N--CA 1.467 0.391 0 O-C-N 123.934 0.771 . . . . 0.0 112.562 178.078 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 801' ' ' ILE . . . . . . . . . . . . . 17.7 mt -105.15 -53.42 6.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 176.494 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 64.96 -2.3 0.73 Allowed 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 114.979 -1.009 . . . . 0.0 113.088 171.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 803' ' ' MET . . . . . . . . . . . . . 12.2 ptm -160.4 99.66 1.31 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.398 0.618 . . . . 0.0 110.457 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 804' ' ' GLU . . . . . 0.419 ' HB2' ' HA3' ' A' ' 706' ' ' GLY . 0.2 OUTLIER -132.33 -72.4 0.53 Allowed 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.573 179.157 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 7.8 m 56.77 46.18 20.42 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 112.902 0.704 . . . . 0.0 112.902 172.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -87.36 -28.93 21.9 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 171.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 807' ' ' ASP . . . . . 0.459 ' N ' ' HD3' ' A' ' 808' ' ' PRO . 27.8 t70 64.47 66.14 1.01 Allowed Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 114.602 -1.181 . . . . 0.0 111.621 -176.167 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 808' ' ' PRO . . . . . 0.52 ' HD3' ' HA2' ' A' ' 706' ' ' GLY . 35.9 Cg_endo -95.26 51.25 0.2 Allowed 'Trans proline' 0 N--CA 1.449 -1.127 0 C-N-CA 123.495 2.796 . . . . 0.0 110.547 172.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -90.87 31.14 1.1 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.29 -174.145 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -98.32 127.23 44.16 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 174.405 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -166.9 98.04 0.54 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.172 -178.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 812' ' ' LEU . . . . . 0.408 ' HA ' ' HD3' ' A' ' 813' ' ' PRO . 1.4 pp -73.23 134.0 80.65 Favored Pre-proline 0 C--N 1.325 -0.459 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.558 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 813' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 812' ' ' LEU . 8.2 Cg_exo -71.86 88.31 0.8 Allowed 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.91 2.407 . . . . 0.0 111.915 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.56 96.35 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.259 175.387 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.8 102.84 15.44 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.547 -173.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -81.64 168.3 18.29 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.673 175.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.12 136.17 33.02 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 179.2 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -54.24 -49.14 70.17 Favored 'General case' 0 C--O 1.232 0.18 0 O-C-N 123.59 0.556 . . . . 0.0 110.384 179.156 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 72.1 t -90.5 136.5 23.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 173.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 4.5 m -67.25 84.15 0.14 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.298 0.57 . . . . 0.0 110.788 179.372 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -139.35 144.46 38.24 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.67 -178.729 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -147.41 12.81 1.06 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.931 0.396 . . . . 0.0 110.746 -178.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -132.11 134.39 45.41 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.653 0.739 . . . . 0.0 111.784 -174.583 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 824' ' ' ASP . . . . . 0.41 ' HB3' ' HE1' ' A' ' 849' ' ' TYR . 25.1 t70 -153.91 -69.87 0.14 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.925 -1.034 . . . . 0.0 108.667 175.636 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -106.78 124.57 49.8 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.457 173.092 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 826' ' ' MET . . . . . . . . . . . . . 2.9 ttt -96.64 113.26 24.81 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.456 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 827' ' ' ILE . . . . . 0.661 HD12 ' HB ' ' A' ' 871' ' ' ILE . 9.4 mm -113.13 134.46 55.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.281 -179.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 828' ' ' LEU . . . . . 0.908 HD23 HG12 ' A' ' 869' ' ' ILE . 0.3 OUTLIER -101.06 120.42 40.18 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.897 178.215 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -102.85 95.78 4.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.209 0.528 . . . . 0.0 110.088 178.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 830' ' ' VAL . . . . . 0.476 HG22 HD12 ' A' ' 828' ' ' LEU . 1.7 t -113.16 109.13 27.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.346 -177.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 831' ' ' ASP . . . . . 0.728 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 18.8 t70 -124.88 159.46 31.07 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 110.22 -0.289 . . . . 0.0 110.22 179.073 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 832' ' ' ASP . . . . . 0.697 ' HB3' ' HB3' ' A' ' 877' ' ' ASN . 35.0 t70 -75.0 -27.55 60.19 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.954 -176.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 6.6 m170 -120.47 111.32 34.96 Favored Pre-proline 0 C--N 1.326 -0.421 0 O-C-N 122.322 -0.236 . . . . 0.0 111.053 -174.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 834' ' ' PRO . . . . . 0.467 ' HA ' ' HD2' ' A' ' 837' ' ' ARG . 87.6 Cg_exo -43.59 -36.89 7.59 Favored 'Trans proline' 0 CA--C 1.532 0.407 0 C-N-CA 123.643 2.895 . . . . 0.0 114.369 -176.052 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 835' ' ' ILE . . . . . 0.512 ' O ' ' HG3' ' A' ' 838' ' ' ARG . 1.1 pp -66.13 -44.46 91.72 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 CA-C-O 120.888 0.375 . . . . 0.0 111.214 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 836' ' ' ASN . . . . . 0.503 HD22 ' CG ' ' A' ' 831' ' ' ASP . 42.5 t30 -72.14 -41.87 66.65 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 177.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 837' ' ' ARG . . . . . 0.728 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 0.1 OUTLIER -53.8 -46.07 70.97 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.733 -1.121 . . . . 0.0 111.437 179.044 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 838' ' ' ARG . . . . . 0.512 ' HG3' ' O ' ' A' ' 835' ' ' ILE . 0.0 OUTLIER -72.76 -29.05 63.0 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 121.0 -0.28 . . . . 0.0 110.88 179.265 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.34 -47.11 83.53 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.645 -0.252 . . . . 0.0 111.371 -178.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 840' ' ' LEU . . . . . 0.473 ' HG ' ' H ' ' A' ' 840' ' ' LEU . 0.0 OUTLIER -71.35 -32.72 68.86 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.952 0.406 . . . . 0.0 110.254 178.188 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -63.64 -33.98 76.83 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.327 0.584 . . . . 0.0 110.39 177.047 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -65.53 -44.63 86.33 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.396 177.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 843' ' ' GLN . . . . . 0.752 ' HG3' HD23 ' A' ' 929' ' ' LEU . 1.2 mp0 -64.75 -41.69 95.73 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.542 179.012 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 844' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.66 -31.82 72.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.419 175.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -61.8 -43.12 99.65 Favored Glycine 0 N--CA 1.451 -0.329 0 CA-C-N 115.771 -0.649 . . . . 0.0 112.301 176.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -31.48 72.7 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.849 0.356 . . . . 0.0 110.626 176.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 847' ' ' LEU . . . . . 0.403 ' HA ' HD23 ' A' ' 847' ' ' LEU . 14.8 mt -66.77 -32.65 74.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.63 177.584 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 87.65 27.55 26.67 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.639 177.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 849' ' ' TYR . . . . . 0.467 ' HD1' ' HA ' ' A' ' 849' ' ' TYR . 0.1 OUTLIER -114.45 167.11 11.0 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 122.804 -0.233 . . . . 0.0 110.674 -179.261 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -71.01 118.64 14.05 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.481 -175.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -123.54 107.82 11.96 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.456 179.287 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.58 119.4 35.0 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 177.048 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.13 110.19 21.22 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.074 0.464 . . . . 0.0 111.709 -171.201 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 854' ' ' ALA . . . . . 0.446 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -121.78 155.93 34.26 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.897 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -137.23 79.07 1.73 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.341 -177.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 856' ' ' ASP . . . . . 0.434 ' CG ' ' H ' ' A' ' 857' ' ' GLY . 7.5 t70 -175.61 -166.92 0.22 Allowed 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.1 177.074 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 857' ' ' GLY . . . . . 0.434 ' H ' ' CG ' ' A' ' 856' ' ' ASP . . . -124.14 -53.61 0.19 Allowed Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 121.226 -0.511 . . . . 0.0 111.907 178.796 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -71.7 -31.02 40.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.899 0.381 . . . . 0.0 110.757 -177.346 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.76 -19.91 65.16 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.973 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 860' ' ' ALA . . . . . 0.473 ' O ' ' HG ' ' A' ' 864' ' ' LEU . . . -64.73 -51.06 64.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.753 0.311 . . . . 0.0 110.203 176.077 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 861' ' ' LEU . . . . . 0.859 HD23 HG13 ' A' ' 890' ' ' ILE . 1.4 tm? -58.87 -39.78 82.4 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.375 0.607 . . . . 0.0 109.636 175.275 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 28.7 t30 -55.02 -42.31 72.45 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.027 177.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 863' ' ' VAL . . . . . 0.591 HG13 HD13 ' A' ' 869' ' ' ILE . 0.4 OUTLIER -71.16 -32.34 47.36 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.71 -177.497 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 864' ' ' LEU . . . . . 0.724 HD13 HD21 ' A' ' 897' ' ' LEU . 4.4 mt -68.02 -37.59 81.57 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.409 0.623 . . . . 0.0 110.5 178.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 1.4 m -78.92 -16.14 57.39 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.317 179.254 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 1.4 mtmm -81.53 -57.49 3.44 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.514 177.169 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -139.53 151.32 46.03 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.448 -178.339 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 80.3 t60 -78.24 105.52 9.53 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.286 0.565 . . . . 0.0 111.156 -177.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 869' ' ' ILE . . . . . 0.908 HG12 HD23 ' A' ' 828' ' ' LEU . 1.5 mp -93.86 146.24 6.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 171.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -84.06 -52.34 6.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.817 0.341 . . . . 0.0 110.884 -175.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 871' ' ' ILE . . . . . 0.661 ' HB ' HD12 ' A' ' 827' ' ' ILE . 12.9 mm -124.59 122.46 63.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.14 -179.237 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 872' ' ' VAL . . . . . 0.634 ' HB ' HG13 ' A' ' 899' ' ' VAL . 2.5 t -103.54 124.94 58.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.863 178.147 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 873' ' ' LEU . . . . . . . . . . . . . 67.7 mt -107.25 110.29 22.29 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 176.186 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -113.62 99.7 7.93 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.679 -179.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 875' ' ' ASP . . . . . 0.516 ' HA ' HG13 ' A' ' 902' ' ' VAL . 47.2 t0 -97.48 113.26 24.91 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.219 -178.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -103.86 103.53 15.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.868 -178.004 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 877' ' ' ASN . . . . . 0.697 ' HB3' ' HB3' ' A' ' 832' ' ' ASP . 0.4 OUTLIER -65.45 -42.6 92.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.623 178.129 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 878' ' ' MET . . . . . 0.516 ' HG2' ' HB2' ' A' ' 880' ' ' ASN . 10.1 ttp -140.28 102.61 6.71 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.942 -177.561 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 879' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_exo -74.27 -60.74 0.04 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 122.557 2.171 . . . . 0.0 110.379 170.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 880' ' ' ASN . . . . . 0.516 ' HB2' ' HG2' ' A' ' 878' ' ' MET . 0.8 OUTLIER 46.03 64.31 1.52 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.464 -0.789 . . . . 0.0 112.31 175.438 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 5.1 tpt 78.42 -20.6 0.38 Allowed 'General case' 0 N--CA 1.471 0.605 0 O-C-N 123.923 0.764 . . . . 0.0 112.038 175.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 29.4 t0 -95.58 171.47 8.66 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 177.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . 103.43 -17.92 49.52 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.916 -0.659 . . . . 0.0 111.504 -176.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.63 -33.21 75.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.208 0.527 . . . . 0.0 109.754 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 885' ' ' ARG . . . . . 0.408 ' O ' ' HB2' ' A' ' 889' ' ' ARG . 0.6 OUTLIER -72.56 -31.33 65.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.528 176.919 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.59 -51.05 62.67 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.808 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 887' ' ' THR . . . . . 0.651 HG21 ' HB2' ' A' ' 916' ' ' GLU . 44.4 m -63.52 -41.48 98.48 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.037 0.446 . . . . 0.0 111.007 178.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 888' ' ' GLN . . . . . 0.478 ' O ' ' HB2' ' A' ' 892' ' ' GLN . 1.5 tp60 -63.2 -41.7 99.2 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.765 178.757 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 889' ' ' ARG . . . . . 0.408 ' HB2' ' O ' ' A' ' 885' ' ' ARG . 0.0 OUTLIER -66.09 -43.39 87.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.264 -178.227 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 890' ' ' ILE . . . . . 0.859 HG13 HD23 ' A' ' 861' ' ' LEU . 13.0 tt -66.37 -41.1 88.28 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.502 -176.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 891' ' ' ARG . . . . . 0.433 ' HG3' ' N ' ' A' ' 892' ' ' GLN . 0.2 OUTLIER -75.4 -29.09 59.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.541 0.21 . . . . 0.0 111.153 179.413 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 892' ' ' GLN . . . . . 0.478 ' HB2' ' O ' ' A' ' 888' ' ' GLN . 1.2 tp60 -73.31 -50.36 22.53 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 120.83 0.348 . . . . 0.0 111.389 -177.545 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.12 -38.16 78.73 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.725 -177.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 121.95 82.39 0.64 Allowed Glycine 0 N--CA 1.445 -0.752 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.656 177.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 895' ' ' LEU . . . . . 0.571 ' HG ' ' O ' ' A' ' 895' ' ' LEU . 0.1 OUTLIER -59.73 130.85 48.84 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 175.793 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -117.96 13.27 13.94 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.57 0.582 . . . . 0.0 112.57 -171.547 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 897' ' ' LEU . . . . . 0.724 HD21 HD13 ' A' ' 864' ' ' LEU . 0.0 OUTLIER -157.31 166.52 16.44 Favored Pre-proline 0 C--N 1.321 -0.645 0 CA-C-N 116.616 -0.266 . . . . 0.0 111.331 -174.38 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_exo -71.06 108.55 2.35 Favored 'Trans proline' 0 C--O 1.239 0.545 0 C-N-CA 122.492 2.128 . . . . 0.0 111.622 173.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 899' ' ' VAL . . . . . 0.634 HG13 ' HB ' ' A' ' 872' ' ' VAL . 2.4 t -97.54 121.32 47.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.868 176.539 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 900' ' ' ILE . . . . . . . . . . . . . 2.7 mp -103.48 106.27 19.87 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-O 121.242 0.544 . . . . 0.0 109.987 178.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -94.61 97.73 2.2 Favored Glycine 0 N--CA 1.443 -0.897 0 CA-C-N 115.458 -0.792 . . . . 0.0 112.203 -178.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 902' ' ' VAL . . . . . 0.516 HG13 ' HA ' ' A' ' 875' ' ' ASP . 0.2 OUTLIER -79.86 123.77 37.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 175.098 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -118.68 143.73 46.66 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.015 0.436 . . . . 0.0 111.094 -174.111 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 904' ' ' ALA . . . . . 0.548 ' HA ' ' HB2' ' A' ' 925' ' ' LYS . . . -82.22 119.23 23.82 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.198 178.7 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 62.8 56.68 1.87 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.985 174.412 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 906' ' ' ALA . . . . . 0.541 ' HB3' ' HG3' ' A' ' 909' ' ' GLU . . . -107.46 -39.08 5.75 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.232 174.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 72.48 -65.68 0.34 Allowed 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.797 177.673 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -82.86 53.93 2.56 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.077 0.465 . . . . 0.0 109.791 176.328 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 909' ' ' GLU . . . . . 0.541 ' HG3' ' HB3' ' A' ' 906' ' ' ALA . 3.4 mp0 -62.63 -35.24 78.95 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.928 -177.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 910' ' ' GLU . . . . . 0.476 ' H ' ' HG3' ' A' ' 910' ' ' GLU . 0.0 OUTLIER -62.62 -45.29 93.53 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.421 0.629 . . . . 0.0 110.194 176.289 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 1.1 tttt -63.69 -37.21 86.49 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.489 177.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 18.6 tt0 -60.57 -42.58 96.95 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.471 177.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.88 -40.34 76.03 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.563 178.542 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 3.9 m -75.58 -31.16 59.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.037 179.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.73 -52.73 18.98 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.664 -175.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 916' ' ' GLU . . . . . 0.651 ' HB2' HG21 ' A' ' 887' ' ' THR . 0.2 OUTLIER -79.23 -44.68 21.33 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.457 -177.341 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 67.4 m 50.72 45.4 27.12 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 123.257 0.348 . . . . 0.0 111.852 -176.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 918' ' ' GLY . . . . . 0.407 ' H ' ' CD ' ' A' ' 916' ' ' GLU . . . -122.23 -33.56 0.89 Allowed Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.561 -0.828 . . . . 0.0 112.133 -179.706 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 919' ' ' MET . . . . . 0.61 ' HB3' ' HB ' ' A' ' 899' ' ' VAL . 5.4 mmt -90.9 -71.82 0.61 Allowed 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 176.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 920' ' ' ASP . . . . . 0.449 ' HB2' ' O ' ' A' ' 919' ' ' MET . 13.6 t70 158.59 -67.34 0.0 OUTLIER 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 114.399 -1.273 . . . . 0.0 108.959 175.135 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -118.9 167.71 11.46 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.26 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 922' ' ' CYS . . . . . 0.535 ' HB2' ' O ' ' A' ' 909' ' ' GLU . 85.0 m -143.47 133.71 24.51 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.225 -0.443 . . . . 0.0 109.985 177.221 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 923' ' ' LEU . . . . . . . . . . . . . 56.0 mt -120.93 169.4 10.5 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.9 -178.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 924' ' ' SER . . . . . 0.435 ' O ' HG23 ' A' ' 927' ' ' VAL . 0.7 OUTLIER -84.66 150.4 25.17 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.4 177.066 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 925' ' ' LYS . . . . . 0.548 ' HB2' ' HA ' ' A' ' 904' ' ' ALA . 0.0 OUTLIER -58.38 -40.82 85.69 Favored Pre-proline 0 CA--C 1.541 0.621 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -179.432 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -64.8 73.83 0.22 Allowed 'Trans proline' 0 C--N 1.357 0.999 0 C-N-CA 122.102 1.868 . . . . 0.0 112.757 173.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 927' ' ' VAL . . . . . 0.435 HG23 ' O ' ' A' ' 924' ' ' SER . 8.9 t -100.94 114.54 40.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 121.12 0.486 . . . . 0.0 109.828 174.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.53 177.46 7.74 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.251 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 929' ' ' LEU . . . . . 0.752 HD23 ' HG3' ' A' ' 843' ' ' GLN . 1.6 tm? -57.82 -45.45 86.15 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.804 0.335 . . . . 0.0 110.401 177.723 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 930' ' ' ASP . . . . . 0.443 ' O ' ' HG2' ' A' ' 934' ' ' GLN . 3.4 t0 -66.5 -40.65 89.37 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.665 -178.452 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 50.8 t -64.7 -47.9 86.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.868 -179.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 932' ' ' ILE . . . . . 0.407 HG22 ' O ' ' A' ' 929' ' ' LEU . 0.0 OUTLIER -64.95 -31.97 56.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.936 0.398 . . . . 0.0 110.09 178.673 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 4.8 ttmt -65.74 -48.31 72.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.242 177.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 934' ' ' GLN . . . . . 0.459 ' O ' ' HB3' ' A' ' 938' ' ' LEU . 56.5 mm-40 -60.54 -48.77 80.29 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.447 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 13.4 m -59.62 -51.85 68.06 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.371 -178.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 936' ' ' LEU . . . . . 0.466 HD11 HG13 ' A' ' 827' ' ' ILE . 0.3 OUTLIER -63.65 -47.19 82.28 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.208 -177.76 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 32.3 m -63.53 -50.29 70.15 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -178.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 938' ' ' LEU . . . . . 0.459 ' HB3' ' O ' ' A' ' 934' ' ' GLN . 0.0 OUTLIER -66.32 -36.33 82.66 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.466 -0.333 . . . . 0.0 111.232 -175.832 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -76.03 -37.66 58.11 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.843 -0.343 . . . . 0.0 111.03 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -65.07 -37.77 88.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.947 0.403 . . . . 0.0 110.713 178.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 941' ' ' GLU . . . . . 0.649 ' O ' ' HG2' ' A' ' 945' ' ' LYS . 2.2 pt-20 -75.76 -29.01 58.69 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.678 -0.409 . . . . 0.0 110.52 177.385 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 942' ' ' ARG . . . . . . . . . . . . . 1.4 tpt85 -66.59 -47.49 72.56 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.567 179.09 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 27.9 m -67.24 -29.16 44.96 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 121.283 0.563 . . . . 0.0 109.861 176.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.91 -24.93 66.15 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.804 175.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 945' ' ' LYS . . . . . 0.649 ' HG2' ' O ' ' A' ' 941' ' ' GLU . 9.6 mmtt -73.87 -43.63 58.0 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 120.855 0.36 . . . . 0.0 110.183 176.821 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.32 -30.89 71.92 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.743 177.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.39 -19.31 46.6 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.248 174.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 29.6 t70 73.18 -95.24 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.957 -1.02 . . . . 0.0 111.538 177.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.252 1.225 0 CA-C-O 117.935 -1.031 . . . . 0.0 109.817 -178.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 2.7 ptt? . . . . . 0 N--CA 1.477 0.891 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 73.49 61.94 3.22 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.876 -0.678 . . . . 0.0 111.814 -176.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . -109.56 120.6 5.81 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 120.862 -0.685 . . . . 0.0 111.809 -179.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.08 -57.6 10.97 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.694 0.283 . . . . 0.0 111.029 -179.51 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . 72.59 -143.26 33.66 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.685 -0.769 . . . . 0.0 111.915 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 9.9 m -94.99 141.21 15.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.011 0.434 . . . . 0.0 111.072 -179.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -128.6 -132.27 0.22 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.118 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . 91.29 -65.62 2.49 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 121.013 -0.613 . . . . 0.0 113.343 175.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.441 HD21 HG12 ' A' ' 801' ' ' ILE . 8.8 mt -80.55 -56.78 3.93 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.925 0.393 . . . . 0.0 111.416 -175.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 3.3 m -66.1 131.21 45.66 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.368 -176.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 106.75 -12.71 42.18 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.76 175.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -75.48 132.0 40.49 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 174.618 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 708' ' ' ARG . . . . . 0.726 ' HG3' ' HB ' ' A' ' 732' ' ' VAL . 2.8 ttt180 -97.3 152.78 18.55 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.19 0.519 . . . . 0.0 111.445 -171.586 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -130.18 117.84 20.51 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.947 176.502 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 710' ' ' TRP . . . . . 0.469 ' O ' HD23 ' A' ' 747' ' ' LEU . 47.2 m95 -94.82 120.19 34.65 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.56 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 711' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -122.36 132.38 54.35 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.393 0.616 . . . . 0.0 111.199 -177.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -125.76 70.4 1.2 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.422 176.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 713' ' ' VAL . . . . . 0.643 HG13 ' HB3' ' A' ' 750' ' ' ASP . 60.8 t -128.15 120.58 53.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.114 -0.948 . . . . 0.0 109.952 -176.727 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 714' ' ' ARG . . . . . 0.572 ' HD2' ' OD2' ' A' ' 750' ' ' ASP . 0.3 OUTLIER -91.94 -8.99 44.71 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.385 -175.734 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -83.23 113.65 20.82 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 176.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 716' ' ' ALA . . . . . 0.402 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -58.0 -43.95 86.93 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.49 -173.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.34 -45.66 86.89 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.009 0.433 . . . . 0.0 110.331 -179.171 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.15 -50.55 60.8 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.235 -179.396 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 719' ' ' CYS . . . . . 0.402 ' SG ' ' HA ' ' A' ' 716' ' ' ALA . 13.9 p -67.13 -44.9 78.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.221 -174.446 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 720' ' ' GLN . . . . . 0.631 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 0.3 OUTLIER -65.51 -37.87 88.04 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 121.002 -0.279 . . . . 0.0 111.173 -177.016 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 39.2 t80 -60.59 -48.16 83.02 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 121.013 -0.275 . . . . 0.0 110.692 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 722' ' ' LEU . . . . . 0.418 HD13 HG21 ' A' ' 748' ' ' ILE . 15.9 mt -66.16 -48.78 69.62 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.628 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 723' ' ' GLU . . . . . 0.887 ' HB2' HG11 ' A' ' 733' ' ' VAL . 8.7 pt-20 -61.88 -37.49 84.75 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.721 -175.181 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 724' ' ' THR . . . . . 0.541 ' HA ' ' HG2' ' A' ' 727' ' ' GLN . 26.2 m -68.96 -38.23 79.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.92 0.391 . . . . 0.0 110.797 179.226 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 24.3 m -70.71 -28.41 64.71 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.11 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 726' ' ' LEU . . . . . . . . . . . . . 18.3 mt -80.14 -44.21 20.3 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.98 0.419 . . . . 0.0 110.747 179.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 727' ' ' GLN . . . . . 0.541 ' HG2' ' HA ' ' A' ' 724' ' ' THR . 12.2 pt20 -72.03 -7.89 51.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.957 0.408 . . . . 0.0 110.705 178.183 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.74 -29.06 70.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.922 178.104 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 2.1 p -104.66 -88.55 0.43 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.065 0.459 . . . . 0.0 110.553 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 730' ' ' GLY . . . . . . . . . . . . . . . -158.05 19.68 0.35 Allowed Glycine 0 N--CA 1.445 -0.751 0 N-CA-C 111.343 -0.703 . . . . 0.0 111.343 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 731' ' ' ILE . . . . . . . . . . . . . 35.0 mm -79.35 128.09 38.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 120.886 0.374 . . . . 0.0 110.601 -179.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 732' ' ' VAL . . . . . 0.726 ' HB ' ' HG3' ' A' ' 708' ' ' ARG . 0.1 OUTLIER -79.15 89.26 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.554 -179.525 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 733' ' ' VAL . . . . . 0.887 HG11 ' HB2' ' A' ' 723' ' ' GLU . 94.7 t -66.09 114.43 3.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.015 176.416 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -130.13 133.41 46.62 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.15 0.5 . . . . 0.0 110.862 -178.703 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.8 124.15 20.74 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.926 178.532 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -85.09 96.29 9.39 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.296 0.57 . . . . 0.0 110.556 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -107.95 -10.81 15.45 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.299 178.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 148.27 57.1 0.01 OUTLIER Glycine 0 CA--C 1.51 -0.25 0 N-CA-C 111.199 -0.76 . . . . 0.0 111.199 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 17.2 mp0 -106.81 173.99 6.08 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.953 0.406 . . . . 0.0 111.59 -173.069 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 740' ' ' GLU . . . . . 0.434 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 6.2 mm-40 -75.38 141.52 73.6 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.557 -177.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 741' ' ' PRO . . . . . 0.589 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 1.9 Cg_endo -84.72 123.52 2.88 Favored 'Trans proline' 0 N--CA 1.455 -0.744 0 C-N-CA 123.108 2.539 . . . . 0.0 112.415 176.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 742' ' ' THR . . . . . 0.497 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.0 OUTLIER -111.95 138.26 21.62 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.468 177.564 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 743' ' ' PRO . . . . . 0.497 ' HD2' HG22 ' A' ' 742' ' ' THR . 40.5 Cg_endo -67.12 -6.65 16.63 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 123.166 2.578 . . . . 0.0 113.916 -175.236 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -109.13 1.12 20.16 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.8 0.333 . . . . 0.0 110.895 178.044 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 82.7 m-20 -117.01 157.51 25.69 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-N 116.279 -0.419 . . . . 0.0 109.979 -175.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 746' ' ' VAL . . . . . 0.423 HG21 HD11 ' A' ' 795' ' ' LEU . 0.8 OUTLIER -123.6 149.08 27.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 120.915 0.388 . . . . 0.0 111.156 -177.809 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 747' ' ' LEU . . . . . 0.469 HD23 ' O ' ' A' ' 710' ' ' TRP . 0.0 OUTLIER -105.82 112.56 25.68 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.877 176.191 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 748' ' ' ILE . . . . . 0.418 HG21 HD13 ' A' ' 722' ' ' LEU . 17.9 mt -98.88 114.19 35.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 176.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 34.8 p -115.01 148.99 38.14 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.685 0.279 . . . . 0.0 111.253 -174.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 750' ' ' ASP . . . . . 0.643 ' HB3' HG13 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -98.82 123.28 42.97 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 171.303 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 751' ' ' GLU . . . . . 0.478 ' HB3' ' H ' ' A' ' 752' ' ' VAL . 10.2 mm-40 57.89 -156.48 0.32 Allowed 'General case' 0 C--O 1.236 0.361 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.356 -175.419 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 752' ' ' VAL . . . . . 0.67 HG22 ' H ' ' A' ' 771' ' ' GLY . 4.9 t -87.55 141.06 14.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 121.103 0.478 . . . . 0.0 111.422 -174.251 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 15.6 m -125.29 160.54 30.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.908 177.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -84.66 56.56 3.92 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.948 0.404 . . . . 0.0 110.9 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.72 176.3 12.14 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.415 179.304 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.53 -39.24 2.03 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.411 -179.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 757' ' ' TRP . . . . . 0.589 ' CH2' ' HA ' ' A' ' 741' ' ' PRO . 76.0 t-105 70.46 158.88 0.19 Allowed 'General case' 0 CA--C 1.537 0.462 0 O-C-N 123.702 0.626 . . . . 0.0 111.576 177.701 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -134.15 -85.45 0.42 Allowed 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 172.175 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 759' ' ' GLY . . . . . . . . . . . . . . . 50.25 -136.44 26.03 Favored Glycine 0 C--N 1.334 0.452 0 CA-C-N 116.394 -0.366 . . . . 0.0 112.946 176.289 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 30.7 ttm-85 -85.29 -50.58 7.23 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.241 0.543 . . . . 0.0 109.587 172.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -166.54 158.85 13.8 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.028 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 762' ' ' VAL . . . . . 0.494 ' HB ' ' CD1' ' A' ' 757' ' ' TRP . 2.4 p -120.41 128.09 75.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 174.334 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 763' ' ' VAL . . . . . 0.732 HG11 HD21 ' A' ' 791' ' ' LEU . 11.9 t -112.06 104.71 17.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 121.085 0.469 . . . . 0.0 110.273 -178.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 764' ' ' THR . . . . . . . . . . . . . 36.7 m -98.38 125.25 43.45 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.043 -179.088 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 765' ' ' PHE . . . . . 0.441 ' CE2' HG23 ' A' ' 785' ' ' VAL . 14.8 m-85 -83.12 112.99 20.32 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.661 175.275 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -95.1 133.03 39.36 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.161 -178.172 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 767' ' ' ARG . . . . . 0.513 ' HA ' ' HD2' ' A' ' 767' ' ' ARG . 13.6 mmm-85 -118.55 -48.37 2.5 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.731 0.301 . . . . 0.0 110.233 178.153 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.41 -19.13 1.25 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.941 -178.04 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -138.09 144.3 40.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.921 0.391 . . . . 0.0 111.013 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 16.2 mt -124.25 87.59 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.573 -178.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 771' ' ' GLY . . . . . 0.67 ' H ' HG22 ' A' ' 752' ' ' VAL . . . -85.7 -33.88 14.93 Favored Glycine 0 N--CA 1.45 -0.378 0 N-CA-C 111.207 -0.757 . . . . 0.0 111.207 175.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 772' ' ' ILE . . . . . 0.439 ' HA ' ' HD3' ' A' ' 773' ' ' PRO . 0.9 OUTLIER -98.5 116.17 65.54 Favored Pre-proline 0 C--N 1.322 -0.596 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 173.118 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 773' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 772' ' ' ILE . 6.0 Cg_exo -77.51 -177.98 4.25 Favored 'Trans proline' 0 N--CA 1.461 -0.439 0 C-N-CA 123.101 2.534 . . . . 0.0 113.41 -174.432 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . 0.524 ' H ' HD23 ' A' ' 774' ' ' LEU . 1.7 pt? -88.06 -161.2 0.7 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.464 179.374 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 775' ' ' GLU . . . . . 0.502 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 9.8 mp0 -65.37 62.95 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 113.632 0.975 . . . . 0.0 113.632 -176.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . 0.427 ' HD3' ' CB ' ' A' ' 773' ' ' PRO . 0.1 OUTLIER -108.42 0.85 21.3 Favored 'General case' 0 C--N 1.309 -1.171 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 168.963 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 777' ' ' ALA . . . . . 0.685 ' HB1' ' HD2' ' A' ' 778' ' ' PRO . . . -132.17 164.55 42.41 Favored Pre-proline 0 N--CA 1.447 -0.601 0 CA-C-N 113.833 -1.53 . . . . 0.0 108.435 177.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 778' ' ' PRO . . . . . 0.685 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 14.0 Cg_endo -55.91 -17.96 20.59 Favored 'Trans proline' 0 CA--C 1.534 0.476 0 C-N-CA 123.087 2.525 . . . . 0.0 114.577 -173.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . -158.54 34.57 0.5 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 119.71 -1.234 . . . . 0.0 113.397 -177.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 780' ' ' GLU . . . . . 0.54 ' HB2' ' HB3' ' A' ' 777' ' ' ALA . 0.1 OUTLIER -97.99 122.66 41.38 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.95 0.375 . . . . 0.0 110.043 178.622 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 16.4 m95 -131.46 146.71 52.37 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.521 -178.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 4.8 m -139.18 153.89 24.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.553 176.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 783' ' ' HIS . . . . . 0.41 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.9 OUTLIER -155.66 127.5 7.46 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.979 0.419 . . . . 0.0 110.688 173.056 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -95.0 99.93 11.86 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.633 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 785' ' ' VAL . . . . . 0.45 ' HB ' ' HD3' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -166.96 -173.57 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.931 179.629 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -124.39 48.19 1.98 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.904 0.383 . . . . 0.0 110.658 175.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 787' ' ' ALA . . . . . 0.406 ' N ' ' HD3' ' A' ' 788' ' ' PRO . . . 54.05 66.17 4.63 Favored Pre-proline 0 N--CA 1.467 0.386 0 CA-C-N 115.248 -0.887 . . . . 0.0 112.547 178.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 788' ' ' PRO . . . . . 0.775 ' HD2' ' OE1' ' A' ' 790' ' ' GLU . 17.0 Cg_exo -68.75 -61.75 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.655 2.236 . . . . 0.0 111.673 175.653 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 789' ' ' HIS . . . . . 0.501 ' HB3' ' O ' ' A' ' 788' ' ' PRO . 0.1 OUTLIER 175.79 10.47 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 O-C-N 123.32 0.388 . . . . 0.0 111.881 178.235 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 790' ' ' GLU . . . . . 0.775 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -93.77 -41.95 9.4 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.812 0.339 . . . . 0.0 110.6 -175.724 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 791' ' ' LEU . . . . . 0.732 HD21 HG11 ' A' ' 763' ' ' VAL . 0.2 OUTLIER -62.86 -49.17 83.29 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.667 -179.976 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 792' ' ' PRO . . . . . 0.524 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 10.7 Cg_endo -56.12 -30.94 81.35 Favored 'Trans proline' 0 C--N 1.354 0.864 0 C-N-CA 121.8 1.667 . . . . 0.0 112.042 175.402 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -72.91 -44.72 60.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.772 178.097 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -61.68 -38.18 86.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.181 177.05 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 795' ' ' LEU . . . . . 0.423 HD11 HG21 ' A' ' 746' ' ' VAL . 0.4 OUTLIER -66.68 -42.65 86.19 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.886 -179.774 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 796' ' ' ALA . . . . . 0.477 ' HB1' HD12 ' A' ' 801' ' ' ILE . . . -63.85 -38.34 90.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.117 0.484 . . . . 0.0 110.481 176.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.17 -44.6 87.98 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.74 178.239 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -69.05 -22.15 25.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.525 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.741 -176.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -85.3 0.35 52.29 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.03 0.443 . . . . 0.0 110.126 176.33 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 6.6 mt 68.1 71.8 0.31 Allowed 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 114.847 -1.069 . . . . 0.0 112.521 171.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 801' ' ' ILE . . . . . 0.477 HD12 ' HB1' ' A' ' 796' ' ' ALA . 59.2 mt -97.52 -66.37 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 171.318 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 51.19 51.73 16.35 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.274 -0.875 . . . . 0.0 113.084 170.23 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 803' ' ' MET . . . . . . . . . . . . . 7.2 ptp -149.88 124.67 9.84 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.422 175.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 804' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -153.91 148.79 26.61 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.462 179.066 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.73 76.33 9.59 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.192 0.52 . . . . 0.0 110.557 177.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -114.18 108.33 16.81 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.672 -178.203 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 28.3 t0 -142.87 85.16 10.15 Favored Pre-proline 0 C--N 1.326 -0.427 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.619 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 808' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_exo -71.57 137.53 30.54 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 123.201 2.6 . . . . 0.0 112.321 -179.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -95.88 144.43 26.22 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.7 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -147.56 143.29 27.67 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.095 -179.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -132.32 102.25 5.68 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.721 0.296 . . . . 0.0 111.105 -179.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -128.63 86.07 58.62 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-O 120.894 0.378 . . . . 0.0 110.238 176.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -85.8 162.82 10.56 Favored 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 123.043 2.495 . . . . 0.0 113.283 -176.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -132.13 137.67 47.77 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.3 176.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.97 116.52 10.19 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.026 0.441 . . . . 0.0 111.825 -177.726 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -132.3 118.45 19.47 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.714 178.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 2.5 ttpm? -129.76 95.34 3.95 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.36 -178.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -125.19 103.92 8.23 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.058 179.452 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -138.76 141.9 35.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.111 178.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -138.88 116.83 11.62 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.927 0.394 . . . . 0.0 111.245 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -78.84 144.54 34.92 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 173.226 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -143.1 -64.89 0.39 Allowed 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 113.426 0.898 . . . . 0.0 113.426 -168.128 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -67.25 125.72 26.98 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -168.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -163.3 90.81 0.67 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.866 -1.061 . . . . 0.0 109.74 174.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -116.68 120.36 38.37 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.834 178.27 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 826' ' ' MET . . . . . 0.482 ' O ' HG22 ' A' ' 869' ' ' ILE . 18.9 ttm -95.13 118.58 32.17 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.349 0.595 . . . . 0.0 112.193 -172.163 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 827' ' ' ILE . . . . . 0.98 ' HB ' HD21 ' A' ' 844' ' ' LEU . 2.5 mm -115.9 135.82 54.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.779 177.404 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 828' ' ' LEU . . . . . 0.467 HD23 HG13 ' A' ' 872' ' ' VAL . 2.7 tp -117.28 128.99 55.61 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.111 0.481 . . . . 0.0 111.094 -177.698 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 829' ' ' VAL . . . . . 0.675 HG12 HD11 ' A' ' 873' ' ' LEU . 0.0 OUTLIER -110.1 110.38 31.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.269 179.511 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 830' ' ' VAL . . . . . 0.709 HG13 ' HB3' ' A' ' 854' ' ' ALA . 0.0 OUTLIER -113.07 101.63 12.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.594 -179.261 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 831' ' ' ASP . . . . . 0.711 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 5.7 t70 -104.76 157.18 17.38 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 110.089 -0.337 . . . . 0.0 110.089 178.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -90.06 -21.42 22.33 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.053 177.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 833' ' ' HIS . . . . . 0.404 ' HA ' ' HD3' ' A' ' 834' ' ' PRO . 25.7 m170 -111.79 123.04 35.57 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.592 -178.42 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 834' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 833' ' ' HIS . 66.3 Cg_exo -52.25 -44.72 44.3 Favored 'Trans proline' 0 C--O 1.237 0.446 0 C-N-CA 123.666 2.911 . . . . 0.0 114.191 -173.499 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -71.87 -40.14 68.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.637 0.256 . . . . 0.0 111.082 -176.119 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 836' ' ' ASN . . . . . 0.423 ' CG ' ' HE3' ' A' ' 925' ' ' LYS . 5.1 t30 -68.31 -37.04 80.21 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 178.134 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 837' ' ' ARG . . . . . 0.711 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 4.3 ttp85 -54.12 -44.09 71.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.736 176.2 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 838' ' ' ARG . . . . . 0.454 ' HD2' ' O ' ' A' ' 838' ' ' ARG . 0.0 OUTLIER -65.26 -37.66 87.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.217 178.676 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 839' ' ' LEU . . . . . 0.441 ' HG ' ' NE2' ' A' ' 843' ' ' GLN . 9.2 tp -61.1 -49.8 75.84 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.645 -176.588 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 840' ' ' LEU . . . . . 0.524 HD11 ' HB2' ' A' ' 831' ' ' ASP . 0.0 OUTLIER -70.32 -35.57 73.73 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.778 179.564 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -62.79 -39.51 94.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.109 0.48 . . . . 0.0 110.772 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -70.23 -42.62 72.0 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.562 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 843' ' ' GLN . . . . . 0.94 ' HG2' HD12 ' A' ' 929' ' ' LEU . 20.8 mt-30 -55.98 -49.51 73.4 Favored 'General case' 0 C--O 1.23 0.078 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.363 176.321 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 844' ' ' LEU . . . . . 0.98 HD21 ' HB ' ' A' ' 827' ' ' ILE . 0.2 OUTLIER -59.65 -40.38 87.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.018 178.329 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -68.07 -24.05 74.56 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 121.069 -0.586 . . . . 0.0 112.502 179.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 5.4 m -86.31 -25.94 25.18 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.911 0.386 . . . . 0.0 110.591 178.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 847' ' ' LEU . . . . . 0.577 HD21 ' HA ' ' A' ' 933' ' ' LYS . 0.2 OUTLIER -67.54 -31.76 72.07 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.87 179.209 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 96.76 52.04 1.58 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.473 178.444 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 54.0 m-85 -133.65 174.56 10.31 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 178.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.4 107.89 13.57 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 175.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -97.57 129.85 44.67 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.618 -174.268 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 852' ' ' LYS . . . . . 0.468 ' HE2' ' SD ' ' A' ' 826' ' ' MET . 1.5 mptt -125.11 122.7 37.9 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 171.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 853' ' ' THR . . . . . 0.533 HG23 HG23 ' A' ' 829' ' ' VAL . 0.2 OUTLIER -110.6 144.28 39.72 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.911 0.386 . . . . 0.0 111.905 -175.083 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 854' ' ' ALA . . . . . 0.709 ' HB3' HG13 ' A' ' 830' ' ' VAL . . . -148.51 151.25 34.81 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.705 174.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 855' ' ' ASN . . . . . 0.474 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 1.1 t30 -130.69 74.56 1.6 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.318 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 856' ' ' ASP . . . . . 0.624 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 24.2 t0 171.26 146.65 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.34 0 O-C-N 123.595 0.559 . . . . 0.0 110.467 -178.554 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -75.3 -35.16 49.14 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.622 -0.799 . . . . 0.0 111.278 175.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 858' ' ' VAL . . . . . 0.407 ' H ' HG23 ' A' ' 858' ' ' VAL . 0.6 OUTLIER -68.65 -34.58 65.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 120.95 0.405 . . . . 0.0 110.415 178.077 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 859' ' ' ASP . . . . . 0.624 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 1.2 t70 -71.1 -30.11 66.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.455 179.36 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 860' ' ' ALA . . . . . 0.641 ' HB2' HG11 ' A' ' 830' ' ' VAL . . . -64.5 -39.15 93.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.337 176.169 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 861' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.79 -40.23 83.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.181 175.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -59.53 -52.95 63.38 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.952 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 7.6 p -65.06 -31.36 53.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.04 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 864' ' ' LEU . . . . . 0.732 HD21 HD11 ' A' ' 897' ' ' LEU . 0.2 OUTLIER -65.48 -32.9 74.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.905 0.383 . . . . 0.0 111.319 179.167 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 865' ' ' SER . . . . . 0.427 ' HB3' HD11 ' A' ' 893' ' ' LEU . 0.1 OUTLIER -88.59 -16.83 31.49 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.924 0.392 . . . . 0.0 111.04 -178.198 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.03 -27.81 15.43 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.794 -177.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -146.02 158.2 43.87 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.691 0.281 . . . . 0.0 110.811 -175.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -90.31 -28.27 18.87 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 176.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 869' ' ' ILE . . . . . 0.482 HG22 ' O ' ' A' ' 826' ' ' MET . 2.3 mt 56.93 -136.52 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.528 0.135 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 -177.537 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 870' ' ' ASP . . . . . 0.429 ' H ' HG22 ' A' ' 869' ' ' ILE . 0.3 OUTLIER -157.95 -52.42 0.07 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.11 0.481 . . . . 0.0 109.824 169.309 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 871' ' ' ILE . . . . . . . . . . . . . 7.4 mm -122.4 124.0 69.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.726 179.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 872' ' ' VAL . . . . . 0.491 ' O ' ' HA ' ' A' ' 899' ' ' VAL . 38.4 t -118.27 129.28 74.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.316 178.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 873' ' ' LEU . . . . . 0.675 HD11 HG12 ' A' ' 829' ' ' VAL . 0.7 OUTLIER -131.76 135.23 46.64 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 177.152 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 874' ' ' SER . . . . . 0.505 ' HA ' ' O ' ' A' ' 830' ' ' VAL . 0.9 OUTLIER -123.69 126.63 46.89 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.686 -177.459 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 875' ' ' ASP . . . . . 0.481 ' HA ' ' O ' ' A' ' 902' ' ' VAL . 40.5 t0 -111.21 120.14 41.28 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.41 -178.291 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 4.1 t -121.39 131.93 71.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.031 -176.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 877' ' ' ASN . . . . . 0.43 ' HB2' ' HE2' ' A' ' 925' ' ' LYS . 1.8 t-20 -121.96 53.02 1.23 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.073 0.464 . . . . 0.0 110.863 179.049 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 878' ' ' MET . . . . . 0.555 ' HG2' ' HB3' ' A' ' 881' ' ' MET . 0.3 OUTLIER -139.15 110.72 7.77 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.13 179.232 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 879' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -65.03 -49.16 2.97 Favored 'Trans proline' 0 CA--C 1.529 0.261 0 C-N-CA 122.606 2.204 . . . . 0.0 112.005 179.365 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -108.26 109.21 20.51 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.525 177.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 881' ' ' MET . . . . . 0.555 ' HB3' ' HG2' ' A' ' 878' ' ' MET . 0.3 OUTLIER -157.55 -174.92 5.1 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.111 0.482 . . . . 0.0 110.978 -175.943 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -122.21 -159.74 0.84 Allowed 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 171.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . 109.54 9.01 25.92 Favored Glycine 0 N--CA 1.445 -0.723 0 N-CA-C 110.397 -1.081 . . . . 0.0 110.397 -172.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.2 -28.28 68.64 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 176.626 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 885' ' ' ARG . . . . . 0.474 ' O ' ' HB2' ' A' ' 889' ' ' ARG . 0.0 OUTLIER -63.82 -31.11 72.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.285 173.939 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 886' ' ' LEU . . . . . 0.453 ' O ' ' HB ' ' A' ' 890' ' ' ILE . 0.0 OUTLIER -68.32 -45.58 72.58 Favored 'General case' 0 C--O 1.226 -0.172 0 CA-C-N 116.662 -0.244 . . . . 0.0 110.523 -177.532 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.59 -43.82 92.61 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.114 0.483 . . . . 0.0 110.814 179.544 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 2.9 tm0? -63.96 -51.46 64.25 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.89 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 889' ' ' ARG . . . . . 0.474 ' HB2' ' O ' ' A' ' 885' ' ' ARG . 0.2 OUTLIER -72.51 -28.17 62.71 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.776 -0.647 . . . . 0.0 112.124 -174.611 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 890' ' ' ILE . . . . . 0.453 ' HB ' ' O ' ' A' ' 886' ' ' LEU . 0.8 OUTLIER -71.65 -38.59 67.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.707 179.273 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 891' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.18 -24.88 54.76 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.121 0.486 . . . . 0.0 109.749 176.559 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -77.3 -31.89 55.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.459 179.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 893' ' ' LEU . . . . . 0.427 HD11 ' HB3' ' A' ' 865' ' ' SER . 1.6 tp -73.57 -49.36 26.73 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.345 -179.728 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 133.93 63.61 0.07 OUTLIER Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.297 -0.954 . . . . 0.0 112.161 -179.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 895' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.38 110.22 17.33 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.94 -0.392 . . . . 0.0 109.94 175.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -115.92 34.04 5.18 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.292 0.568 . . . . 0.0 110.996 -178.852 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 897' ' ' LEU . . . . . 0.732 HD11 HD21 ' A' ' 864' ' ' LEU . 0.2 OUTLIER -141.52 148.93 52.36 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.925 -178.283 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -69.66 130.12 18.9 Favored 'Trans proline' 0 C--O 1.24 0.599 0 C-N-CA 122.647 2.232 . . . . 0.0 113.03 -177.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 899' ' ' VAL . . . . . 0.7 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 8.0 t -112.05 129.45 67.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.586 176.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 900' ' ' ILE . . . . . 0.428 ' CG2' ' HG ' ' A' ' 923' ' ' LEU . 3.0 mp -99.2 111.93 30.07 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 175.805 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 901' ' ' GLY . . . . . 0.43 ' HA3' ' SD ' ' A' ' 919' ' ' MET . . . -95.07 101.13 2.67 Favored Glycine 0 N--CA 1.442 -0.938 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.035 -177.433 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 902' ' ' VAL . . . . . 1.017 ' HB ' ' HB2' ' A' ' 923' ' ' LEU . 0.1 OUTLIER -96.21 128.17 47.65 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 178.898 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 903' ' ' THR . . . . . 0.478 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.2 OUTLIER -135.51 169.12 18.0 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.321 -176.492 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 904' ' ' ALA . . . . . 0.576 ' HB2' ' HB2' ' A' ' 925' ' ' LYS . . . -142.81 104.73 4.38 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.678 0.275 . . . . 0.0 111.307 177.354 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 58.3 74.01 0.45 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.175 -0.921 . . . . 0.0 113.217 172.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 906' ' ' ALA . . . . . 0.618 ' HB3' ' HG3' ' A' ' 909' ' ' GLU . . . -117.76 -2.06 11.45 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 169.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 2.3 tp 71.76 -56.1 0.65 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 114.87 -1.059 . . . . 0.0 112.746 175.579 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 908' ' ' ALA . . . . . 0.588 ' O ' ' HB2' ' A' ' 912' ' ' GLN . . . -92.14 12.58 21.69 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -172.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 909' ' ' GLU . . . . . 0.618 ' HG3' ' HB3' ' A' ' 906' ' ' ALA . 0.5 OUTLIER -63.36 -36.19 82.89 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.583 0.23 . . . . 0.0 111.338 -175.192 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 910' ' ' GLU . . . . . 0.404 ' H ' ' HG3' ' A' ' 910' ' ' GLU . 0.0 OUTLIER -59.73 -61.89 2.28 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.209 -177.341 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.64 -29.31 66.75 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.088 -178.051 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 912' ' ' GLN . . . . . 0.588 ' HB2' ' O ' ' A' ' 908' ' ' ALA . 1.1 mt-30 -62.94 -45.04 94.33 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 177.55 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.61 -38.6 81.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.597 179.52 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 90.7 m -62.84 -35.25 79.31 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.956 176.002 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.47 -51.86 21.48 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.652 -179.051 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 916' ' ' GLU . . . . . 0.508 ' H ' ' HG3' ' A' ' 916' ' ' GLU . 0.0 OUTLIER -72.91 -50.31 24.45 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.672 -0.24 . . . . 0.0 111.292 -175.899 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 49.96 39.21 18.18 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.87 -174.512 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -99.11 -31.45 6.22 Favored Glycine 0 N--CA 1.445 -0.701 0 C-N-CA 120.845 -0.693 . . . . 0.0 111.975 -177.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 919' ' ' MET . . . . . 0.7 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 2.6 mtm -78.58 -94.0 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 110.533 -0.173 . . . . 0.0 110.533 179.325 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 920' ' ' ASP . . . . . 0.572 ' HB2' ' O ' ' A' ' 919' ' ' MET . 11.5 t70 157.47 -81.88 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.39 1.076 . . . . 0.0 108.871 179.479 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -97.48 173.04 7.37 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.752 -178.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 922' ' ' CYS . . . . . 0.424 ' O ' HD23 ' A' ' 923' ' ' LEU . 0.0 OUTLIER -144.18 136.76 26.86 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.943 0.401 . . . . 0.0 111.208 -178.248 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 923' ' ' LEU . . . . . 1.017 ' HB2' ' HB ' ' A' ' 902' ' ' VAL . 60.6 mt -127.25 -175.72 3.52 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.612 178.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 924' ' ' SER . . . . . 0.478 ' HA ' ' O ' ' A' ' 903' ' ' THR . 0.2 OUTLIER -126.31 144.17 50.9 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.362 178.3 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 925' ' ' LYS . . . . . 0.576 ' HB2' ' HB2' ' A' ' 904' ' ' ALA . 2.3 tttp -53.82 -42.96 95.44 Favored Pre-proline 0 CA--C 1.54 0.564 0 O-C-N 123.538 0.524 . . . . 0.0 112.305 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -66.91 69.99 0.52 Allowed 'Trans proline' 0 C--N 1.36 1.168 0 C-N-CA 122.067 1.845 . . . . 0.0 111.807 171.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 3.0 p -115.48 158.1 15.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.72 -177.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -109.03 161.97 14.67 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.255 177.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 929' ' ' LEU . . . . . 0.94 HD12 ' HG2' ' A' ' 843' ' ' GLN . 1.2 tt -61.77 -29.52 70.19 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.925 0.393 . . . . 0.0 110.295 176.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 930' ' ' ASP . . . . . 0.561 ' O ' ' HG2' ' A' ' 934' ' ' GLN . 17.1 t0 -62.59 -46.24 89.22 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.246 179.375 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 55.2 t -71.73 -42.23 70.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.784 -176.285 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 932' ' ' ILE . . . . . 0.512 HG22 ' HA ' ' A' ' 929' ' ' LEU . 0.0 OUTLIER -64.95 -38.74 83.55 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.038 177.956 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 933' ' ' LYS . . . . . 0.577 ' HA ' HD21 ' A' ' 847' ' ' LEU . 2.0 tmmt? -62.7 -46.13 89.58 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.328 176.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 934' ' ' GLN . . . . . 0.561 ' HG2' ' O ' ' A' ' 930' ' ' ASP . 14.1 mm100 -57.05 -51.13 70.51 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.906 179.145 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 5.1 m -63.13 -42.45 99.5 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.464 -178.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 936' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.02 -35.85 82.07 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.712 178.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 90.2 m -68.32 -45.28 73.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.098 178.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 9.4 tp -61.83 -42.87 99.57 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.166 0.508 . . . . 0.0 110.506 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -72.67 -31.85 65.39 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.935 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -62.12 -41.15 97.95 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.807 178.037 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 941' ' ' GLU . . . . . 0.552 ' HG3' ' N ' ' A' ' 942' ' ' ARG . 0.0 OUTLIER -66.51 -35.43 80.23 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.342 178.139 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 942' ' ' ARG . . . . . 0.552 ' N ' ' HG3' ' A' ' 941' ' ' GLU . 5.0 mmt85 -66.1 -48.65 70.24 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.024 0.44 . . . . 0.0 110.89 178.37 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 25.4 m -74.17 -33.23 34.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.531 -174.263 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 944' ' ' ARG . . . . . 0.507 ' HG3' ' N ' ' A' ' 945' ' ' LYS . 0.0 OUTLIER -69.92 -34.59 73.69 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 121.187 -0.205 . . . . 0.0 110.696 -179.819 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 945' ' ' LYS . . . . . 0.507 ' N ' ' HG3' ' A' ' 944' ' ' ARG . 12.8 ptpt -79.16 -31.74 44.08 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 121.158 -0.217 . . . . 0.0 111.347 -178.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 946' ' ' SER . . . . . 0.401 ' N ' ' HG3' ' A' ' 945' ' ' LYS . 7.7 m -74.42 -36.82 63.45 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.98 0.419 . . . . 0.0 110.508 179.489 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 947' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 947' ' ' ARG . 1.7 ttm105 -78.51 -19.51 52.82 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.722 175.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 27.1 t70 67.84 79.44 0.22 Allowed 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.036 -0.984 . . . . 0.0 111.118 177.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 14.9 m . . . . . 0 C--N 1.32 -0.7 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.651 176.983 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.479 1.025 0 CA-C-O 120.777 0.322 . . . . 0.0 110.596 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . -91.02 -128.71 4.11 Favored Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.922 -0.656 . . . . 0.0 112.065 179.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . 60.02 -167.63 9.05 Favored Glycine 0 CA--C 1.52 0.362 0 C-N-CA 121.235 -0.507 . . . . 0.0 112.701 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.3 -40.47 16.53 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.743 0.306 . . . . 0.0 110.877 177.539 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . 88.38 122.25 1.87 Allowed Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.752 -0.737 . . . . 0.0 111.729 -176.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -120.19 67.35 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 120.921 0.391 . . . . 0.0 110.697 -178.03 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.93 129.97 35.09 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.863 176.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . -101.18 -154.3 26.52 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.839 -0.696 . . . . 0.0 113.006 -176.148 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -86.75 46.87 1.41 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.762 0.315 . . . . 0.0 111.303 -175.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 705' ' ' SER . . . . . 0.628 ' HA ' ' O ' ' A' ' 730' ' ' GLY . 0.9 OUTLIER -70.54 62.56 0.25 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.439 177.394 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . -171.83 -28.45 0.02 OUTLIER Glycine 0 N--CA 1.446 -0.681 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.614 -178.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 707' ' ' LYS . . . . . 0.501 ' HE2' ' CE2' ' A' ' 799' ' ' TYR . 0.0 OUTLIER -63.41 148.99 46.99 Favored 'General case' 0 C--N 1.334 -0.095 0 N-CA-C 109.862 -0.421 . . . . 0.0 109.862 176.595 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 708' ' ' ARG . . . . . 0.463 ' H ' ' HE3' ' A' ' 707' ' ' LYS . 4.7 mtt180 -116.53 146.86 42.32 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.125 0.488 . . . . 0.0 111.322 -177.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 709' ' ' CYS . . . . . 0.506 ' HB2' HD22 ' A' ' 726' ' ' LEU . 42.9 t -126.89 138.0 53.24 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.138 174.163 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 710' ' ' TRP . . . . . 0.63 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 38.9 m95 -105.49 130.83 53.48 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 120.783 0.325 . . . . 0.0 110.336 -177.335 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 711' ' ' LEU . . . . . 0.545 HD22 HG22 ' A' ' 733' ' ' VAL . 0.6 OUTLIER -136.37 137.73 40.85 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.217 0.532 . . . . 0.0 111.429 -178.412 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -126.91 53.45 1.7 Allowed 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.322 176.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 713' ' ' VAL . . . . . 0.987 ' HA ' ' HB2' ' A' ' 750' ' ' ASP . 15.8 t -109.13 132.76 56.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.807 -175.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.57 -11.81 16.21 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.583 -177.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -74.22 112.9 10.83 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 170.357 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 716' ' ' ALA . . . . . 0.609 ' O ' ' HB2' ' A' ' 720' ' ' GLN . . . -63.05 -44.75 94.96 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 122.73 0.412 . . . . 0.0 111.542 -172.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.3 -39.04 89.08 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.002 0.43 . . . . 0.0 110.709 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 718' ' ' LEU . . . . . 0.518 ' O ' ' HG ' ' A' ' 722' ' ' LEU . 2.3 tt -69.0 -51.17 42.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.596 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 719' ' ' CYS . . . . . 0.434 ' HB3' ' HB ' ' A' ' 713' ' ' VAL . 15.0 p -65.12 -42.03 94.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.548 -176.624 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 720' ' ' GLN . . . . . 0.726 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -60.95 -39.38 89.3 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.288 179.483 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -58.12 -53.7 55.3 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.96 0.409 . . . . 0.0 110.836 -179.623 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 722' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 718' ' ' LEU . 0.0 OUTLIER -67.4 -48.25 67.9 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.304 -178.314 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 723' ' ' GLU . . . . . 0.726 ' HG2' ' HA ' ' A' ' 720' ' ' GLN . 3.1 pt-20 -59.51 -41.13 89.2 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.669 -174.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 724' ' ' THR . . . . . 0.671 ' HA ' ' HG2' ' A' ' 727' ' ' GLN . 10.0 m -70.35 -36.6 74.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.688 0.28 . . . . 0.0 111.277 -179.1 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 25.1 m -66.92 -34.08 76.98 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.478 0.18 . . . . 0.0 111.336 -179.116 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 726' ' ' LEU . . . . . 0.671 HD11 HD12 ' A' ' 795' ' ' LEU . 1.1 mp -81.48 -41.67 21.4 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 121.17 -0.212 . . . . 0.0 111.301 178.161 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 727' ' ' GLN . . . . . 0.671 ' HG2' ' HA ' ' A' ' 724' ' ' THR . 0.0 OUTLIER -65.07 -21.76 66.86 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.219 0.533 . . . . 0.0 109.906 177.19 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 728' ' ' ARG . . . . . 0.468 ' HB2' ' O ' ' A' ' 724' ' ' THR . 20.2 ttp85 -60.48 -26.69 66.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.841 175.056 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -107.21 4.32 26.55 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.144 -179.588 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 730' ' ' GLY . . . . . 0.628 ' O ' ' HA ' ' A' ' 705' ' ' SER . . . 99.44 -5.82 58.97 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 121.122 -0.561 . . . . 0.0 112.436 177.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 731' ' ' ILE . . . . . 0.589 HG21 HD23 ' A' ' 726' ' ' LEU . 17.1 mt -75.6 113.75 14.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.116 0.484 . . . . 0.0 110.487 -177.053 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 732' ' ' VAL . . . . . . . . . . . . . 10.5 m -76.33 133.69 30.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.83 -177.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 733' ' ' VAL . . . . . 0.545 HG22 HD22 ' A' ' 711' ' ' LEU . 0.3 OUTLIER -97.6 138.86 21.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.351 179.42 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 4.7 m -133.98 135.31 43.38 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.254 179.082 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.33 118.82 9.22 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.425 177.016 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 736' ' ' TYR . . . . . 0.63 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 50.8 t80 -82.48 95.01 7.57 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.255 0.55 . . . . 0.0 110.556 -179.294 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.24 -70.82 0.78 Allowed 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.404 175.803 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -130.22 91.29 0.3 Allowed Glycine 0 N--CA 1.445 -0.75 0 N-CA-C 110.788 -0.925 . . . . 0.0 110.788 175.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.13 164.25 34.46 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.78 0.324 . . . . 0.0 111.002 -176.37 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 740' ' ' GLU . . . . . 0.523 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 1.9 mt-10 -79.28 138.49 55.92 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.771 -179.066 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 741' ' ' PRO . . . . . 0.523 ' HD3' ' HA ' ' A' ' 740' ' ' GLU . 5.0 Cg_endo -87.46 126.63 2.28 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 123.282 2.655 . . . . 0.0 112.246 177.013 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 742' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -104.65 134.62 19.57 Favored Pre-proline 0 C--N 1.323 -0.571 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.009 177.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 743' ' ' PRO . . . . . 1.044 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 18.7 Cg_endo -61.91 -16.88 52.4 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 123.084 2.523 . . . . 0.0 112.98 -179.564 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 56.8 mp0 -105.33 11.79 32.41 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.844 0.354 . . . . 0.0 110.839 178.044 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -111.53 159.86 17.72 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.465 -177.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 3.6 p -124.08 141.44 44.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.236 -174.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 747' ' ' LEU . . . . . 0.671 ' HB3' HG23 ' A' ' 762' ' ' VAL . 0.5 OUTLIER -117.56 141.43 48.38 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.944 179.33 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -121.75 120.92 63.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 N-CA-C 108.631 -0.878 . . . . 0.0 108.631 169.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 749' ' ' THR . . . . . 0.427 HG23 HD22 ' A' ' 747' ' ' LEU . 0.0 OUTLIER -119.27 150.42 40.13 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -169.575 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 750' ' ' ASP . . . . . 0.987 ' HB2' ' HA ' ' A' ' 713' ' ' VAL . 10.1 t0 -108.84 111.55 23.33 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.479 179.472 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 751' ' ' GLU . . . . . 0.972 ' HG2' HH21 ' A' ' 767' ' ' ARG . 17.1 mm-40 58.75 -151.9 0.41 Allowed 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 123.517 0.727 . . . . 0.0 111.248 -177.69 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 752' ' ' VAL . . . . . 0.552 HG22 ' H ' ' A' ' 771' ' ' GLY . 2.6 t -85.74 129.73 37.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 121.061 0.458 . . . . 0.0 111.741 -174.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 753' ' ' VAL . . . . . 0.403 HG21 HG22 ' A' ' 749' ' ' THR . 3.4 t -120.7 159.59 22.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.19 -0.671 . . . . 0.0 109.19 177.597 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 1.4 m -79.78 37.93 0.37 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.974 0.416 . . . . 0.0 110.934 178.103 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 3.8 mttt -159.31 -174.65 4.8 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 178.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 756' ' ' LYS . . . . . 0.627 ' O ' ' HB2' ' A' ' 757' ' ' TRP . 0.0 OUTLIER -140.03 -67.6 0.43 Allowed 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 172.627 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 757' ' ' TRP . . . . . 0.627 ' HB2' ' O ' ' A' ' 756' ' ' LYS . 0.7 OUTLIER 157.68 164.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 114.303 -1.317 . . . . 0.0 109.519 -175.265 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.69 49.97 1.14 Allowed 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 173.362 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 759' ' ' GLY . . . . . 1.044 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -150.14 -144.6 3.96 Favored Glycine 0 N--CA 1.442 -0.954 0 C-N-CA 120.403 -0.904 . . . . 0.0 113.654 -173.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 760' ' ' ARG . . . . . 0.726 HH21 ' HB3' ' A' ' 821' ' ' ASP . 4.9 ttt85 -63.42 -61.51 2.29 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.22 -0.49 . . . . 0.0 111.652 -173.483 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -162.4 146.35 11.86 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.859 0.362 . . . . 0.0 111.068 -178.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 762' ' ' VAL . . . . . 0.671 HG23 ' HB3' ' A' ' 747' ' ' LEU . 4.0 p -126.57 122.96 62.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.738 174.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 763' ' ' VAL . . . . . 0.574 HG11 HD21 ' A' ' 791' ' ' LEU . 16.6 t -102.08 95.56 4.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.824 179.668 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 764' ' ' THR . . . . . 0.822 HG21 HG13 ' A' ' 772' ' ' ILE . 91.5 m -92.14 122.53 34.72 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.618 -179.38 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 765' ' ' PHE . . . . . 0.875 ' HZ ' ' HG ' ' A' ' 791' ' ' LEU . 3.9 m-30 -99.39 101.65 12.98 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.098 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -123.5 133.53 54.0 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.21 -177.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 767' ' ' ARG . . . . . 0.972 HH21 ' HG2' ' A' ' 751' ' ' GLU . 0.0 OUTLIER -140.19 -35.08 0.52 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.944 -179.048 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -84.98 -52.53 5.92 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 178.195 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -125.15 124.91 42.81 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.57 172.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 2.1 mt -115.39 85.34 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.161 0.505 . . . . 0.0 110.538 -177.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 771' ' ' GLY . . . . . 0.552 ' H ' HG22 ' A' ' 752' ' ' VAL . . . -92.35 -6.54 64.42 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.858 -0.686 . . . . 0.0 111.815 178.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 772' ' ' ILE . . . . . 0.822 HG13 HG21 ' A' ' 764' ' ' THR . 3.0 mm -103.52 131.3 22.19 Favored Pre-proline 0 C--N 1.323 -0.583 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.431 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 773' ' ' PRO . . . . . 0.562 ' O ' ' HB3' ' A' ' 774' ' ' LEU . 31.6 Cg_exo -60.57 -94.04 0.0 OUTLIER 'Trans proline' 0 CA--C 1.532 0.391 0 C-N-CA 123.188 2.592 . . . . 0.0 113.075 -176.725 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . 0.678 ' HA ' ' HB ' ' A' ' 782' ' ' VAL . 0.4 OUTLIER 167.4 -163.68 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.19 0.596 . . . . 0.0 109.913 -178.98 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 775' ' ' GLU . . . . . 0.605 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 1.4 mp0 -62.94 69.47 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.743 0.782 . . . . 0.0 112.423 175.084 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . 0.404 ' HE3' ' CD2' ' A' ' 774' ' ' LEU . 18.3 ptpt -132.61 -1.03 3.49 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 114.796 -1.093 . . . . 0.0 108.872 171.208 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 777' ' ' ALA . . . . . 0.457 ' HB1' ' HD2' ' A' ' 778' ' ' PRO . . . -131.62 158.36 75.58 Favored Pre-proline 0 N--CA 1.449 -0.494 0 CA-C-N 114.94 -1.027 . . . . 0.0 109.25 179.557 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 778' ' ' PRO . . . . . 0.457 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 23.0 Cg_endo -61.64 99.93 0.18 Allowed 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.58 2.187 . . . . 0.0 112.714 -178.529 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 94.23 15.62 47.09 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.883 -0.675 . . . . 0.0 113.408 175.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 780' ' ' GLU . . . . . 0.605 ' O ' ' HG3' ' A' ' 775' ' ' GLU . 2.7 tt0 -100.07 121.78 41.92 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 117.541 0.67 . . . . 0.0 110.322 179.251 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 781' ' ' TRP . . . . . 0.545 ' CZ3' HD11 ' A' ' 794' ' ' LEU . 12.0 m95 -129.33 124.23 33.77 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 176.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . 0.678 ' HB ' ' HA ' ' A' ' 774' ' ' LEU . 1.8 t -141.13 136.34 33.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 C-N-CA 120.696 -0.402 . . . . 0.0 111.711 -176.131 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 783' ' ' HIS . . . . . 0.444 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 1.0 OUTLIER -176.17 174.81 1.98 Allowed 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.913 168.432 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 784' ' ' SER . . . . . 0.726 ' HB3' ' HB3' ' A' ' 767' ' ' ARG . 0.7 OUTLIER -98.42 100.47 11.74 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.968 177.1 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 785' ' ' VAL . . . . . 0.755 HG12 ' H ' ' A' ' 787' ' ' ALA . 39.8 t -138.47 140.38 39.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -178.703 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -90.23 12.57 17.66 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.76 0.314 . . . . 0.0 111.138 -179.016 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 787' ' ' ALA . . . . . 0.755 ' H ' HG12 ' A' ' 785' ' ' VAL . . . 53.82 57.64 13.18 Favored Pre-proline 0 N--CA 1.467 0.381 0 CA-C-N 115.481 -0.781 . . . . 0.0 112.279 -178.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 788' ' ' PRO . . . . . 0.525 ' HD3' ' N ' ' A' ' 787' ' ' ALA . 24.2 Cg_exo -65.23 -57.83 0.24 Allowed 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 122.509 2.139 . . . . 0.0 112.375 178.22 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -160.73 -22.49 0.06 Allowed 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 179.041 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 790' ' ' GLU . . . . . 0.417 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 2.7 pm0 -73.09 -33.53 65.66 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 111.684 0.253 . . . . 0.0 111.684 -175.152 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 791' ' ' LEU . . . . . 0.875 ' HG ' ' HZ ' ' A' ' 765' ' ' PHE . 0.4 OUTLIER -71.07 -52.53 9.32 Favored Pre-proline 0 C--N 1.327 -0.382 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.761 -178.673 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 792' ' ' PRO . . . . . 0.443 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 9.5 Cg_endo -56.68 -30.77 85.17 Favored 'Trans proline' 0 C--N 1.356 0.949 0 C-N-CA 121.521 1.481 . . . . 0.0 111.831 175.228 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -69.7 -42.24 74.32 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.657 175.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 794' ' ' LEU . . . . . 0.545 HD11 ' CZ3' ' A' ' 781' ' ' TRP . 0.7 OUTLIER -60.44 -42.57 96.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.66 177.997 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 795' ' ' LEU . . . . . 0.671 HD12 HD11 ' A' ' 726' ' ' LEU . 0.3 OUTLIER -64.68 -35.36 80.77 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.988 0.423 . . . . 0.0 110.693 -179.338 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -63.67 -38.43 91.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.626 177.116 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 797' ' ' ARG . . . . . 0.509 ' HG3' ' N ' ' A' ' 798' ' ' ILE . 0.0 OUTLIER -71.55 -33.06 68.8 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.106 176.593 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 798' ' ' ILE . . . . . 0.509 ' N ' ' HG3' ' A' ' 797' ' ' ARG . 0.9 OUTLIER -61.45 -35.53 67.24 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.445 -175.739 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 799' ' ' TYR . . . . . 0.501 ' CE2' ' HE2' ' A' ' 707' ' ' LYS . 0.2 OUTLIER -104.62 28.04 7.39 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 119.829 -0.749 . . . . 0.0 112.076 176.114 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 800' ' ' LEU . . . . . 0.533 HD21 ' HB2' ' A' ' 821' ' ' ASP . 0.7 OUTLIER 46.09 50.74 11.52 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.291 -0.868 . . . . 0.0 112.993 170.419 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 801' ' ' ILE . . . . . . . . . . . . . 31.5 mt -77.21 79.72 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 121.817 0.817 . . . . 0.0 109.183 174.019 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -84.6 51.54 2.15 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.887 -1.051 . . . . 0.0 111.482 -173.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 803' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.35 -63.2 1.24 Allowed 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 107.937 -1.135 . . . . 0.0 107.937 170.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 804' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 56.02 61.02 2.93 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 114.809 -1.087 . . . . 0.0 112.619 167.319 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -83.42 37.65 0.58 Allowed 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.14 174.456 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 22.8 t70 53.43 58.03 5.6 Favored 'General case' 0 C--O 1.232 0.139 0 N-CA-C 107.953 -1.128 . . . . 0.0 107.953 -167.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 807' ' ' ASP . . . . . 0.447 ' HA ' ' HD3' ' A' ' 808' ' ' PRO . 1.7 t0 -66.64 118.61 56.02 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-N 114.304 -1.316 . . . . 0.0 111.101 -173.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 808' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 807' ' ' ASP . 13.5 Cg_exo -69.51 -166.57 0.18 Allowed 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 123.196 2.597 . . . . 0.0 112.062 179.126 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . 73.02 -41.06 0.49 Allowed 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.25 0.62 . . . . 0.0 111.427 -179.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -79.44 81.77 5.66 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.239 0.542 . . . . 0.0 110.09 175.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -101.33 28.71 5.23 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.161 177.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -130.47 75.49 78.96 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.982 177.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -74.21 14.5 0.72 Allowed 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.859 2.373 . . . . 0.0 112.641 -177.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.65 5.19 19.01 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.778 179.139 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.73 53.8 1.99 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.755 178.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -84.73 129.65 34.8 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.65 -176.825 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.03 162.13 41.15 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.106 -179.387 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -82.58 117.45 22.57 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.88 0.371 . . . . 0.0 110.509 179.128 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 45.1 t -83.76 84.12 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 121.302 0.572 . . . . 0.0 110.973 -178.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -104.22 19.35 20.33 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.814 174.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 821' ' ' ASP . . . . . 0.726 ' HB3' HH21 ' A' ' 760' ' ' ARG . 18.8 m-20 -76.73 94.18 3.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.386 -179.693 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -89.91 73.96 7.39 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.58 -176.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -106.41 54.86 0.68 Allowed 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 173.6 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -94.82 59.44 2.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.99 -1.004 . . . . 0.0 111.249 -172.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 3.0 tpt -112.99 92.7 4.1 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.142 0.496 . . . . 0.0 110.252 176.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 826' ' ' MET . . . . . . . . . . . . . 8.7 ptp -114.27 129.89 56.64 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.938 -179.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 827' ' ' ILE . . . . . 0.503 ' O ' ' HA ' ' A' ' 851' ' ' CYS . 1.0 OUTLIER -126.39 137.76 56.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.998 -178.584 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 828' ' ' LEU . . . . . 0.698 HD22 HD13 ' A' ' 869' ' ' ILE . 0.2 OUTLIER -107.68 143.61 35.93 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.782 0.325 . . . . 0.0 110.632 -178.504 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 829' ' ' VAL . . . . . 0.562 ' HA ' ' HB2' ' A' ' 873' ' ' LEU . 0.1 OUTLIER -128.04 119.67 51.72 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 121.315 0.579 . . . . 0.0 110.231 -179.345 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 830' ' ' VAL . . . . . 0.774 HG22 ' HB3' ' A' ' 854' ' ' ALA . 69.0 t -122.6 107.89 20.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 115.285 -0.871 . . . . 0.0 109.333 176.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 831' ' ' ASP . . . . . 0.545 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -118.22 153.26 34.19 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.155 0.502 . . . . 0.0 111.177 -177.611 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 832' ' ' ASP . . . . . 0.44 ' HB2' ' HA ' ' A' ' 876' ' ' VAL . 6.8 t70 -68.94 -42.4 76.78 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.778 -1.101 . . . . 0.0 112.293 -177.289 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 833' ' ' HIS . . . . . 0.489 ' HA ' ' HD2' ' A' ' 834' ' ' PRO . 0.5 OUTLIER -126.41 105.06 24.52 Favored Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 110.299 -0.259 . . . . 0.0 110.299 -173.776 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 834' ' ' PRO . . . . . 0.489 ' HD2' ' HA ' ' A' ' 833' ' ' HIS . 1.4 Cg_endo -40.75 -25.12 0.18 Allowed 'Trans proline' 0 C--N 1.353 0.803 1 C-N-CA 125.892 4.395 . . . . 0.0 116.553 -164.38 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 835' ' ' ILE . . . . . 0.443 ' O ' ' HG3' ' A' ' 838' ' ' ARG . 0.0 OUTLIER -61.01 -39.95 83.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 117.985 0.357 . . . . 0.0 111.173 -179.206 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 836' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -74.5 -41.6 60.41 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 837' ' ' ARG . . . . . 0.545 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 12.9 ttp180 -52.83 -49.93 64.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.25 177.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 838' ' ' ARG . . . . . 0.443 ' HG3' ' O ' ' A' ' 835' ' ' ILE . 0.0 OUTLIER -68.56 -34.61 76.13 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.94 -178.139 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 839' ' ' LEU . . . . . 0.435 HD22 ' HA ' ' A' ' 839' ' ' LEU . 0.6 OUTLIER -69.91 -49.15 54.88 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.077 -176.104 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 840' ' ' LEU . . . . . 0.479 HD11 ' CG2' ' A' ' 829' ' ' VAL . 2.6 pp -74.26 -31.44 62.55 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.405 -178.199 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -68.93 -35.21 76.53 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.941 0.401 . . . . 0.0 110.398 177.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 842' ' ' ASP . . . . . 0.404 ' HB2' ' O ' ' A' ' 838' ' ' ARG . 0.3 OUTLIER -63.5 -36.66 84.49 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.885 176.064 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 843' ' ' GLN . . . . . 0.734 ' HG3' HD23 ' A' ' 929' ' ' LEU . 2.5 mm-40 -68.44 -39.79 81.36 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.494 -0.775 . . . . 0.0 109.991 176.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 844' ' ' LEU . . . . . 0.585 ' HA ' HD12 ' A' ' 847' ' ' LEU . 0.3 OUTLIER -59.15 -43.46 92.06 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.273 176.579 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -61.92 -35.13 90.92 Favored Glycine 0 N--CA 1.451 -0.316 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.003 176.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 846' ' ' SER . . . . . 0.626 ' HA ' ' O ' ' A' ' 705' ' ' SER . 29.3 m -71.47 -17.26 62.37 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.792 0.33 . . . . 0.0 111.167 178.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 847' ' ' LEU . . . . . 0.585 HD12 ' HA ' ' A' ' 844' ' ' LEU . 44.3 mt -83.22 -18.39 39.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.374 175.312 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 88.97 30.02 15.99 Favored Glycine 0 C--N 1.33 0.213 0 C-N-CA 121.042 -0.599 . . . . 0.0 112.924 177.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 849' ' ' TYR . . . . . 0.424 ' HB2' HD23 ' A' ' 844' ' ' LEU . 27.1 m-85 -119.31 160.19 22.71 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 179.149 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.82 109.51 19.33 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.196 0.522 . . . . 0.0 111.085 -177.614 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 851' ' ' CYS . . . . . 0.503 ' HA ' ' O ' ' A' ' 827' ' ' ILE . 0.0 OUTLIER -93.39 151.79 19.53 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.996 179.97 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.92 109.94 13.63 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.517 173.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 853' ' ' THR . . . . . 0.428 HG22 ' CG ' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -94.43 124.07 38.23 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -171.189 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 854' ' ' ALA . . . . . 0.774 ' HB3' HG22 ' A' ' 830' ' ' VAL . . . -137.65 155.58 48.99 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.479 175.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -134.39 75.35 1.58 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 856' ' ' ASP . . . . . 0.62 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 26.8 t70 170.6 143.84 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.681 179.627 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -70.63 -37.42 67.82 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 121.038 -0.601 . . . . 0.0 113.148 -177.114 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -73.71 -31.54 32.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.846 0.355 . . . . 0.0 110.217 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 859' ' ' ASP . . . . . 0.62 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 1.0 OUTLIER -58.99 -29.21 67.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.764 177.275 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 860' ' ' ALA . . . . . 0.4 ' O ' ' HB2' ' A' ' 864' ' ' LEU . . . -63.76 -42.47 97.82 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.961 0.41 . . . . 0.0 110.495 177.018 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 861' ' ' LEU . . . . . 0.533 HD22 ' HA ' ' A' ' 861' ' ' LEU . 0.2 OUTLIER -71.14 -33.52 70.16 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.999 178.17 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -63.98 -52.23 60.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.602 179.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 9.4 p -69.14 -32.69 55.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.023 -177.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 864' ' ' LEU . . . . . 0.783 HD21 HD11 ' A' ' 897' ' ' LEU . 0.2 OUTLIER -61.3 -39.02 88.92 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.051 0.453 . . . . 0.0 110.571 177.984 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 11.0 m -82.14 -20.89 37.04 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.986 -178.49 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.8 -46.34 17.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.451 -179.607 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -150.5 138.92 20.46 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 177.729 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 18.3 m80 -86.7 88.66 7.72 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.301 0.572 . . . . 0.0 111.773 -172.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 869' ' ' ILE . . . . . 0.698 HD13 HD22 ' A' ' 828' ' ' LEU . 0.8 OUTLIER -69.48 154.74 8.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.301 173.22 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.03 -34.37 15.15 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -169.692 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 871' ' ' ILE . . . . . . . . . . . . . 2.2 mt -130.37 136.01 59.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 O-C-N 122.208 -0.308 . . . . 0.0 110.721 -179.165 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 872' ' ' VAL . . . . . 0.852 ' HB ' ' HB ' ' A' ' 899' ' ' VAL . 2.2 t -103.38 126.2 57.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.425 -178.092 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 873' ' ' LEU . . . . . 0.562 ' HB2' ' HA ' ' A' ' 829' ' ' VAL . 13.0 mt -104.03 99.82 9.57 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 170.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -106.05 96.95 6.84 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.581 0.229 . . . . 0.0 110.645 -178.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 875' ' ' ASP . . . . . 0.527 ' HA ' ' HB ' ' A' ' 902' ' ' VAL . 10.2 t0 -109.26 110.69 21.94 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.395 -177.245 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 876' ' ' VAL . . . . . 0.44 ' HA ' ' HB2' ' A' ' 832' ' ' ASP . 0.2 OUTLIER -108.01 155.19 8.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.22 0.533 . . . . 0.0 111.538 -175.884 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -115.63 -65.75 1.16 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.476 176.031 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 878' ' ' MET . . . . . 0.438 ' CB ' ' HD3' ' A' ' 879' ' ' PRO . 2.5 ttm -178.0 -70.32 0.0 OUTLIER Pre-proline 0 CA--C 1.538 0.491 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 177.062 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 879' ' ' PRO . . . . . 0.438 ' HD3' ' CB ' ' A' ' 878' ' ' MET . 79.5 Cg_endo -88.5 51.52 1.77 Allowed 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 122.302 2.001 . . . . 0.0 114.235 -164.138 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -125.63 -23.64 4.01 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.813 175.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 4.1 ptt? -173.78 179.58 1.98 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.426 -177.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -74.8 131.77 41.05 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 171.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -75.28 41.54 1.35 Allowed Glycine 0 CA--C 1.519 0.332 0 C-N-CA 121.49 -0.386 . . . . 0.0 114.005 -172.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 884' ' ' TYR . . . . . 0.448 ' H ' ' H ' ' A' ' 885' ' ' ARG . 0.6 OUTLIER -168.06 -8.58 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.842 0.353 . . . . 0.0 110.6 178.512 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 885' ' ' ARG . . . . . 0.448 ' H ' ' H ' ' A' ' 884' ' ' TYR . 5.8 tmm_? -63.51 -44.15 95.13 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.311 -176.141 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 886' ' ' LEU . . . . . 0.636 HD13 ' H ' ' A' ' 887' ' ' THR . 0.0 OUTLIER -68.72 -29.25 67.64 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.149 -177.796 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 887' ' ' THR . . . . . 0.636 ' H ' HD13 ' A' ' 886' ' ' LEU . 0.2 OUTLIER -72.33 -43.58 63.91 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 120.942 0.401 . . . . 0.0 110.409 176.863 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 33.1 mm-40 -59.53 -40.78 88.27 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.343 177.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.68 -34.78 62.74 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.355 -178.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 890' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -73.32 -36.72 49.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 120.9 -0.32 . . . . 0.0 110.904 -179.712 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 891' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -75.57 -25.26 56.91 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.969 0.414 . . . . 0.0 110.097 176.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -71.01 -45.41 63.99 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.209 175.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 4.4 tp -68.08 -45.81 72.77 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.571 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 125.49 66.41 0.18 Allowed Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.155 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 895' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 895' ' ' LEU . 0.0 OUTLIER -55.52 121.6 9.41 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.18 0.514 . . . . 0.0 110.204 176.599 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -123.12 17.8 9.97 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.323 0.582 . . . . 0.0 111.021 -176.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 897' ' ' LEU . . . . . 0.783 HD11 HD21 ' A' ' 864' ' ' LEU . 0.0 OUTLIER -144.03 138.54 15.09 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.203 -177.003 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 898' ' ' PRO . . . . . 0.472 ' HD3' ' HA ' ' A' ' 897' ' ' LEU . 33.1 Cg_exo -61.43 140.78 89.59 Favored 'Trans proline' 0 C--O 1.237 0.427 0 C-N-CA 122.709 2.273 . . . . 0.0 112.191 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 899' ' ' VAL . . . . . 0.877 HG13 ' HA ' ' A' ' 919' ' ' MET . 0.2 OUTLIER -128.88 138.42 54.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.655 0.74 . . . . 0.0 110.94 -178.425 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 900' ' ' ILE . . . . . 0.608 HG23 ' HB2' ' A' ' 921' ' ' SER . 4.1 mt -91.15 114.29 28.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 115.33 -0.85 . . . . 0.0 109.905 177.675 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 901' ' ' GLY . . . . . 0.518 ' O ' ' HA ' ' A' ' 922' ' ' CYS . . . -84.52 106.66 2.94 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.266 -179.201 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 902' ' ' VAL . . . . . 0.527 ' HB ' ' HA ' ' A' ' 875' ' ' ASP . 1.1 t -110.07 140.04 30.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 903' ' ' THR . . . . . 0.417 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.0 OUTLIER -150.82 150.03 30.44 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 110.267 -0.271 . . . . 0.0 110.267 176.542 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 904' ' ' ALA . . . . . 0.527 ' HB2' ' HD2' ' A' ' 925' ' ' LYS . . . -69.79 114.54 8.08 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 169.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -54.7 106.45 0.21 Allowed 'General case' 0 CA--C 1.513 -0.453 0 CA-C-O 121.539 0.685 . . . . 0.0 110.64 -174.427 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 906' ' ' ALA . . . . . 0.573 ' O ' ' HB2' ' A' ' 907' ' ' LEU . . . -120.8 -81.64 0.64 Allowed 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 114.851 -1.068 . . . . 0.0 110.109 -175.464 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 907' ' ' LEU . . . . . 0.573 ' HB2' ' O ' ' A' ' 906' ' ' ALA . 0.4 OUTLIER 160.24 137.87 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.475 -1.239 . . . . 0.0 108.496 -176.692 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . 74.69 -50.72 0.67 Allowed 'General case' 0 N--CA 1.467 0.391 0 O-C-N 123.788 0.68 . . . . 0.0 111.977 175.483 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.98 -38.8 92.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.119 0.485 . . . . 0.0 111.027 179.7 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 910' ' ' GLU . . . . . 0.458 ' H ' ' HG3' ' A' ' 910' ' ' GLU . 0.5 OUTLIER -67.15 -29.12 68.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.449 0.642 . . . . 0.0 109.496 175.581 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 1.4 ttpm? -77.69 -15.94 58.83 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.315 178.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -75.59 -37.53 59.8 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 173.266 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.49 -40.46 87.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.672 172.582 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 70.8 m -71.54 -26.5 62.67 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.156 176.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.6 -44.6 70.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.643 -179.809 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -77.85 -48.11 17.25 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.059 178.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.8 25.92 3.23 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.066 0.546 . . . . 0.0 111.776 -175.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -98.62 24.02 33.82 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.156 -178.017 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 919' ' ' MET . . . . . 0.877 ' HA ' HG13 ' A' ' 899' ' ' VAL . 1.5 mpt? -112.44 -86.19 0.56 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 110.162 -0.31 . . . . 0.0 110.162 -179.396 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 920' ' ' ASP . . . . . 0.595 ' HB2' ' O ' ' A' ' 919' ' ' MET . 8.4 t70 160.38 -73.17 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.449 0 O-C-N 124.614 1.196 . . . . 0.0 109.357 175.549 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . 0.608 ' HB2' HG23 ' A' ' 900' ' ' ILE . 0.1 OUTLIER -90.77 172.97 8.27 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.077 -173.993 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 922' ' ' CYS . . . . . 0.518 ' HA ' ' O ' ' A' ' 901' ' ' GLY . 0.1 OUTLIER -149.73 121.33 8.01 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.485 177.794 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 923' ' ' LEU . . . . . 0.402 HD12 HG13 ' A' ' 902' ' ' VAL . 0.0 OUTLIER -143.7 173.04 12.02 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.894 0.378 . . . . 0.0 110.31 175.138 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 924' ' ' SER . . . . . 0.417 ' HA ' ' O ' ' A' ' 903' ' ' THR . 1.8 m -94.52 153.29 17.97 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.436 179.255 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 925' ' ' LYS . . . . . 0.527 ' HD2' ' HB2' ' A' ' 904' ' ' ALA . 25.8 tttp -46.93 -48.99 51.42 Favored Pre-proline 0 CA--C 1.538 0.519 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -178.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 926' ' ' PRO . . . . . 0.421 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 50.2 Cg_endo -69.67 72.52 1.39 Allowed 'Trans proline' 0 C--N 1.355 0.901 0 C-N-CA 121.634 1.556 . . . . 0.0 112.815 177.257 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 34.2 t -79.62 119.19 28.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.428 177.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 928' ' ' THR . . . . . 0.466 ' O ' HG22 ' A' ' 932' ' ' ILE . 0.0 OUTLIER -72.42 156.55 38.94 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.228 179.655 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 929' ' ' LEU . . . . . 0.734 HD23 ' HG3' ' A' ' 843' ' ' GLN . 1.4 tm? -56.57 -46.05 80.97 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.631 -176.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -67.43 -33.09 74.44 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.372 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 54.0 t -70.08 -49.23 57.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.876 -177.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 932' ' ' ILE . . . . . 0.466 HG22 ' O ' ' A' ' 928' ' ' THR . 0.8 OUTLIER -61.1 -39.59 82.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 178.861 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 2.4 tmmt? -61.93 -48.79 78.85 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.894 178.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 -66.16 -48.22 71.48 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.487 -177.081 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 4.3 m -61.85 -44.16 97.38 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.165 -178.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 936' ' ' LEU . . . . . 0.462 ' HB2' ' O ' ' A' ' 932' ' ' ILE . 0.7 OUTLIER -64.59 -41.73 96.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.513 179.527 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 86.4 m -62.36 -44.43 96.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.977 0.418 . . . . 0.0 110.819 178.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -64.98 -44.32 89.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.406 -177.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 939' ' ' TYR . . . . . 0.418 ' HA ' ' HB3' ' A' ' 942' ' ' ARG . 19.5 m-85 -76.64 -28.57 56.09 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.414 -177.458 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -66.71 -41.51 87.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.899 0.381 . . . . 0.0 110.179 175.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 941' ' ' GLU . . . . . 0.523 ' HA ' ' HB2' ' A' ' 944' ' ' ARG . 7.4 pt-20 -75.55 -22.1 57.34 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.347 177.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 942' ' ' ARG . . . . . 0.418 ' HB3' ' HA ' ' A' ' 939' ' ' TYR . 0.0 OUTLIER -66.28 -48.01 71.78 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.259 175.604 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 12.7 m -74.41 -30.93 26.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.892 0.377 . . . . 0.0 110.342 178.05 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 944' ' ' ARG . . . . . 0.523 ' HB2' ' HA ' ' A' ' 941' ' ' GLU . 0.8 OUTLIER -65.83 -31.94 73.19 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.002 177.928 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -87.73 -15.35 37.31 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.692 0.282 . . . . 0.0 110.623 177.11 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 53.2 m -72.52 -45.27 60.11 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.904 0.383 . . . . 0.0 110.053 174.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 2.9 ttp85 -78.07 -31.68 50.37 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 174.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 36.5 t70 70.41 101.43 0.06 Allowed 'General case' 0 C--O 1.233 0.235 0 CA-C-N 114.751 -1.113 . . . . 0.0 111.272 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 C--O 1.25 1.103 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.145 -177.859 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 2.9 tpt . . . . . 0 N--CA 1.481 1.103 0 N-CA-C 110.191 -0.3 . . . . 0.0 110.191 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 106.17 -76.8 0.24 Allowed Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.786 -0.721 . . . . 0.0 111.523 -179.3 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . -163.45 -131.95 1.28 Allowed Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 121.044 -0.598 . . . . 0.0 111.937 177.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 5.7 m -92.82 148.48 22.0 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 120.951 0.405 . . . . 0.0 110.649 -179.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . -103.67 38.55 3.19 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.992 -0.623 . . . . 0.0 112.134 -177.181 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 11.5 p -152.78 152.29 10.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 N-CA-C 110.24 -0.281 . . . . 0.0 110.24 -178.493 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 702' ' ' GLU . . . . . 0.42 ' HB3' ' H ' ' A' ' 703' ' ' GLY . 1.0 OUTLIER -96.9 -143.28 0.29 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 175.255 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 703' ' ' GLY . . . . . 0.42 ' H ' ' HB3' ' A' ' 702' ' ' GLU . . . 72.87 68.35 1.61 Allowed Glycine 0 C--N 1.33 0.213 0 C-N-CA 120.516 -0.85 . . . . 0.0 111.174 -176.325 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.582 HD13 ' H ' ' A' ' 704' ' ' LEU . 0.0 OUTLIER -74.55 121.77 22.06 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.724 0.773 . . . . 0.0 112.499 -171.678 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 705' ' ' SER . . . . . 0.584 ' HA ' ' HA3' ' A' ' 730' ' ' GLY . 4.6 m -94.19 47.72 1.21 Allowed 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.153 -0.931 . . . . 0.0 109.444 172.161 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . -145.42 43.94 0.9 Allowed Glycine 0 N--CA 1.447 -0.596 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.617 -176.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 707' ' ' LYS . . . . . 0.559 ' HE3' ' HD1' ' A' ' 799' ' ' TYR . 1.2 mmtt -133.99 143.92 48.43 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 178.201 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 708' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.06 152.82 20.53 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.246 0.546 . . . . 0.0 110.993 -177.566 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 709' ' ' CYS . . . . . 0.501 ' SG ' HD13 ' A' ' 726' ' ' LEU . 0.1 OUTLIER -131.59 112.36 12.54 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.766 175.482 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 710' ' ' TRP . . . . . 0.64 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 84.5 m95 -92.51 121.12 33.66 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.431 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 711' ' ' LEU . . . . . 0.518 HD12 ' SG ' ' A' ' 719' ' ' CYS . 2.4 pt? -128.77 131.15 47.81 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.528 0.68 . . . . 0.0 111.297 -177.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -127.43 66.34 1.31 Allowed 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.876 177.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 713' ' ' VAL . . . . . 0.815 HG13 ' HB3' ' A' ' 750' ' ' ASP . 45.9 t -113.85 130.09 68.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.109 -179.015 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 714' ' ' ARG . . . . . 0.485 ' HD2' ' OD2' ' A' ' 750' ' ' ASP . 20.6 mtt180 -81.37 -13.42 58.35 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.209 -177.536 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 715' ' ' ASN . . . . . 0.643 ' H ' HG12 ' A' ' 713' ' ' VAL . 0.6 OUTLIER -87.4 122.2 30.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.411 178.098 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -70.59 -35.65 73.14 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.74 -176.199 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.18 -54.41 47.23 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.115 0.483 . . . . 0.0 110.244 177.502 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 718' ' ' LEU . . . . . 0.494 HD21 ' CE1' ' A' ' 765' ' ' PHE . 0.8 OUTLIER -61.99 -49.38 76.29 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.763 -179.499 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 719' ' ' CYS . . . . . 0.759 ' SG ' ' HB ' ' A' ' 713' ' ' VAL . 0.7 OUTLIER -59.31 -53.08 62.3 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.205 -177.287 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 720' ' ' GLN . . . . . 0.478 ' O ' ' HG3' ' A' ' 723' ' ' GLU . 48.0 tt0 -65.28 -44.34 88.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.798 -174.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -56.52 -48.81 76.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.822 0.344 . . . . 0.0 110.954 -176.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 76.3 mt -68.35 -48.12 65.65 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.09 -178.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 723' ' ' GLU . . . . . 0.724 ' HB2' HG21 ' A' ' 733' ' ' VAL . 0.0 OUTLIER -62.15 -42.73 99.53 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 111.705 0.261 . . . . 0.0 111.705 -174.092 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 724' ' ' THR . . . . . . . . . . . . . 27.8 m -69.08 -37.52 78.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.837 0.351 . . . . 0.0 111.022 -179.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 23.8 m -67.76 -37.88 82.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.804 0.335 . . . . 0.0 111.151 178.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 726' ' ' LEU . . . . . 0.785 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 18.4 mt -75.15 -38.57 60.9 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.998 0.428 . . . . 0.0 111.101 -178.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -74.47 -4.3 35.91 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.148 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.78 -44.11 94.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.277 -0.42 . . . . 0.0 109.95 174.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -80.67 -68.76 0.65 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.068 175.604 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 730' ' ' GLY . . . . . 0.584 ' HA3' ' HA ' ' A' ' 705' ' ' SER . . . 172.28 26.07 0.02 OUTLIER Glycine 0 N--CA 1.442 -0.919 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.942 176.051 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 731' ' ' ILE . . . . . 0.785 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 13.5 mm -84.09 91.49 2.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 177.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 732' ' ' VAL . . . . . . . . . . . . . 1.8 p -67.46 120.71 15.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.601 0.715 . . . . 0.0 111.173 -176.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 733' ' ' VAL . . . . . 0.724 HG21 ' HB2' ' A' ' 723' ' ' GLU . 4.3 m -91.32 147.63 5.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.087 -178.028 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 734' ' ' THR . . . . . 0.445 ' HB ' ' CZ3' ' A' ' 710' ' ' TRP . 0.1 OUTLIER -143.61 138.44 29.02 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.767 178.309 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.25 110.91 1.17 Allowed 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.788 176.46 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 736' ' ' TYR . . . . . 0.64 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 46.2 t80 -80.52 93.17 6.0 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.371 0.605 . . . . 0.0 110.175 178.158 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -97.21 -30.85 12.75 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.763 177.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 162.64 56.78 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 111.019 -0.832 . . . . 0.0 111.019 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 739' ' ' GLN . . . . . 0.492 ' HB3' ' H ' ' A' ' 740' ' ' GLU . 15.2 mp0 -101.99 -144.95 0.35 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.91 0.386 . . . . 0.0 111.728 -172.425 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 740' ' ' GLU . . . . . 0.492 ' H ' ' HB3' ' A' ' 739' ' ' GLN . 2.3 pt-20 -106.02 125.11 33.92 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.117 -173.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 741' ' ' PRO . . . . . 0.556 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 73.4 Cg_endo -78.5 123.34 5.92 Favored 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 122.471 2.114 . . . . 0.0 112.267 175.487 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 742' ' ' THR . . . . . 0.605 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.2 OUTLIER -118.84 141.8 30.72 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.589 178.506 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 743' ' ' PRO . . . . . 0.605 ' HD2' HG22 ' A' ' 742' ' ' THR . 34.7 Cg_endo -65.55 -1.38 4.72 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 123.314 2.676 . . . . 0.0 113.032 179.036 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -103.34 -8.48 20.24 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.245 0.545 . . . . 0.0 110.4 177.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -112.75 153.1 28.3 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.744 -171.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 746' ' ' VAL . . . . . 0.48 ' HA ' ' O ' ' A' ' 761' ' ' ALA . 8.3 m -116.94 147.92 20.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.817 178.353 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 747' ' ' LEU . . . . . 0.434 HD23 ' HA ' ' A' ' 747' ' ' LEU . 0.0 OUTLIER -107.86 104.61 14.12 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.372 179.933 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -99.49 111.89 30.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 177.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 14.0 p -124.09 156.22 36.98 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.896 0.379 . . . . 0.0 111.418 -175.326 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 750' ' ' ASP . . . . . 0.815 ' HB3' HG13 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -109.16 130.77 55.48 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 168.464 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 751' ' ' GLU . . . . . 0.43 ' HG3' ' N ' ' A' ' 752' ' ' VAL . 4.4 tp10 72.86 153.25 0.13 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.188 -167.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 752' ' ' VAL . . . . . 0.847 HG22 ' HB ' ' A' ' 772' ' ' ILE . 1.4 t -70.82 123.5 25.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.63 -178.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 11.1 m -101.32 155.09 4.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.563 -179.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -83.24 75.15 9.97 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.061 178.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -154.24 127.3 8.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.066 0.46 . . . . 0.0 111.568 -175.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.96 81.2 4.59 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 169.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 757' ' ' TRP . . . . . 0.556 ' CH2' ' HA ' ' A' ' 741' ' ' PRO . 70.7 t-105 -68.24 100.64 1.06 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.759 -177.649 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.39 49.15 0.99 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.38 0.61 . . . . 0.0 109.805 178.659 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 759' ' ' GLY . . . . . 0.45 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -104.13 -131.34 7.15 Favored Glycine 0 N--CA 1.444 -0.768 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.396 178.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 2.9 ttm-85 -79.83 -50.41 10.56 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.102 177.128 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 761' ' ' ALA . . . . . 0.48 ' O ' ' HA ' ' A' ' 746' ' ' VAL . . . -166.93 157.87 12.07 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.256 179.065 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 762' ' ' VAL . . . . . 0.544 HG13 ' HA ' ' A' ' 780' ' ' GLU . 1.4 p -133.91 122.8 43.16 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 176.604 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 763' ' ' VAL . . . . . 0.489 HG11 HD21 ' A' ' 791' ' ' LEU . 41.8 t -114.71 115.11 48.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.291 -0.413 . . . . 0.0 109.904 -178.284 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 764' ' ' THR . . . . . 0.586 HG22 ' HB2' ' A' ' 766' ' ' CYS . 34.2 m -112.2 119.09 37.17 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.246 0.546 . . . . 0.0 111.321 -178.321 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 765' ' ' PHE . . . . . 0.612 ' HA ' ' O ' ' A' ' 783' ' ' HIS . 91.3 m-85 -84.06 98.0 9.62 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.372 175.163 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 766' ' ' CYS . . . . . 0.586 ' HB2' HG22 ' A' ' 764' ' ' THR . 1.7 t -140.04 141.35 36.27 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -172.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 767' ' ' ARG . . . . . 0.505 ' HE ' ' HB3' ' A' ' 767' ' ' ARG . 0.0 OUTLIER -104.29 -31.03 9.76 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.026 174.654 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 768' ' ' ARG . . . . . 0.407 HH11 ' HD2' ' A' ' 768' ' ' ARG . 0.0 OUTLIER -83.92 -50.86 7.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.194 177.401 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . 0.572 ' HA ' ' CG2' ' A' ' 752' ' ' VAL . 12.3 p-80 46.93 88.22 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.331 1.052 . . . . 0.0 113.037 177.484 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 6.1 mt -78.05 -74.21 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.919 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 771' ' ' GLY . . . . . 0.679 ' H ' HG11 ' A' ' 752' ' ' VAL . . . -111.85 7.91 27.62 Favored Glycine 0 C--N 1.332 0.317 0 C-N-CA 120.485 -0.864 . . . . 0.0 114.375 -170.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 772' ' ' ILE . . . . . 0.847 ' HB ' HG22 ' A' ' 752' ' ' VAL . 43.2 mm -105.0 115.58 62.16 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 117.647 0.724 . . . . 0.0 110.397 176.307 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 773' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -90.63 -170.41 0.38 Allowed 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 123.769 2.98 . . . . 0.0 112.465 176.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . 0.459 ' HA ' HG22 ' A' ' 782' ' ' VAL . 1.0 OUTLIER -95.32 -158.22 0.63 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.509 178.041 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 775' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 0.3 OUTLIER -66.49 61.92 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -179.085 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -121.56 22.15 10.71 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 167.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 777' ' ' ALA . . . . . 0.851 ' HB1' ' HD2' ' A' ' 778' ' ' PRO . . . -148.47 176.31 2.3 Favored Pre-proline 0 N--CA 1.451 -0.399 0 CA-C-N 113.611 -1.632 . . . . 0.0 108.794 -175.39 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 778' ' ' PRO . . . . . 0.851 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 51.8 Cg_endo -68.65 61.96 1.2 Allowed 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 122.702 2.268 . . . . 0.0 114.176 -178.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 102.02 22.26 10.2 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.611 -0.804 . . . . 0.0 113.764 173.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 780' ' ' GLU . . . . . 0.584 ' HB2' ' HB3' ' A' ' 777' ' ' ALA . 0.3 OUTLIER -79.57 125.28 29.39 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 117.111 0.456 . . . . 0.0 110.564 178.213 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 20.3 m95 -130.12 115.62 17.32 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.65 0.262 . . . . 0.0 110.429 179.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . 0.459 HG22 ' HA ' ' A' ' 774' ' ' LEU . 0.1 OUTLIER -103.04 136.02 37.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 110.176 -0.305 . . . . 0.0 110.176 175.263 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 783' ' ' HIS . . . . . 0.612 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.2 OUTLIER -152.1 132.93 14.11 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.725 0.298 . . . . 0.0 110.827 179.202 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -99.44 100.24 11.26 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.982 0.42 . . . . 0.0 110.176 174.121 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -164.56 178.92 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.764 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -111.51 28.95 8.27 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.94 0.4 . . . . 0.0 110.187 175.106 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 57.82 70.54 1.26 Allowed Pre-proline 0 N--CA 1.465 0.285 0 CA-C-N 115.32 -0.855 . . . . 0.0 111.278 -178.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 788' ' ' PRO . . . . . 0.458 ' HB2' ' H ' ' A' ' 789' ' ' HIS . 5.3 Cg_exo -77.09 -96.34 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.724 2.283 . . . . 0.0 112.438 -178.34 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 789' ' ' HIS . . . . . 0.458 ' H ' ' HB2' ' A' ' 788' ' ' PRO . 0.2 OUTLIER -124.11 2.94 8.62 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.964 0.411 . . . . 0.0 111.717 -178.319 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 790' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -104.38 -46.66 4.33 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.669 -175.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 791' ' ' LEU . . . . . 0.588 ' HG ' ' CZ ' ' A' ' 765' ' ' PHE . 0.4 OUTLIER -62.91 -51.23 72.73 Favored Pre-proline 0 C--N 1.327 -0.382 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -178.803 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 792' ' ' PRO . . . . . 0.427 ' HD3' ' HB3' ' A' ' 791' ' ' LEU . 24.5 Cg_exo -60.95 -30.59 90.22 Favored 'Trans proline' 0 C--N 1.354 0.836 0 C-N-CA 121.445 1.43 . . . . 0.0 111.626 179.747 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -68.98 -45.49 70.5 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.413 176.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 794' ' ' LEU . . . . . 0.444 HD22 ' HA ' ' A' ' 794' ' ' LEU . 0.2 OUTLIER -63.78 -36.58 84.36 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.687 179.437 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 795' ' ' LEU . . . . . 0.443 HD22 ' HA ' ' A' ' 795' ' ' LEU . 0.4 OUTLIER -63.56 -47.61 80.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.771 179.622 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -66.14 -33.6 76.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.105 179.196 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 1.5 ttt-85 -71.05 -37.12 72.53 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.889 179.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -69.53 -31.45 49.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.827 -178.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 799' ' ' TYR . . . . . 0.559 ' HD1' ' HE3' ' A' ' 707' ' ' LYS . 17.3 m-85 -85.39 -0.43 54.82 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.578 178.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 47.7 mt 58.4 44.7 17.85 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.337 178.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 801' ' ' ILE . . . . . 0.411 ' C ' ' H ' ' A' ' 803' ' ' MET . 48.0 mm -72.01 -40.57 67.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.14 177.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 802' ' ' GLU . . . . . 0.492 ' HA ' ' OG ' ' A' ' 805' ' ' SER . 8.0 mm-40 72.13 -21.68 0.22 Allowed 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.619 0.768 . . . . 0.0 112.873 173.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 803' ' ' MET . . . . . 0.411 ' H ' ' C ' ' A' ' 801' ' ' ILE . 6.1 tpt -71.36 -32.15 68.17 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.285 0.564 . . . . 0.0 109.881 175.602 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 804' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -112.29 12.17 20.23 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.995 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 805' ' ' SER . . . . . 0.492 ' OG ' ' HA ' ' A' ' 802' ' ' GLU . 13.8 m -82.98 81.97 8.43 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 174.089 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -80.65 52.54 1.7 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.669 -172.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -130.84 90.72 39.07 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.084 177.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 808' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -81.63 54.72 5.23 Favored 'Trans proline' 0 N--CA 1.462 -0.381 0 C-N-CA 122.647 2.232 . . . . 0.0 111.645 178.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . 60.14 67.42 0.86 Allowed 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.751 -0.658 . . . . 0.0 109.381 -173.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -45.93 -62.52 1.28 Allowed 'General case' 0 C--O 1.232 0.181 0 CA-C-N 114.843 -1.071 . . . . 0.0 112.752 -174.473 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -142.32 -53.26 0.41 Allowed 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -176.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -113.45 122.66 34.84 Favored Pre-proline 0 C--N 1.322 -0.587 0 CA-C-O 120.561 0.22 . . . . 0.0 111.546 -173.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_exo -58.0 -47.24 21.28 Favored 'Trans proline' 0 C--O 1.232 0.209 0 C-N-CA 122.638 2.225 . . . . 0.0 110.996 172.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 1.4 m 69.88 -58.54 0.53 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.884 0.874 . . . . 0.0 113.1 173.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -82.15 88.6 6.46 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.244 0.545 . . . . 0.0 112.296 -174.009 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 47.0 t0 -91.75 163.68 13.99 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.689 174.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.75 -62.22 1.75 Allowed 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 -179.539 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . 60.56 89.83 0.07 Allowed 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.817 176.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -101.28 135.82 35.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.664 179.519 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 1.7 m -130.61 93.79 3.51 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.104 0.478 . . . . 0.0 111.025 -177.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -83.0 74.55 9.95 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.055 0.455 . . . . 0.0 110.742 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -111.15 5.38 20.01 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.411 179.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -101.93 107.44 18.59 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.662 -178.326 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -129.26 -35.82 1.76 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -173.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 825' ' ' MET . . . . . 0.543 ' O ' ' HB2' ' A' ' 850' ' ' GLN . 0.1 OUTLIER -127.83 106.66 9.27 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.979 -176.767 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 826' ' ' MET . . . . . 0.489 ' H ' ' HG2' ' A' ' 826' ' ' MET . 0.0 OUTLIER -97.84 108.86 21.66 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.301 0.572 . . . . 0.0 111.3 -177.042 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 827' ' ' ILE . . . . . 0.49 HG23 ' HB ' ' A' ' 871' ' ' ILE . 9.6 mm -107.52 136.13 43.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.312 175.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 828' ' ' LEU . . . . . 0.607 HD23 HG13 ' A' ' 872' ' ' VAL . 46.2 tp -106.17 122.61 46.56 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.994 0.425 . . . . 0.0 110.541 -176.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 829' ' ' VAL . . . . . 0.632 ' HB ' ' HD2' ' A' ' 837' ' ' ARG . 0.8 OUTLIER -113.38 111.55 36.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.19 -179.361 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 830' ' ' VAL . . . . . 0.621 HG22 ' HB3' ' A' ' 854' ' ' ALA . 12.7 t -117.37 129.27 74.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.335 -179.435 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 831' ' ' ASP . . . . . 0.752 ' HB2' ' NE ' ' A' ' 837' ' ' ARG . 9.1 t0 -134.61 142.54 46.94 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 173.028 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 832' ' ' ASP . . . . . 0.425 ' HB2' ' HB2' ' A' ' 878' ' ' MET . 4.8 p-10 -65.98 -15.1 62.71 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.132 0.492 . . . . 0.0 110.432 174.108 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 833' ' ' HIS . . . . . 0.408 ' HA ' ' HD2' ' A' ' 834' ' ' PRO . 22.1 m170 -117.41 104.99 49.21 Favored Pre-proline 0 C--O 1.234 0.268 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.486 171.246 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 834' ' ' PRO . . . . . 0.408 ' HD2' ' HA ' ' A' ' 833' ' ' HIS . 19.7 Cg_endo -57.67 -35.77 98.7 Favored 'Trans proline' 0 CA--C 1.532 0.392 0 C-N-CA 123.184 2.589 . . . . 0.0 113.799 -173.388 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 835' ' ' ILE . . . . . 0.519 ' O ' ' HG3' ' A' ' 838' ' ' ARG . 0.0 OUTLIER -59.55 -44.38 93.0 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-O 121.006 0.432 . . . . 0.0 111.199 -177.737 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 836' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -65.41 -40.09 92.95 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.248 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 837' ' ' ARG . . . . . 0.752 ' NE ' ' HB2' ' A' ' 831' ' ' ASP . 0.0 OUTLIER -64.97 -46.99 79.21 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.675 -177.028 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 838' ' ' ARG . . . . . 0.519 ' HG3' ' O ' ' A' ' 835' ' ' ILE . 0.3 OUTLIER -65.87 -29.13 69.53 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.839 0.352 . . . . 0.0 110.962 -179.28 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 8.5 mt -66.41 -52.56 45.31 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.944 -179.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 840' ' ' LEU . . . . . 0.462 HD11 ' HD3' ' A' ' 837' ' ' ARG . 1.2 pp -72.68 -26.66 61.7 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.588 179.247 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -65.58 -33.28 75.55 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.008 0.433 . . . . 0.0 110.202 174.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -63.14 -43.5 98.2 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.045 175.53 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 843' ' ' GLN . . . . . . . . . . . . . 45.2 mm-40 -64.29 -39.73 94.52 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.387 176.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 844' ' ' LEU . . . . . 0.598 HD13 ' HB2' ' A' ' 849' ' ' TYR . 0.0 OUTLIER -61.15 -34.96 75.86 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.578 176.575 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -62.41 -39.0 97.22 Favored Glycine 0 N--CA 1.445 -0.72 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.003 176.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -70.32 -23.25 62.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.92 0.391 . . . . 0.0 110.985 176.514 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 847' ' ' LEU . . . . . 0.411 ' HA ' HD23 ' A' ' 847' ' ' LEU . 5.4 mt -78.81 -21.47 47.69 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.885 0.374 . . . . 0.0 111.127 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 102.21 12.15 34.55 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.662 -0.78 . . . . 0.0 113.545 174.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 849' ' ' TYR . . . . . 0.598 ' HB2' HD13 ' A' ' 844' ' ' LEU . 66.6 m-85 -104.68 138.4 41.04 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.958 0.379 . . . . 0.0 109.986 178.658 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 850' ' ' GLN . . . . . 0.543 ' HB2' ' O ' ' A' ' 825' ' ' MET . 4.7 mp0 -73.03 121.08 19.57 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 179.275 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 851' ' ' CYS . . . . . 0.471 ' SG ' ' HB3' ' A' ' 844' ' ' LEU . 0.0 OUTLIER -108.13 126.83 53.23 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 120.988 0.423 . . . . 0.0 111.607 -173.884 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 852' ' ' LYS . . . . . 0.422 ' O ' HD12 ' A' ' 828' ' ' LEU . 0.0 OUTLIER -106.36 111.76 24.48 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 174.797 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 853' ' ' THR . . . . . 0.468 ' HA ' HG23 ' A' ' 829' ' ' VAL . 0.9 OUTLIER -91.18 124.58 35.5 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 120.93 0.395 . . . . 0.0 111.451 -174.632 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 854' ' ' ALA . . . . . 0.621 ' HB3' HG22 ' A' ' 830' ' ' VAL . . . -130.11 142.28 50.61 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.961 -179.681 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 855' ' ' ASN . . . . . 0.56 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 20.2 t30 -124.22 74.99 1.34 Allowed 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 177.026 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 856' ' ' ASP . . . . . 0.743 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 12.0 t70 166.14 147.37 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.036 177.043 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -71.9 -41.91 54.13 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.566 178.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 2.0 t -73.7 -34.7 41.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.077 0.465 . . . . 0.0 110.598 -178.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 859' ' ' ASP . . . . . 0.743 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 1.1 t0 -64.27 -27.74 69.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.939 -178.867 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -62.14 -38.39 88.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.139 0.495 . . . . 0.0 110.352 176.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 861' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.14 -33.01 63.39 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.93 176.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -60.56 -53.76 53.64 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.858 178.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 10.7 p -66.01 -32.21 57.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.769 0.318 . . . . 0.0 110.945 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 864' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.99 -40.46 97.82 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.565 176.578 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 7.4 m -74.31 -27.28 60.64 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.862 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 866' ' ' LYS . . . . . 0.536 ' HA ' ' HD2' ' A' ' 866' ' ' LYS . 1.3 tptm -69.79 -55.85 8.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.716 179.532 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 867' ' ' ASN . . . . . 0.482 ' HB3' ' H ' ' A' ' 868' ' ' HIS . 6.0 t30 -119.15 -105.5 0.39 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.905 178.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 868' ' ' HIS . . . . . 0.482 ' H ' ' HB3' ' A' ' 867' ' ' ASN . 0.1 OUTLIER 178.93 155.54 0.45 Allowed 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 178.571 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 869' ' ' ILE . . . . . 0.452 HG12 ' HB2' ' A' ' 828' ' ' LEU . 0.7 OUTLIER -143.25 147.98 19.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 -179.794 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.69 -49.98 5.13 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.694 0.283 . . . . 0.0 111.356 -178.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 871' ' ' ILE . . . . . 0.49 ' HB ' HG23 ' A' ' 827' ' ' ILE . 18.7 mm -111.54 123.98 67.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.272 -178.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 872' ' ' VAL . . . . . 0.607 HG13 HD23 ' A' ' 828' ' ' LEU . 1.8 t -109.52 125.92 66.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.217 -179.086 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 873' ' ' LEU . . . . . 0.698 HD11 HD12 ' A' ' 936' ' ' LEU . 47.3 mt -111.49 100.83 9.32 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 173.456 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 5.7 m -105.77 101.49 11.0 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.939 0.4 . . . . 0.0 111.22 -176.206 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 875' ' ' ASP . . . . . 0.673 ' OD1' ' HG2' ' A' ' 925' ' ' LYS . 0.6 OUTLIER -92.62 106.6 18.55 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.383 -179.517 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 876' ' ' VAL . . . . . 0.683 HG12 ' HG2' ' A' ' 879' ' ' PRO . 0.1 OUTLIER -115.45 111.99 37.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.314 0.578 . . . . 0.0 112.134 -172.25 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -119.65 -44.59 2.54 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.664 172.044 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 878' ' ' MET . . . . . 0.425 ' HB2' ' HB2' ' A' ' 832' ' ' ASP . 4.4 tpp -69.61 -50.15 19.47 Favored Pre-proline 0 CA--C 1.537 0.443 0 CA-C-N 115.559 -0.746 . . . . 0.0 112.699 -178.844 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 879' ' ' PRO . . . . . 0.683 ' HG2' HG12 ' A' ' 876' ' ' VAL . 34.7 Cg_exo -59.3 103.94 0.19 Allowed 'Trans proline' 0 C--N 1.357 1.011 0 C-N-CA 121.961 1.774 . . . . 0.0 112.579 179.197 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -113.54 -53.9 2.65 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.715 179.243 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -94.51 -22.86 17.97 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.105 179.471 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -87.97 2.96 50.43 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.836 -179.38 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -76.9 38.33 1.52 Allowed Glycine 0 C--N 1.331 0.301 0 CA-C-N 115.793 -0.64 . . . . 0.0 112.047 178.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -137.22 -40.91 0.58 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -68.47 -47.33 67.39 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.677 -179.017 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 886' ' ' LEU . . . . . 0.647 ' HG ' ' N ' ' A' ' 887' ' ' THR . 0.0 OUTLIER -65.55 -43.55 89.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.646 -0.252 . . . . 0.0 110.384 -179.495 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 887' ' ' THR . . . . . 0.647 ' N ' ' HG ' ' A' ' 886' ' ' LEU . 0.0 OUTLIER -62.52 -44.89 95.25 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.218 0.532 . . . . 0.0 110.662 -179.483 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 888' ' ' GLN . . . . . 0.79 ' HA ' ' HD3' ' A' ' 891' ' ' ARG . 15.9 tt0 -63.47 -41.31 98.61 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.624 177.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -67.27 -41.66 85.13 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.192 0.441 . . . . 0.0 112.192 -175.185 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 890' ' ' ILE . . . . . 0.614 HG13 ' O ' ' A' ' 886' ' ' LEU . 22.2 mt -68.54 -42.63 83.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.881 -179.478 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 891' ' ' ARG . . . . . 0.79 ' HD3' ' HA ' ' A' ' 888' ' ' GLN . 0.7 OUTLIER -68.92 -23.93 64.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.032 0.444 . . . . 0.0 110.216 177.262 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 -71.18 -42.14 69.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.367 176.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 893' ' ' LEU . . . . . 0.493 ' HA ' HD22 ' A' ' 893' ' ' LEU . 0.2 OUTLIER -71.26 -32.8 69.14 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.183 179.071 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 115.66 87.5 1.41 Allowed Glycine 0 N--CA 1.441 -1.017 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.747 178.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 895' ' ' LEU . . . . . 0.524 HD12 HG22 ' A' ' 890' ' ' ILE . 0.3 OUTLIER -63.74 109.27 1.66 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.125 0.488 . . . . 0.0 110.602 177.781 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -120.77 16.95 11.9 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.805 0.812 . . . . 0.0 109.469 176.284 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 897' ' ' LEU . . . . . 0.463 HD12 HG21 ' A' ' 872' ' ' VAL . 0.0 OUTLIER -139.06 123.88 11.63 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 114.801 -1.09 . . . . 0.0 109.283 -176.665 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 898' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 897' ' ' LEU . 35.5 Cg_exo -59.28 121.41 9.86 Favored 'Trans proline' 0 C--O 1.238 0.494 0 C-N-CA 122.888 2.392 . . . . 0.0 112.305 -177.69 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 899' ' ' VAL . . . . . 0.558 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 26.5 t -98.36 108.68 22.45 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 CA-C-O 121.257 0.551 . . . . 0.0 110.639 -179.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 900' ' ' ILE . . . . . 0.421 HG23 ' HB2' ' A' ' 921' ' ' SER . 2.5 mt -84.41 92.42 3.11 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 175.445 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 901' ' ' GLY . . . . . 0.711 ' HA3' ' SD ' ' A' ' 919' ' ' MET . . . -83.4 122.41 5.77 Favored Glycine 0 N--CA 1.441 -1.026 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.075 -176.093 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 902' ' ' VAL . . . . . 0.682 ' HB ' ' HB2' ' A' ' 923' ' ' LEU . 0.2 OUTLIER -111.57 117.09 54.28 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 178.459 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 903' ' ' THR . . . . . 0.651 ' HB ' ' HB2' ' A' ' 906' ' ' ALA . 0.0 OUTLIER -107.64 148.88 28.77 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.917 -172.271 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 904' ' ' ALA . . . . . 0.66 ' HB2' ' HG3' ' A' ' 925' ' ' LYS . . . -90.51 134.51 34.31 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.494 175.538 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 53.69 43.26 31.34 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.298 179.627 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 906' ' ' ALA . . . . . 0.651 ' HB2' ' HB ' ' A' ' 903' ' ' THR . . . -92.25 93.76 8.82 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.059 177.245 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -52.33 -49.11 64.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.254 -178.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -127.06 88.56 2.83 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.103 176.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 909' ' ' GLU . . . . . 0.7 ' HB3' ' HB2' ' A' ' 922' ' ' CYS . 10.7 mt-10 -57.85 -34.97 70.28 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.179 -176.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 910' ' ' GLU . . . . . 0.529 ' H ' ' HG3' ' A' ' 910' ' ' GLU . 0.0 OUTLIER -58.78 -57.03 14.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.998 178.638 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 8.0 tttt -65.52 -27.93 68.82 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.197 179.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -62.91 -44.96 94.67 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 176.022 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 913' ' ' ARG . . . . . 0.508 ' O ' ' HD2' ' A' ' 913' ' ' ARG . 0.0 OUTLIER -65.63 -37.9 87.86 Favored 'General case' 0 C--O 1.225 -0.201 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.053 175.999 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 19.0 m -58.66 -37.16 75.39 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.871 0.367 . . . . 0.0 110.937 177.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.84 -51.23 42.69 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.755 -178.206 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 916' ' ' GLU . . . . . 0.446 ' OE2' ' HD3' ' A' ' 913' ' ' ARG . 0.0 OUTLIER -77.11 -42.64 37.18 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 111.627 0.232 . . . . 0.0 111.627 -175.219 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 1.4 m 53.06 52.15 14.35 Favored 'General case' 0 C--O 1.235 0.32 0 O-C-N 123.464 0.478 . . . . 0.0 112.149 -178.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -139.66 -32.8 0.17 Allowed Glycine 0 CA--C 1.523 0.578 0 C-N-CA 120.51 -0.853 . . . . 0.0 113.745 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 919' ' ' MET . . . . . 0.711 ' SD ' ' HA3' ' A' ' 901' ' ' GLY . 20.2 mtt -76.58 -93.54 0.03 OUTLIER 'General case' 0 C--O 1.238 0.488 0 CA-C-N 117.311 0.556 . . . . 0.0 112.171 -174.311 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 920' ' ' ASP . . . . . 0.52 ' HB2' ' O ' ' A' ' 919' ' ' MET . 45.0 t0 162.29 -73.16 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.191 0.996 . . . . 0.0 109.643 176.705 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . 0.421 ' HB2' HG23 ' A' ' 900' ' ' ILE . 0.0 OUTLIER -105.91 172.02 7.03 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.054 -179.765 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 922' ' ' CYS . . . . . 0.7 ' HB2' ' HB3' ' A' ' 909' ' ' GLU . 0.8 OUTLIER -140.42 136.78 33.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.292 0.568 . . . . 0.0 111.881 -178.278 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 923' ' ' LEU . . . . . 0.682 ' HB2' ' HB ' ' A' ' 902' ' ' VAL . 0.3 OUTLIER -133.73 178.21 7.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.192 177.158 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -104.18 143.1 33.39 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.268 178.594 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 925' ' ' LYS . . . . . 0.673 ' HG2' ' OD1' ' A' ' 875' ' ' ASP . 0.0 OUTLIER -48.63 -43.5 63.11 Favored Pre-proline 0 N--CA 1.475 0.823 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -176.034 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 926' ' ' PRO . . . . . 0.514 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 37.7 Cg_endo -66.71 68.44 0.51 Allowed 'Trans proline' 0 C--N 1.356 0.929 0 C-N-CA 121.885 1.723 . . . . 0.0 112.998 175.441 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 927' ' ' VAL . . . . . 0.704 HG13 ' HB ' ' A' ' 931' ' ' VAL . 42.3 t -87.8 110.67 21.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.038 0.447 . . . . 0.0 110.425 177.225 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.36 167.49 20.16 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.29 176.074 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 929' ' ' LEU . . . . . 0.438 ' HA ' HG23 ' A' ' 932' ' ' ILE . 0.7 OUTLIER -54.62 -38.66 67.09 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.69 0.281 . . . . 0.0 111.604 -177.975 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -68.72 -23.35 64.34 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.854 0.359 . . . . 0.0 110.747 -177.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 931' ' ' VAL . . . . . 0.704 ' HB ' HG13 ' A' ' 927' ' ' VAL . 18.4 t -78.13 -41.57 26.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.418 179.062 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 932' ' ' ILE . . . . . 0.438 HG23 ' HA ' ' A' ' 929' ' ' LEU . 0.0 OUTLIER -66.64 -37.16 78.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 177.277 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -60.7 -49.05 79.08 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.439 -179.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 934' ' ' GLN . . . . . 0.453 ' HG3' ' H ' ' A' ' 935' ' ' THR . 0.3 OUTLIER -71.74 -48.96 43.45 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -175.941 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 935' ' ' THR . . . . . 0.453 ' H ' ' HG3' ' A' ' 934' ' ' GLN . 1.6 m -66.73 -43.4 84.32 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 111.828 0.307 . . . . 0.0 111.828 -174.363 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 936' ' ' LEU . . . . . 0.698 HD12 HD11 ' A' ' 873' ' ' LEU . 0.3 OUTLIER -66.23 -49.92 65.6 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.636 0.255 . . . . 0.0 110.812 -179.577 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 95.0 m -62.2 -46.06 90.61 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.25 -178.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 938' ' ' LEU . . . . . 0.466 ' O ' ' HB3' ' A' ' 942' ' ' ARG . 29.3 tp -62.82 -47.77 81.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.182 -178.46 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -69.26 -40.73 77.67 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.613 -0.267 . . . . 0.0 111.171 -177.097 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -66.36 -40.98 90.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.737 0.303 . . . . 0.0 111.006 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 941' ' ' GLU . . . . . 0.584 ' O ' ' HG3' ' A' ' 944' ' ' ARG . 0.0 OUTLIER -69.99 -33.8 72.51 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.87 0.366 . . . . 0.0 110.216 178.473 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 942' ' ' ARG . . . . . 0.466 ' HB3' ' O ' ' A' ' 938' ' ' LEU . 0.0 OUTLIER -66.84 -37.7 84.98 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.446 -178.511 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 943' ' ' VAL . . . . . 0.461 ' N ' ' HG3' ' A' ' 942' ' ' ARG . 17.1 m -78.08 -33.8 18.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.646 -0.422 . . . . 0.0 110.954 -177.496 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 944' ' ' ARG . . . . . 0.584 ' HG3' ' O ' ' A' ' 941' ' ' GLU . 0.2 OUTLIER -73.56 -21.63 60.3 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.32 177.42 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 16.0 mmtp -67.32 -52.4 40.79 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-O 121.33 0.586 . . . . 0.0 109.885 171.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 50.3 m -63.5 -44.32 94.67 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.123 -0.944 . . . . 0.0 111.428 -177.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -68.38 -60.94 2.07 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.77 -0.196 . . . . 0.0 110.51 178.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 6.7 t70 72.55 -34.13 0.29 Allowed 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.724 0.81 . . . . 0.0 112.79 175.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 14.6 m . . . . . 0 C--O 1.246 0.915 0 CA-C-O 118.869 -0.586 . . . . 0.0 109.892 -179.601 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 2.9 tpt . . . . . 0 N--CA 1.478 0.926 0 CA-C-O 120.9 0.381 . . . . 0.0 110.501 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 146.47 169.06 13.98 Favored Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.938 -0.648 . . . . 0.0 111.87 -179.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . -81.11 62.3 4.47 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.517 -178.391 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -94.32 141.8 28.15 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.255 -0.276 . . . . 0.0 110.255 179.594 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . -159.07 -77.05 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.943 -179.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . 0.605 ' HB ' ' HB3' ' A' ' 802' ' ' GLU . 6.7 t 58.41 72.35 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 CA-C-O 121.517 0.675 . . . . 0.0 110.341 -178.768 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -75.35 70.87 2.29 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.557 -0.747 . . . . 0.0 112.43 -174.462 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 703' ' ' GLY . . . . . 0.425 ' HA3' ' HG2' ' A' ' 804' ' ' GLU . . . -85.06 -52.41 3.45 Favored Glycine 0 N--CA 1.449 -0.438 0 N-CA-C 110.527 -1.029 . . . . 0.0 110.527 171.24 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.909 ' HA ' ' HB ' ' A' ' 801' ' ' ILE . 1.8 mt 63.41 62.13 0.99 Allowed 'General case' 0 C--N 1.332 -0.172 0 C-N-CA 123.21 0.604 . . . . 0.0 112.456 173.391 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 705' ' ' SER . . . . . 0.474 ' HA ' ' C ' ' A' ' 730' ' ' GLY . 0.8 OUTLIER -127.47 145.89 50.68 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.012 175.397 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 108.51 -36.13 4.54 Favored Glycine 0 CA--C 1.52 0.355 0 C-N-CA 120.384 -0.912 . . . . 0.0 114.037 171.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 707' ' ' LYS . . . . . 0.403 ' NZ ' ' HB3' ' A' ' 744' ' ' GLU . 7.2 mmmt -75.4 155.61 36.23 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 117.011 0.406 . . . . 0.0 111.624 -174.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 708' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -97.63 149.32 22.38 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.875 178.585 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -134.88 131.7 37.65 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 177.454 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 710' ' ' TRP . . . . . 0.471 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 70.4 m95 -105.06 124.72 50.01 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.901 0.382 . . . . 0.0 110.679 -177.715 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 711' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -120.51 138.97 53.55 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.198 0.523 . . . . 0.0 111.046 -179.257 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -124.6 67.39 1.09 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.125 176.002 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 713' ' ' VAL . . . . . 0.754 HG13 ' HB3' ' A' ' 750' ' ' ASP . 41.4 t -122.39 122.44 66.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.277 -177.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 714' ' ' ARG . . . . . 0.48 ' HB2' HH11 ' A' ' 714' ' ' ARG . 0.1 OUTLIER -86.74 -25.29 24.79 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 176.271 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -67.63 104.53 1.63 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.274 178.271 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 716' ' ' ALA . . . . . 0.652 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -60.45 -43.25 97.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.065 -0.516 . . . . 0.0 112.0 -173.071 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.02 -39.64 95.36 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.193 0.521 . . . . 0.0 110.524 179.538 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 718' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.04 -49.57 27.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.155 -178.032 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 719' ' ' CYS . . . . . 0.739 ' HB3' ' HB ' ' A' ' 713' ' ' VAL . 28.4 p -64.79 -40.59 95.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.556 -177.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 720' ' ' GLN . . . . . 0.554 ' HB2' ' O ' ' A' ' 716' ' ' ALA . 0.0 OUTLIER -63.23 -40.39 97.31 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.382 -179.543 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -57.68 -48.76 78.63 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.958 0.409 . . . . 0.0 110.47 178.842 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 722' ' ' LEU . . . . . 0.469 ' O ' ' HG ' ' A' ' 726' ' ' LEU . 6.4 mt -67.66 -48.19 67.34 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.58 -178.342 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 723' ' ' GLU . . . . . 0.885 ' HA ' HG11 ' A' ' 733' ' ' VAL . 0.0 OUTLIER -62.57 -43.97 97.5 Favored 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 111.579 0.214 . . . . 0.0 111.579 -174.126 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 724' ' ' THR . . . . . 0.512 ' O ' ' HB3' ' A' ' 728' ' ' ARG . 28.1 m -64.83 -39.26 93.29 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.715 0.293 . . . . 0.0 110.811 -179.613 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 44.0 m -65.38 -32.57 74.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.783 0.325 . . . . 0.0 111.388 179.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 726' ' ' LEU . . . . . 0.675 HD22 HD12 ' A' ' 731' ' ' ILE . 24.9 mt -81.95 -47.9 12.14 Favored 'General case' 0 C--N 1.322 -0.626 0 O-C-N 122.208 -0.307 . . . . 0.0 110.921 -178.418 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 727' ' ' GLN . . . . . 0.456 ' HG2' ' HA ' ' A' ' 724' ' ' THR . 3.1 pt20 -67.92 -25.08 65.3 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.527 -177.283 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 728' ' ' ARG . . . . . 0.512 ' HB3' ' O ' ' A' ' 724' ' ' THR . 0.0 OUTLIER -64.03 -31.37 72.54 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 121.114 0.483 . . . . 0.0 110.304 178.303 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -85.67 -51.01 6.75 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.378 179.047 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 730' ' ' GLY . . . . . 0.474 ' C ' ' HA ' ' A' ' 705' ' ' SER . . . 154.32 -6.29 0.33 Allowed Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.508 -0.853 . . . . 0.0 112.689 178.448 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 731' ' ' ILE . . . . . 0.675 HD12 HD22 ' A' ' 726' ' ' LEU . 0.2 OUTLIER -75.3 114.08 14.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 176.604 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 732' ' ' VAL . . . . . . . . . . . . . 2.1 p -74.58 113.96 13.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 121.719 0.771 . . . . 0.0 110.78 -176.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 733' ' ' VAL . . . . . 0.885 HG11 ' HA ' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -85.94 136.88 21.92 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.861 -179.21 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -145.36 137.7 25.79 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.483 177.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -61.47 124.86 21.81 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 173.81 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 736' ' ' TYR . . . . . 0.471 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 47.2 t80 -55.71 -47.05 77.49 Favored 'General case' 0 C--O 1.232 0.17 0 O-C-N 123.242 0.339 . . . . 0.0 110.278 -179.259 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 54.61 -108.78 0.45 Allowed 'General case' 0 CA--C 1.53 0.183 0 O-C-N 123.728 0.643 . . . . 0.0 110.431 177.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -129.62 37.67 2.13 Favored Glycine 0 N--CA 1.445 -0.743 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 176.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -84.19 -172.48 4.18 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.002 0.43 . . . . 0.0 111.31 -177.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.61 126.89 54.59 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.977 -178.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 741' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -71.61 123.46 9.46 Favored 'Trans proline' 0 N--CA 1.462 -0.345 0 C-N-CA 122.612 2.208 . . . . 0.0 111.876 175.14 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 742' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.47 134.93 19.49 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-O 120.699 0.285 . . . . 0.0 111.066 179.691 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 743' ' ' PRO . . . . . 0.514 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 57.3 Cg_endo -71.15 3.72 3.27 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 123.102 2.535 . . . . 0.0 112.464 179.419 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 744' ' ' GLU . . . . . 0.403 ' HB3' ' NZ ' ' A' ' 707' ' ' LYS . 2.2 mm-40 -109.95 -12.29 14.57 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.714 178.792 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 85.2 m-20 -114.47 165.44 12.74 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.722 -172.106 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 746' ' ' VAL . . . . . 0.617 HG21 HD21 ' A' ' 795' ' ' LEU . 18.8 m -117.1 148.43 19.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.965 -175.334 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 747' ' ' LEU . . . . . 0.515 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 0.3 OUTLIER -104.72 113.27 26.75 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.91 175.764 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 3.7 mt -97.45 113.53 32.16 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 175.19 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -114.77 164.74 13.65 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.576 -170.089 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 750' ' ' ASP . . . . . 0.754 ' HB3' HG13 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -125.62 123.35 38.81 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 168.548 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 751' ' ' GLU . . . . . 0.877 ' HG2' HH21 ' A' ' 767' ' ' ARG . 0.0 OUTLIER 61.95 176.84 0.13 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.681 -172.8 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 752' ' ' VAL . . . . . 0.527 HG23 ' HB ' ' A' ' 772' ' ' ILE . 2.6 p -69.86 131.76 33.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.402 -176.182 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 4.4 p -120.41 164.69 16.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.161 179.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.2 50.29 1.91 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.879 0.371 . . . . 0.0 111.023 -179.531 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -152.71 132.17 12.95 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.149 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 6.2 tptp -89.97 -18.76 25.44 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.886 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 757' ' ' TRP . . . . . 0.515 ' CD2' ' HB2' ' A' ' 747' ' ' LEU . 73.7 t-105 67.37 96.98 0.06 Allowed 'General case' 0 C--O 1.234 0.248 0 C-N-CA 123.237 0.615 . . . . 0.0 111.928 176.558 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 32.3 tp60 -86.84 58.15 4.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.445 0.641 . . . . 0.0 109.789 173.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 759' ' ' GLY . . . . . 0.514 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -119.25 -147.29 8.06 Favored Glycine 0 N--CA 1.443 -0.834 0 CA-C-N 115.696 -0.684 . . . . 0.0 112.016 -179.075 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 5.3 ttm180 -77.01 -59.74 2.65 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.204 0.526 . . . . 0.0 109.922 177.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -152.88 155.12 36.44 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.0 -179.154 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 2.7 p -128.07 128.53 68.94 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 177.046 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 763' ' ' VAL . . . . . 0.551 HG13 ' HB2' ' A' ' 781' ' ' TRP . 0.1 OUTLIER -118.09 102.94 13.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.48 -178.945 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 764' ' ' THR . . . . . 0.481 ' HB ' HG23 ' A' ' 782' ' ' VAL . 91.0 m -100.66 124.45 46.27 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.798 -0.637 . . . . 0.0 112.022 -174.693 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 765' ' ' PHE . . . . . 0.562 ' HA ' ' O ' ' A' ' 783' ' ' HIS . 34.5 m-85 -79.79 78.49 6.37 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.539 173.345 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 766' ' ' CYS . . . . . 0.472 ' SG ' HG21 ' A' ' 772' ' ' ILE . 0.0 OUTLIER -106.93 133.24 51.88 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.327 -172.195 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 767' ' ' ARG . . . . . 0.877 HH21 ' HG2' ' A' ' 751' ' ' GLU . 0.0 OUTLIER -111.0 -24.62 10.25 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 174.06 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -103.41 -71.33 0.73 Allowed 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.084 175.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . 0.59 ' HB2' HG22 ' A' ' 772' ' ' ILE . 0.0 OUTLIER 66.6 129.0 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 122.112 0.958 . . . . 0.0 112.377 179.735 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 770' ' ' ILE . . . . . 0.445 HD12 HG11 ' A' ' 752' ' ' VAL . 6.4 mt -128.66 -79.96 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.021 -0.991 . . . . 0.0 109.681 176.05 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -82.69 -21.2 60.19 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.932 -0.651 . . . . 0.0 111.846 177.327 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 772' ' ' ILE . . . . . 0.59 HG22 ' HB2' ' A' ' 769' ' ' HIS . 0.3 OUTLIER -67.45 141.91 95.99 Favored Pre-proline 0 C--O 1.237 0.405 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 176.395 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 773' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -91.05 -143.41 0.02 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.098 0 C-N-CA 123.156 2.57 . . . . 0.0 113.22 -174.04 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . 0.547 ' HA ' ' HB ' ' A' ' 782' ' ' VAL . 0.4 OUTLIER -176.24 -172.26 0.47 Allowed 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 -177.729 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 775' ' ' GLU . . . . . 0.552 ' HA ' ' O ' ' A' ' 780' ' ' GLU . 0.6 OUTLIER -65.81 52.73 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 113.021 0.748 . . . . 0.0 113.021 175.745 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.3 -21.55 23.11 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 169.624 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 777' ' ' ALA . . . . . 0.449 ' HB1' ' HD2' ' A' ' 778' ' ' PRO . . . -133.03 157.68 77.75 Favored Pre-proline 0 N--CA 1.449 -0.482 0 CA-C-N 114.382 -1.281 . . . . 0.0 108.443 174.82 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 778' ' ' PRO . . . . . 0.449 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 49.3 Cg_endo -68.58 -4.3 12.81 Favored 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 122.552 2.168 . . . . 0.0 114.089 -173.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . -112.58 -4.0 25.16 Favored Glycine 0 N--CA 1.453 -0.167 0 C-N-CA 120.575 -0.821 . . . . 0.0 112.358 -176.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 780' ' ' GLU . . . . . 0.552 ' O ' ' HA ' ' A' ' 775' ' ' GLU . 6.7 mt-10 -118.86 125.45 49.55 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 -179.167 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 781' ' ' TRP . . . . . 0.551 ' HB2' HG13 ' A' ' 763' ' ' VAL . 15.2 m95 -130.25 147.16 51.94 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 -177.717 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . 0.547 ' HB ' ' HA ' ' A' ' 774' ' ' LEU . 0.4 OUTLIER -142.69 145.94 22.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-O 120.848 0.356 . . . . 0.0 110.5 179.46 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 783' ' ' HIS . . . . . 0.562 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 2.1 t-160 -157.5 135.96 11.24 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.975 178.278 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -98.21 100.85 12.18 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.404 175.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 785' ' ' VAL . . . . . 0.488 ' HB ' ' HD3' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -163.21 -172.9 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 179.937 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -117.66 39.28 3.37 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.639 177.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 787' ' ' ALA . . . . . 0.424 ' N ' ' HD3' ' A' ' 788' ' ' PRO . . . 57.87 61.94 5.46 Favored Pre-proline 0 N--CA 1.463 0.213 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.632 -179.186 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 788' ' ' PRO . . . . . 0.488 ' HD3' ' HB ' ' A' ' 785' ' ' VAL . 19.3 Cg_exo -66.93 -65.51 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.433 2.089 . . . . 0.0 111.979 -177.448 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -171.63 -16.61 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 178.17 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 790' ' ' GLU . . . . . . . . . . . . . 6.3 pm0 -76.15 -35.46 59.19 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 121.006 -0.278 . . . . 0.0 111.407 -173.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 791' ' ' LEU . . . . . 0.52 HD22 ' CE2' ' A' ' 765' ' ' PHE . 0.2 OUTLIER -73.31 -50.18 6.47 Favored Pre-proline 0 CA--C 1.533 0.308 0 CA-C-O 119.489 -0.291 . . . . 0.0 111.77 -179.128 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 792' ' ' PRO . . . . . 0.477 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 11.0 Cg_endo -57.37 -32.87 95.12 Favored 'Trans proline' 0 C--N 1.357 1.024 0 C-N-CA 121.7 1.6 . . . . 0.0 112.212 175.216 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -70.93 -44.27 66.5 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.952 0.406 . . . . 0.0 110.678 177.198 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -61.9 -40.47 95.56 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.506 178.452 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 795' ' ' LEU . . . . . 0.617 HD21 HG21 ' A' ' 746' ' ' VAL . 0.0 OUTLIER -65.13 -34.7 79.01 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.119 -179.453 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -61.4 -41.73 97.6 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.255 0.55 . . . . 0.0 110.021 176.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 797' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 797' ' ' ARG . 2.7 ttt-85 -71.28 -32.37 68.59 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.734 178.614 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 2.8 mt -66.22 -45.75 89.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.826 179.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -75.17 -43.55 51.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.149 -176.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 4.9 mt 50.47 61.82 3.01 Favored 'General case' 0 C--O 1.236 0.366 0 O-C-N 123.644 0.59 . . . . 0.0 111.534 179.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 801' ' ' ILE . . . . . 0.909 ' HB ' ' HA ' ' A' ' 704' ' ' LEU . 1.6 mt -96.32 108.08 20.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.907 177.726 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 802' ' ' GLU . . . . . 0.605 ' HB3' ' HB ' ' A' ' 701' ' ' VAL . 0.2 OUTLIER -85.86 -10.78 54.8 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.972 -178.183 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 803' ' ' MET . . . . . . . . . . . . . 27.4 ttp -72.71 116.23 12.94 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.948 -1.024 . . . . 0.0 109.403 175.302 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 804' ' ' GLU . . . . . 0.425 ' HG2' ' HA3' ' A' ' 703' ' ' GLY . 12.4 mt-10 -100.48 163.54 12.32 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.522 -177.285 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -95.36 -179.93 4.95 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.159 0.504 . . . . 0.0 111.497 -177.798 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -106.4 143.96 33.77 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 169.779 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 807' ' ' ASP . . . . . 0.424 ' HA ' ' HD3' ' A' ' 808' ' ' PRO . 31.5 t70 -105.45 109.44 63.2 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-O 120.992 0.425 . . . . 0.0 111.514 -175.14 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 808' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 807' ' ' ASP . 2.8 Cg_exo -77.46 120.7 5.33 Favored 'Trans proline' 0 C--O 1.235 0.348 0 C-N-CA 123.258 2.639 . . . . 0.0 112.001 176.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -104.4 149.65 25.22 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.47 179.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -162.15 133.25 5.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.653 0.263 . . . . 0.0 110.781 -178.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -142.58 151.96 42.07 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.964 177.475 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -143.0 97.42 5.78 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 120.761 0.315 . . . . 0.0 111.513 -176.662 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -90.0 115.0 0.56 Allowed 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 122.866 2.378 . . . . 0.0 111.851 174.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -133.68 137.09 45.14 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.189 -176.823 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -134.03 162.51 31.88 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.046 -179.097 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -131.5 156.71 45.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.751 0.31 . . . . 0.0 110.709 179.066 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -135.49 145.88 47.58 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.613 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -129.17 145.85 51.22 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.946 -179.292 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 4.0 p -155.09 136.87 5.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.151 -179.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -141.09 155.45 46.13 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.764 0.316 . . . . 0.0 110.416 177.752 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -149.18 -176.15 5.25 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.279 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -154.49 -89.73 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.543 -0.298 . . . . 0.0 110.664 -178.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 14.6 t70 54.87 77.31 0.21 Allowed 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.394 0.616 . . . . 0.0 110.293 -176.011 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -147.43 82.18 1.53 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.884 -178.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -107.6 135.34 49.22 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.404 175.292 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 826' ' ' MET . . . . . 0.653 ' HG3' ' HA ' ' A' ' 869' ' ' ILE . 0.4 OUTLIER -115.76 124.11 49.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.277 0.56 . . . . 0.0 111.587 -173.684 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 827' ' ' ILE . . . . . 0.4 HG23 ' HB ' ' A' ' 871' ' ' ILE . 3.1 mm -117.34 138.77 46.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.086 178.516 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 828' ' ' LEU . . . . . 0.661 ' HB2' HG21 ' A' ' 869' ' ' ILE . 0.5 OUTLIER -105.21 122.39 45.82 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.727 0.299 . . . . 0.0 110.728 179.309 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -104.31 100.82 11.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.993 176.19 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 830' ' ' VAL . . . . . 0.432 HG22 HD22 ' A' ' 828' ' ' LEU . 5.1 t -109.04 112.2 39.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.304 -179.38 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 831' ' ' ASP . . . . . 0.748 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 11.5 t0 -121.58 142.94 49.61 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 178.778 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -78.75 -21.01 48.6 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.699 -178.765 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 15.7 m80 -114.31 109.85 48.49 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.132 177.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -51.13 -38.57 60.69 Favored 'Trans proline' 0 CA--C 1.531 0.368 0 C-N-CA 123.766 2.978 . . . . 0.0 114.668 -173.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -64.19 -38.99 83.92 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-O 121.223 0.535 . . . . 0.0 110.678 -179.275 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 836' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -73.57 -37.83 65.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.613 178.41 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 837' ' ' ARG . . . . . 0.748 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 16.2 ttp180 -55.83 -44.34 77.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.448 176.579 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 7.1 ttm180 -59.18 -41.78 89.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.789 178.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 1.7 tp -58.88 -52.6 65.02 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.744 -179.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 840' ' ' LEU . . . . . 0.489 HD11 ' HA ' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -72.99 -30.44 63.8 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 120.79 -0.364 . . . . 0.0 111.597 -177.476 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -66.44 -37.55 85.43 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.097 0.475 . . . . 0.0 110.702 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 12.4 t0 -67.9 -41.04 83.33 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.301 178.042 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 843' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -62.74 -50.8 69.63 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.679 178.459 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 844' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.48 -35.78 74.75 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.993 178.038 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -62.97 -35.01 91.49 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.058 177.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 4.2 m -76.64 -26.81 55.3 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.873 0.368 . . . . 0.0 110.521 178.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 847' ' ' LEU . . . . . 0.611 HD21 ' HG2' ' A' ' 933' ' ' LYS . 3.6 mp -63.13 -33.68 75.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.013 177.503 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 97.59 26.91 9.49 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.692 -0.765 . . . . 0.0 112.918 176.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 849' ' ' TYR . . . . . 0.449 ' HE2' HD23 ' A' ' 847' ' ' LEU . 38.9 m-85 -112.09 155.77 23.32 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 176.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -69.08 118.0 11.43 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 178.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -107.3 126.19 52.12 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.16 0.505 . . . . 0.0 111.399 -173.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -111.0 140.44 45.53 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 171.633 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -118.31 144.05 46.14 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 120.559 -0.456 . . . . 0.0 111.643 -174.013 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 854' ' ' ALA . . . . . . . . . . . . . . . -149.21 150.55 32.8 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.157 178.024 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 855' ' ' ASN . . . . . 0.543 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 13.6 t-20 -133.84 74.97 1.57 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.399 175.572 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 856' ' ' ASP . . . . . 0.668 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 4.1 t70 165.53 170.44 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.118 -0.946 . . . . 0.0 108.836 -178.302 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -92.73 -47.29 3.22 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.865 -0.683 . . . . 0.0 111.922 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 858' ' ' VAL . . . . . 0.424 HG22 ' H ' ' A' ' 858' ' ' VAL . 0.0 OUTLIER -71.67 -31.1 40.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.984 0.421 . . . . 0.0 110.661 -178.955 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 859' ' ' ASP . . . . . 0.668 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 0.3 OUTLIER -64.23 -35.4 80.68 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.007 -179.53 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -68.34 -33.64 74.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.181 0.515 . . . . 0.0 110.49 178.65 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 861' ' ' LEU . . . . . 0.595 HD21 ' HG ' ' A' ' 893' ' ' LEU . 15.3 tp -73.59 -32.37 64.07 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.596 179.056 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 -62.82 -47.12 84.8 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.816 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.81 -31.27 50.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 C-N-CA 120.861 -0.336 . . . . 0.0 110.61 177.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 864' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.84 -34.84 75.19 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 120.704 0.288 . . . . 0.0 111.138 179.118 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.89 -33.41 34.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.929 0.395 . . . . 0.0 110.482 179.426 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.14 -46.15 78.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.525 179.613 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -144.39 129.33 18.45 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 176.855 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 10.0 t-80 -70.7 88.36 0.71 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.8 0.333 . . . . 0.0 111.291 -177.335 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 869' ' ' ILE . . . . . 0.661 HG21 ' HB2' ' A' ' 828' ' ' LEU . 1.4 mp -65.43 139.91 20.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.524 174.101 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 35.6 m-20 -73.91 -60.34 2.3 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.066 -172.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 871' ' ' ILE . . . . . 0.533 HD12 ' HB3' ' A' ' 939' ' ' TYR . 8.0 mm -117.43 128.61 74.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.223 -178.482 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 872' ' ' VAL . . . . . 0.401 HG22 ' HB2' ' A' ' 828' ' ' LEU . 48.1 t -115.33 125.72 72.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.34 179.324 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 873' ' ' LEU . . . . . 0.665 HD22 HD12 ' A' ' 900' ' ' ILE . 0.1 OUTLIER -109.13 121.73 45.77 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 178.956 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -106.78 96.49 6.48 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.033 178.202 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 875' ' ' ASP . . . . . 0.581 ' HA ' HG13 ' A' ' 902' ' ' VAL . 22.1 t0 -97.89 110.29 22.89 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.719 179.388 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -121.89 132.1 71.64 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.41 -173.591 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -99.52 12.2 37.09 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.773 0.797 . . . . 0.0 108.879 171.421 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 878' ' ' MET . . . . . 0.5 ' HA ' ' HD3' ' A' ' 879' ' ' PRO . 6.0 ttm -68.51 137.68 91.0 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 114.68 -1.146 . . . . 0.0 110.27 179.228 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 879' ' ' PRO . . . . . 0.5 ' HD3' ' HA ' ' A' ' 878' ' ' MET . 10.2 Cg_exo -73.07 -140.35 0.02 OUTLIER 'Trans proline' 0 CA--C 1.534 0.525 0 C-N-CA 122.85 2.367 . . . . 0.0 112.822 178.405 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -85.17 159.01 20.22 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.521 -173.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 3.3 tpt 83.98 -54.58 0.13 Allowed 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.229 1.011 . . . . 0.0 112.702 170.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 14.6 t0 -87.73 137.24 32.51 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.877 0.37 . . . . 0.0 110.952 -175.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . 122.44 -7.78 9.67 Favored Glycine 0 N--CA 1.447 -0.603 0 N-CA-C 111.368 -0.693 . . . . 0.0 111.368 -176.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -84.43 -32.43 24.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.519 0.676 . . . . 0.0 109.425 -178.246 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.55 -32.77 63.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.796 178.019 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 4.1 tp -67.06 -51.52 53.56 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.753 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -45.26 92.79 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.213 -178.557 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 888' ' ' GLN . . . . . 0.558 ' HA ' ' HD3' ' A' ' 891' ' ' ARG . 7.7 tp-100 -56.98 -42.6 80.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.164 0.506 . . . . 0.0 110.737 178.609 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.97 -38.65 66.62 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.077 -178.613 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 890' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -69.98 -37.13 71.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.726 0.298 . . . . 0.0 111.203 -176.682 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 891' ' ' ARG . . . . . 0.558 ' HD3' ' HA ' ' A' ' 888' ' ' GLN . 1.9 ptm180 -74.15 -28.7 61.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.824 0.345 . . . . 0.0 110.613 178.005 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -78.07 -27.99 48.74 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.075 0.464 . . . . 0.0 110.752 178.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 893' ' ' LEU . . . . . 0.595 ' HG ' HD21 ' A' ' 861' ' ' LEU . 1.8 mm? -80.59 -11.34 59.66 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.239 179.448 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 86.28 56.93 2.19 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.294 178.271 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 895' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 895' ' ' LEU . 0.2 OUTLIER -57.72 135.16 56.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.111 0.481 . . . . 0.0 110.577 178.471 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -141.01 49.47 1.66 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.305 0.574 . . . . 0.0 110.637 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 897' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -157.79 151.73 19.74 Favored Pre-proline 0 C--N 1.32 -0.698 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.704 -177.274 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_exo -73.18 112.93 3.64 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 122.454 2.103 . . . . 0.0 111.496 177.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 899' ' ' VAL . . . . . 0.791 HG13 ' HA ' ' A' ' 919' ' ' MET . 0.2 OUTLIER -115.41 130.79 69.4 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 CA-C-O 121.5 0.667 . . . . 0.0 110.126 176.746 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 900' ' ' ILE . . . . . 0.665 HD12 HD22 ' A' ' 873' ' ' LEU . 21.2 mt -96.34 117.0 39.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.719 -176.145 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 901' ' ' GLY . . . . . 0.554 ' HA3' ' HD3' ' A' ' 913' ' ' ARG . . . -92.7 105.82 3.34 Favored Glycine 0 N--CA 1.444 -0.811 0 C-N-CA 120.621 -0.799 . . . . 0.0 111.989 177.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 902' ' ' VAL . . . . . 0.836 ' HB ' HD12 ' A' ' 923' ' ' LEU . 0.1 OUTLIER -113.83 126.18 71.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 177.49 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 903' ' ' THR . . . . . 0.442 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.4 OUTLIER -143.87 165.23 28.3 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.679 -0.237 . . . . 0.0 110.398 -175.026 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 904' ' ' ALA . . . . . 0.417 ' HB2' ' CB ' ' A' ' 925' ' ' LYS . . . -119.44 103.12 9.17 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.968 0.414 . . . . 0.0 111.722 -178.464 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 52.22 56.23 8.03 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.064 -0.971 . . . . 0.0 112.856 171.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 906' ' ' ALA . . . . . 0.76 ' HB3' ' HB3' ' A' ' 909' ' ' GLU . . . -95.75 46.91 1.1 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.073 0.463 . . . . 0.0 110.123 174.676 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 907' ' ' LEU . . . . . 0.492 ' HB3' ' H ' ' A' ' 908' ' ' ALA . 0.1 OUTLIER 64.94 -108.71 0.18 Allowed 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.115 -178.998 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 908' ' ' ALA . . . . . 0.492 ' H ' ' HB3' ' A' ' 907' ' ' LEU . . . -98.53 33.56 2.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.96 0.409 . . . . 0.0 110.682 -177.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 909' ' ' GLU . . . . . 0.76 ' HB3' ' HB3' ' A' ' 906' ' ' ALA . 0.0 OUTLIER -52.1 -47.15 65.39 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.42 -0.809 . . . . 0.0 112.314 -176.625 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 910' ' ' GLU . . . . . 0.68 ' HA ' ' NH1' ' A' ' 913' ' ' ARG . 1.5 pt-20 -64.82 -37.46 87.68 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.978 -176.668 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.39 -42.34 71.84 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.872 0.368 . . . . 0.0 110.269 178.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -61.81 -40.59 95.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.706 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 913' ' ' ARG . . . . . 0.87 ' HD2' ' HB2' ' A' ' 922' ' ' CYS . 3.0 mtm105 -59.81 -45.54 92.03 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.756 178.128 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 80.7 m -64.73 -44.9 88.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.6 178.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.83 -43.51 94.54 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.308 -179.535 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.52 -43.21 81.37 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.569 179.536 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 51.67 33.84 11.67 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.139 -175.687 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -106.08 24.66 25.92 Favored Glycine 0 N--CA 1.447 -0.568 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.715 178.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 919' ' ' MET . . . . . 0.791 ' HA ' HG13 ' A' ' 899' ' ' VAL . 2.1 mtt -132.2 -94.89 0.35 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 110.328 -0.249 . . . . 0.0 110.328 -177.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 920' ' ' ASP . . . . . 0.427 ' H ' ' HB3' ' A' ' 919' ' ' MET . 9.6 t70 166.36 -64.77 0.0 OUTLIER 'General case' 0 CA--C 1.518 -0.279 0 O-C-N 124.205 0.941 . . . . 0.0 109.175 175.433 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . 0.599 ' HB2' HG23 ' A' ' 900' ' ' ILE . 0.0 OUTLIER -115.08 165.81 12.5 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.799 -177.459 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 922' ' ' CYS . . . . . 0.87 ' HB2' ' HD2' ' A' ' 913' ' ' ARG . 0.0 OUTLIER -147.37 135.12 21.11 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.332 -179.683 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 923' ' ' LEU . . . . . 0.836 HD12 ' HB ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -155.98 -175.8 5.62 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 178.37 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 924' ' ' SER . . . . . 0.716 ' HB2' ' HD2' ' A' ' 926' ' ' PRO . 0.0 OUTLIER -106.29 154.68 20.41 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.916 -178.839 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 925' ' ' LYS . . . . . 0.45 ' HB3' ' HD3' ' A' ' 926' ' ' PRO . 8.4 tttp -52.92 -43.33 93.86 Favored Pre-proline 0 N--CA 1.47 0.531 0 N-CA-C 112.762 0.652 . . . . 0.0 112.762 179.4 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 926' ' ' PRO . . . . . 0.716 ' HD2' ' HB2' ' A' ' 924' ' ' SER . 23.2 Cg_exo -66.5 75.33 0.38 Allowed 'Trans proline' 0 C--N 1.357 0.997 0 C-N-CA 121.983 1.788 . . . . 0.0 111.798 172.474 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -107.09 152.98 8.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.188 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 928' ' ' THR . . . . . 0.408 ' O ' HG22 ' A' ' 932' ' ' ILE . 0.0 OUTLIER -95.06 149.56 21.13 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.913 179.854 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 929' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.93 -37.78 69.4 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.652 -179.029 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.92 -27.21 65.55 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.82 -178.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 931' ' ' VAL . . . . . 0.523 ' O ' ' HG2' ' A' ' 934' ' ' GLN . 93.2 t -75.94 -51.34 20.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.863 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 932' ' ' ILE . . . . . 0.408 HG22 ' O ' ' A' ' 928' ' ' THR . 0.0 OUTLIER -58.52 -37.06 62.4 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-O 121.056 0.455 . . . . 0.0 109.826 178.403 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 933' ' ' LYS . . . . . 0.611 ' HG2' HD21 ' A' ' 847' ' ' LEU . 0.0 OUTLIER -65.37 -47.43 76.43 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.288 -179.978 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 934' ' ' GLN . . . . . 0.554 ' O ' ' HB2' ' A' ' 938' ' ' LEU . 10.2 pt20 -63.72 -41.96 98.0 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.406 -177.049 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 1.3 m -69.44 -39.33 77.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.612 0.244 . . . . 0.0 110.732 -179.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 936' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.89 -54.8 29.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.618 179.595 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 74.6 m -60.6 -41.86 95.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.575 -179.076 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 938' ' ' LEU . . . . . 0.554 ' HB2' ' O ' ' A' ' 934' ' ' GLN . 0.1 OUTLIER -68.01 -40.16 83.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.732 0.301 . . . . 0.0 111.416 -178.156 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 939' ' ' TYR . . . . . 0.579 ' HA ' ' HB3' ' A' ' 942' ' ' ARG . 1.6 m-85 -77.19 -27.21 53.5 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.93 -0.308 . . . . 0.0 111.101 -178.087 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -64.28 -43.61 94.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.007 0.432 . . . . 0.0 110.254 174.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 941' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -73.73 -21.99 60.04 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.333 177.575 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 942' ' ' ARG . . . . . 0.579 ' HB3' ' HA ' ' A' ' 939' ' ' TYR . 0.0 OUTLIER -67.57 -47.55 69.46 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.266 177.234 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 943' ' ' VAL . . . . . 0.402 ' N ' ' HG3' ' A' ' 942' ' ' ARG . 10.1 m -74.11 -33.07 34.45 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 CA-C-O 120.946 0.403 . . . . 0.0 110.155 178.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 19.1 ttt85 -58.56 -48.1 82.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.517 176.472 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.03 -19.33 60.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.199 -179.873 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 71.4 m -71.9 -21.95 61.56 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.09 0.472 . . . . 0.0 109.903 175.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.63 -30.21 14.45 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.311 174.489 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -78.78 -46.09 19.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.027 -175.787 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.006 0 CA-C-O 118.289 -0.863 . . . . 0.0 110.448 -176.26 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 4.3 ttp . . . . . 0 N--CA 1.479 1.024 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 110.6 34.09 2.33 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.507 -0.854 . . . . 0.0 111.671 179.119 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . -138.27 129.16 4.45 Favored Glycine 0 N--CA 1.445 -0.758 0 N-CA-C 111.408 -0.677 . . . . 0.0 111.408 178.703 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -142.03 105.89 4.72 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.848 0.356 . . . . 0.0 110.298 -179.61 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . -80.93 68.28 3.44 Favored Glycine 0 N--CA 1.448 -0.516 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.618 -179.203 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -87.67 87.46 2.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 120.872 0.367 . . . . 0.0 110.037 177.469 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -124.08 134.7 53.33 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.635 -179.4 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . 138.1 -54.81 0.69 Allowed Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 121.051 -0.595 . . . . 0.0 112.107 178.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 8.3 mt -125.76 -158.91 0.87 Allowed 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 705' ' ' SER . . . . . 0.55 ' HA ' ' O ' ' A' ' 730' ' ' GLY . 1.5 m 55.25 72.88 0.45 Allowed 'General case' 0 CA--C 1.531 0.234 0 O-C-N 123.722 0.639 . . . . 0.0 111.495 177.746 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 170.49 -23.98 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.345 -0.931 . . . . 0.0 112.597 -178.05 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 1.4 mptt -75.16 135.75 41.08 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 -179.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 708' ' ' ARG . . . . . 0.654 ' HG2' HG23 ' A' ' 732' ' ' VAL . 0.0 OUTLIER -100.24 155.13 17.94 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.054 0.454 . . . . 0.0 111.612 -174.445 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 709' ' ' CYS . . . . . 0.455 ' SG ' HD13 ' A' ' 726' ' ' LEU . 0.0 OUTLIER -136.47 127.17 27.21 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.812 176.698 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 710' ' ' TRP . . . . . 0.652 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 90.2 m95 -107.07 117.45 34.09 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 177.113 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 711' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -120.27 123.02 42.17 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.233 0.54 . . . . 0.0 111.191 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -121.27 68.92 0.9 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.368 176.595 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 713' ' ' VAL . . . . . 0.618 HG11 ' HB3' ' A' ' 718' ' ' LEU . 55.3 t -117.84 127.98 75.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.182 -178.216 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 714' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 714' ' ' ARG . 3.3 mtt85 -73.53 -35.45 65.56 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.942 0.401 . . . . 0.0 110.667 178.757 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 41.2 t-20 -63.36 112.53 2.76 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.375 177.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 716' ' ' ALA . . . . . 0.65 ' O ' ' HB2' ' A' ' 720' ' ' GLN . . . -66.71 -38.1 86.04 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.328 -175.006 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.83 -38.28 83.02 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.935 0.398 . . . . 0.0 110.092 178.662 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 718' ' ' LEU . . . . . 0.646 HD21 ' HD2' ' A' ' 765' ' ' PHE . 0.9 OUTLIER -67.95 -50.22 57.14 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.663 179.908 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 719' ' ' CYS . . . . . 0.581 ' HB3' ' HB ' ' A' ' 713' ' ' VAL . 21.8 p -67.35 -38.46 84.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.65 -177.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 720' ' ' GLN . . . . . 0.702 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -63.96 -39.14 93.46 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.176 177.574 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -57.3 -55.17 38.23 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.704 -179.588 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.87 -48.35 77.04 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.952 -179.42 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 723' ' ' GLU . . . . . 0.8 ' HA ' HG11 ' A' ' 733' ' ' VAL . 2.9 pt-20 -60.39 -43.41 96.68 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.67 -174.154 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 724' ' ' THR . . . . . 0.556 ' N ' ' HG3' ' A' ' 723' ' ' GLU . 14.6 m -71.8 -38.55 70.23 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.841 0.353 . . . . 0.0 111.166 -177.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 725' ' ' SER . . . . . 0.425 ' O ' ' HG2' ' A' ' 728' ' ' ARG . 37.5 m -69.03 -36.42 77.73 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.877 0.37 . . . . 0.0 111.299 -179.083 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 726' ' ' LEU . . . . . 0.48 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 11.1 mt -82.06 -42.86 18.66 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.869 -176.655 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 727' ' ' GLN . . . . . 0.433 ' HA ' ' O ' ' A' ' 731' ' ' ILE . 8.5 pt20 -62.43 -29.76 70.74 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.57 0.224 . . . . 0.0 111.392 -176.387 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 728' ' ' ARG . . . . . 0.425 ' HG2' ' O ' ' A' ' 725' ' ' SER . 11.7 ptt180 -69.51 -17.83 63.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.956 0.408 . . . . 0.0 111.128 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 1.4 m -99.35 -1.82 37.87 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.094 -178.123 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 730' ' ' GLY . . . . . 0.55 ' O ' ' HA ' ' A' ' 705' ' ' SER . . . 100.31 14.68 32.34 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.35 -0.929 . . . . 0.0 112.578 179.237 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 731' ' ' ILE . . . . . 0.48 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 32.0 mm -90.57 129.07 41.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 176.438 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 732' ' ' VAL . . . . . 0.654 HG23 ' HG2' ' A' ' 708' ' ' ARG . 0.2 OUTLIER -85.78 94.33 4.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 121.981 0.896 . . . . 0.0 110.428 -178.784 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 733' ' ' VAL . . . . . 0.8 HG11 ' HA ' ' A' ' 723' ' ' GLU . 0.1 OUTLIER -83.22 122.8 38.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 114.595 -1.184 . . . . 0.0 111.08 -177.398 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.66 147.91 52.39 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.717 -179.66 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 3.9 m -77.46 119.27 20.82 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.032 0.444 . . . . 0.0 110.766 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 736' ' ' TYR . . . . . 0.652 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 86.0 t80 -81.84 114.58 20.55 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.616 -178.551 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -109.33 -42.59 4.33 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.075 177.313 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 176.97 47.76 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.432 0 N-CA-C 111.208 -0.757 . . . . 0.0 111.208 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 13.3 mp0 -91.79 -176.31 4.42 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.528 -0.336 . . . . 0.0 110.863 -174.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 740' ' ' GLU . . . . . 0.504 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 0.0 OUTLIER -97.78 131.77 26.21 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.455 179.897 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 741' ' ' PRO . . . . . 0.677 ' HG2' ' HB2' ' A' ' 758' ' ' GLN . 6.5 Cg_endo -87.25 127.54 2.49 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 123.348 2.699 . . . . 0.0 113.313 -175.519 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 742' ' ' THR . . . . . 0.817 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.2 OUTLIER -90.92 148.59 38.5 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 172.392 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 743' ' ' PRO . . . . . 0.817 ' HD2' HG22 ' A' ' 742' ' ' THR . 23.8 Cg_endo -61.77 5.01 0.23 Allowed 'Trans proline' 0 N--CA 1.48 0.687 0 C-N-CA 123.208 2.605 . . . . 0.0 113.931 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 744' ' ' GLU . . . . . 0.407 ' HA ' ' HB2' ' A' ' 760' ' ' ARG . 2.1 mt-10 -118.03 -2.57 11.23 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.772 0.32 . . . . 0.0 110.424 175.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 745' ' ' ASP . . . . . 0.451 ' HB3' ' HD1' ' A' ' 710' ' ' TRP . 87.1 m-20 -89.38 149.09 23.15 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.746 -176.149 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 746' ' ' VAL . . . . . 0.529 HG11 HD11 ' A' ' 795' ' ' LEU . 2.8 p -120.51 137.25 54.92 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.3 178.458 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 747' ' ' LEU . . . . . 0.414 ' HG ' ' CZ3' ' A' ' 757' ' ' TRP . 0.0 OUTLIER -106.01 100.01 9.57 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.874 0.369 . . . . 0.0 110.903 -179.748 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 12.0 mt -93.78 106.83 18.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 173.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 749' ' ' THR . . . . . 0.654 HG21 ' HB ' ' A' ' 753' ' ' VAL . 6.0 t -128.98 160.38 32.9 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 110.113 -0.328 . . . . 0.0 110.113 -177.275 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 750' ' ' ASP . . . . . 0.584 ' HB3' HG13 ' A' ' 713' ' ' VAL . 1.5 p-10 -105.51 145.86 30.34 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.02 0.438 . . . . 0.0 111.171 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 751' ' ' GLU . . . . . 0.509 ' HA ' ' HA ' ' A' ' 766' ' ' CYS . 22.5 mm-40 63.91 -157.06 0.31 Allowed 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.366 -178.656 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 752' ' ' VAL . . . . . 0.578 HG22 ' H ' ' A' ' 771' ' ' GLY . 62.1 t -75.68 127.16 37.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 120.992 0.425 . . . . 0.0 111.287 -176.295 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 753' ' ' VAL . . . . . 0.654 ' HB ' HG21 ' A' ' 749' ' ' THR . 8.6 p -102.12 142.74 15.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.823 175.437 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -94.37 39.84 1.09 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.906 0.384 . . . . 0.0 111.236 -178.266 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.02 148.24 18.67 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.223 178.684 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 6.4 mmtm -97.2 10.51 39.26 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.826 179.092 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 757' ' ' TRP . . . . . 0.597 ' CH2' ' HB3' ' A' ' 741' ' ' PRO . 4.5 t-105 69.61 153.96 0.11 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.419 -0.81 . . . . 0.0 112.123 177.255 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 758' ' ' GLN . . . . . 0.677 ' HB2' ' HG2' ' A' ' 741' ' ' PRO . 4.9 mp0 -135.22 47.96 2.29 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.797 178.249 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 759' ' ' GLY . . . . . 0.55 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -146.1 -140.86 3.54 Favored Glycine 0 N--CA 1.443 -0.87 0 C-N-CA 120.409 -0.901 . . . . 0.0 113.1 -175.481 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 760' ' ' ARG . . . . . 0.407 ' HB2' ' HA ' ' A' ' 744' ' ' GLU . 0.2 OUTLIER -74.31 -59.97 2.48 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 111.597 0.221 . . . . 0.0 111.597 -178.226 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 761' ' ' ALA . . . . . 0.47 ' O ' ' HA ' ' A' ' 746' ' ' VAL . . . -156.99 157.85 35.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.738 -176.235 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 3.2 p -126.59 131.81 70.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.139 177.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 763' ' ' VAL . . . . . 0.577 HG11 HD11 ' A' ' 791' ' ' LEU . 92.2 t -111.37 96.66 4.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 178.487 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 764' ' ' THR . . . . . 0.763 HG21 HG13 ' A' ' 772' ' ' ILE . 0.2 OUTLIER -86.39 92.67 8.9 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.083 -178.593 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 765' ' ' PHE . . . . . 0.741 ' CZ ' ' HG ' ' A' ' 791' ' ' LEU . 0.2 OUTLIER -84.23 83.63 7.9 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.207 179.085 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 766' ' ' CYS . . . . . 0.54 ' HB2' HG12 ' A' ' 770' ' ' ILE . 0.0 OUTLIER -94.54 132.85 38.8 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 -175.049 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 5.1 mmm-85 -88.86 -56.15 3.41 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.913 -171.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.28 -34.16 2.96 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.271 -176.33 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -108.75 106.59 16.68 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.291 0.567 . . . . 0.0 110.402 -179.425 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 770' ' ' ILE . . . . . 0.54 HG12 ' HB2' ' A' ' 766' ' ' CYS . 24.2 mt -107.26 87.39 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.467 178.377 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 771' ' ' GLY . . . . . 0.578 ' H ' HG22 ' A' ' 752' ' ' VAL . . . -95.28 6.71 68.78 Favored Glycine 0 N--CA 1.454 -0.156 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.693 177.873 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 772' ' ' ILE . . . . . 0.763 HG13 HG21 ' A' ' 764' ' ' THR . 41.9 mm -104.06 141.79 23.26 Favored Pre-proline 0 C--N 1.32 -0.686 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 178.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 773' ' ' PRO . . . . . 0.668 ' O ' ' HB3' ' A' ' 774' ' ' LEU . 50.7 Cg_exo -53.39 -96.83 0.0 OUTLIER 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 123.135 2.557 . . . . 0.0 113.37 178.657 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . 0.698 ' HA ' HG13 ' A' ' 782' ' ' VAL . 0.3 OUTLIER 153.05 -161.85 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.462 1.105 . . . . 0.0 109.477 -177.365 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 775' ' ' GLU . . . . . 0.486 ' HA ' ' O ' ' A' ' 780' ' ' GLU . 0.8 OUTLIER -62.65 54.05 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.911 0.884 . . . . 0.0 113.335 177.266 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . 0.569 ' HD3' ' HB3' ' A' ' 773' ' ' PRO . 0.1 OUTLIER -118.75 0.41 11.44 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 170.122 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 777' ' ' ALA . . . . . 0.419 ' HB3' ' HB2' ' A' ' 780' ' ' GLU . . . -126.93 150.87 72.96 Favored Pre-proline 0 C--N 1.324 -0.526 0 CA-C-N 114.615 -1.175 . . . . 0.0 109.114 176.123 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_endo -62.14 100.32 0.21 Allowed 'Trans proline' 0 CA--C 1.529 0.232 0 C-N-CA 122.617 2.212 . . . . 0.0 112.626 -178.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 96.48 20.11 25.78 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.832 -0.699 . . . . 0.0 113.004 177.475 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 780' ' ' GLU . . . . . 0.486 ' O ' ' HA ' ' A' ' 775' ' ' GLU . 0.1 OUTLIER -109.59 125.06 52.16 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 179.808 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 35.5 m95 -142.66 106.78 4.73 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.853 -0.158 . . . . 0.0 111.152 -175.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . 0.698 HG13 ' HA ' ' A' ' 774' ' ' LEU . 3.6 m -102.19 156.43 4.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 C-N-CA 120.781 -0.367 . . . . 0.0 110.156 175.19 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 783' ' ' HIS . . . . . 0.43 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.1 OUTLIER -176.36 150.16 0.88 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.61 177.415 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 3.1 m -104.96 100.21 9.82 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.935 0.397 . . . . 0.0 110.533 173.586 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 785' ' ' VAL . . . . . 0.415 HG23 ' CE1' ' A' ' 765' ' ' PHE . 0.1 OUTLIER -159.45 164.55 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 178.239 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -103.56 40.36 1.43 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.997 179.094 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 49.39 64.09 9.18 Favored Pre-proline 0 N--CA 1.469 0.487 0 CA-C-N 115.26 -0.882 . . . . 0.0 112.705 177.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 788' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -68.59 -70.37 0.02 OUTLIER 'Trans proline' 0 CA--C 1.533 0.455 0 C-N-CA 122.254 1.969 . . . . 0.0 112.545 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 2.2 p-80 -153.32 -30.82 0.13 Allowed 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -178.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 790' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -71.18 -34.28 70.77 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 111.747 0.277 . . . . 0.0 111.747 -174.258 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 791' ' ' LEU . . . . . 0.741 ' HG ' ' CZ ' ' A' ' 765' ' ' PHE . 0.7 OUTLIER -65.46 -55.62 23.68 Favored Pre-proline 0 C--N 1.327 -0.382 0 C-N-CA 120.986 -0.286 . . . . 0.0 111.272 -178.922 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 792' ' ' PRO . . . . . 0.404 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 11.7 Cg_endo -58.55 -26.71 79.79 Favored 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 121.585 1.523 . . . . 0.0 111.871 175.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -68.09 -45.69 73.07 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.892 176.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 794' ' ' LEU . . . . . 0.506 HD22 ' HA ' ' A' ' 794' ' ' LEU . 0.2 OUTLIER -65.63 -36.89 85.0 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 176.797 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 795' ' ' LEU . . . . . 0.529 HD11 HG11 ' A' ' 746' ' ' VAL . 0.6 OUTLIER -63.04 -44.26 96.36 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.865 179.158 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -63.69 -31.73 72.99 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.148 0.499 . . . . 0.0 110.727 177.053 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.24 -47.18 65.46 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.674 178.69 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 798' ' ' ILE . . . . . 0.437 HG22 ' O ' ' A' ' 795' ' ' LEU . 0.9 OUTLIER -70.1 -16.94 20.58 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.589 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.308 -177.562 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 799' ' ' TYR . . . . . 0.43 ' HD1' ' HA ' ' A' ' 799' ' ' TYR . 2.4 m-30 -78.53 -8.32 58.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.282 175.188 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 34.1 mt 62.17 49.3 4.47 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.532 177.206 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 801' ' ' ILE . . . . . . . . . . . . . 93.6 mt -74.62 -39.49 46.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.236 176.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 50.67 70.01 0.57 Allowed 'General case' 0 C--O 1.234 0.264 0 O-C-N 123.943 0.777 . . . . 0.0 110.892 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 803' ' ' MET . . . . . . . . . . . . . 1.8 ttp -82.42 -37.84 24.92 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.385 -174.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 804' ' ' GLU . . . . . 0.531 ' HG3' ' H ' ' A' ' 804' ' ' GLU . 0.0 OUTLIER -75.44 99.41 4.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.795 0.331 . . . . 0.0 110.862 -177.499 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -97.01 162.75 13.25 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.172 -179.043 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -146.1 91.25 2.05 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.094 177.423 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 807' ' ' ASP . . . . . 0.433 ' HA ' ' HD3' ' A' ' 808' ' ' PRO . 0.7 OUTLIER -60.25 122.21 65.23 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.001 179.346 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 808' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 807' ' ' ASP . 4.7 Cg_exo -77.38 -170.33 0.91 Allowed 'Trans proline' 0 N--CA 1.462 -0.358 0 C-N-CA 123.281 2.654 . . . . 0.0 112.473 -178.269 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -109.73 163.45 13.48 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.915 177.246 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 17.2 t30 -118.69 128.84 54.89 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.156 0.503 . . . . 0.0 111.04 -178.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -141.14 105.77 4.89 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.169 179.206 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 812' ' ' LEU . . . . . 0.457 ' HA ' ' HD3' ' A' ' 813' ' ' PRO . 2.9 tp -88.71 137.56 30.11 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.892 -177.321 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 813' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 812' ' ' LEU . 14.2 Cg_exo -70.07 152.53 67.73 Favored 'Trans proline' 0 N--CA 1.461 -0.428 0 C-N-CA 122.847 2.365 . . . . 0.0 111.96 176.18 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 54.8 m -137.02 138.93 41.0 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 174.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.23 93.97 4.07 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.782 -175.399 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -119.08 120.03 35.95 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.314 -177.039 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 2.0 ttmt -172.57 116.02 0.31 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.952 176.173 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -140.07 146.52 39.05 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.861 0.363 . . . . 0.0 111.516 -178.086 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 2.6 p -175.07 115.5 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.679 -0.692 . . . . 0.0 109.424 176.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 1.2 m -151.09 147.78 27.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.702 0.287 . . . . 0.0 111.513 -175.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 29.1 t70 74.23 137.56 0.06 Allowed 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.07 -0.968 . . . . 0.0 112.716 171.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 822' ' ' ASN . . . . . 0.408 ' O ' ' HB3' ' A' ' 823' ' ' ASP . 21.7 t30 -159.83 -43.05 0.05 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.878 173.555 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 823' ' ' ASP . . . . . 0.408 ' HB3' ' O ' ' A' ' 822' ' ' ASN . 14.4 t0 70.82 111.34 0.06 Allowed 'General case' 0 N--CA 1.467 0.387 0 O-C-N 123.939 0.775 . . . . 0.0 111.061 -179.397 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -112.55 62.49 0.63 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.513 -175.288 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 825' ' ' MET . . . . . 0.524 ' O ' ' HB3' ' A' ' 849' ' ' TYR . 0.5 OUTLIER -92.29 127.76 37.89 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 -178.501 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 826' ' ' MET . . . . . 0.6 ' HG3' ' HA ' ' A' ' 869' ' ' ILE . 5.0 ptp -125.61 131.02 52.76 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.121 0.486 . . . . 0.0 111.383 -176.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 827' ' ' ILE . . . . . . . . . . . . . 10.3 mm -120.71 128.91 76.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.075 176.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 828' ' ' LEU . . . . . 0.7 ' HB3' HD13 ' A' ' 869' ' ' ILE . 0.1 OUTLIER -106.36 134.75 49.01 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.259 0.552 . . . . 0.0 110.768 -178.063 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 829' ' ' VAL . . . . . 0.413 HG23 ' HA ' ' A' ' 853' ' ' THR . 0.0 OUTLIER -112.33 111.73 37.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.509 -177.373 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 830' ' ' VAL . . . . . 0.619 ' HA ' ' O ' ' A' ' 854' ' ' ALA . 48.7 t -112.17 100.59 11.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.316 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 831' ' ' ASP . . . . . 0.746 ' HB2' ' HB3' ' A' ' 875' ' ' ASP . 0.1 OUTLIER -121.26 137.55 54.64 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.935 0.398 . . . . 0.0 110.505 -178.27 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 832' ' ' ASP . . . . . 0.462 ' O ' ' HD3' ' A' ' 834' ' ' PRO . 7.2 t70 -74.24 -37.7 63.73 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.854 -176.181 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -108.49 93.1 11.04 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.28 -174.531 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 834' ' ' PRO . . . . . 0.462 ' HD3' ' O ' ' A' ' 832' ' ' ASP . 98.1 Cg_exo -45.62 -25.34 2.33 Favored 'Trans proline' 0 N--CA 1.482 0.849 0 C-N-CA 125.14 3.893 . . . . 0.0 116.374 -164.0 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 1.2 pp -58.25 -40.49 77.87 Favored 'Isoleucine or valine' 0 C--O 1.239 0.524 0 CA-C-O 121.242 0.544 . . . . 0.0 110.758 179.524 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 836' ' ' ASN . . . . . 0.529 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 2.2 t30 -74.53 -39.82 62.12 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.903 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 837' ' ' ARG . . . . . 0.557 ' HB2' ' OD2' ' A' ' 831' ' ' ASP . 6.7 ttp-105 -53.43 -39.96 64.8 Favored 'General case' 0 CA--C 1.518 -0.281 0 O-C-N 123.338 0.399 . . . . 0.0 110.542 175.856 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 838' ' ' ARG . . . . . 0.433 HH11 ' HG2' ' A' ' 838' ' ' ARG . 0.0 OUTLIER -59.39 -44.0 92.84 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 176.297 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 839' ' ' LEU . . . . . 0.432 ' N ' ' HG3' ' A' ' 838' ' ' ARG . 0.7 OUTLIER -69.04 -45.22 70.98 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.971 -0.559 . . . . 0.0 112.098 -175.279 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 840' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 836' ' ' ASN . 0.0 OUTLIER -67.59 -37.37 82.47 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.183 177.629 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -67.22 -24.25 65.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.005 0.431 . . . . 0.0 110.444 178.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.08 -57.76 8.66 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.052 176.011 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 843' ' ' GLN . . . . . 1.03 ' HG2' HD23 ' A' ' 929' ' ' LEU . 4.4 mp0 -68.1 -42.03 80.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.095 -177.654 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 844' ' ' LEU . . . . . 0.434 ' HB2' ' O ' ' A' ' 840' ' ' LEU . 0.0 OUTLIER -66.04 -32.76 74.42 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.11 0.481 . . . . 0.0 110.743 179.263 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -65.46 -38.41 94.8 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.933 -0.651 . . . . 0.0 111.874 178.766 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -70.98 -44.38 66.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.618 0.247 . . . . 0.0 111.099 179.09 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -161.23 78.65 0.58 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.065 0.459 . . . . 0.0 111.39 178.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . -147.8 32.5 1.31 Allowed Glycine 0 N--CA 1.445 -0.753 0 C-N-CA 120.673 -0.775 . . . . 0.0 111.786 176.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 849' ' ' TYR . . . . . 0.524 ' HB3' ' O ' ' A' ' 825' ' ' MET . 70.0 m-85 62.89 -156.9 0.33 Allowed 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 -178.895 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -77.24 108.81 10.62 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.866 0.365 . . . . 0.0 110.298 179.211 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -96.6 134.3 40.0 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.256 -176.228 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.43 122.44 36.69 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.069 177.095 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 853' ' ' THR . . . . . 0.433 HG22 ' HG2' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -92.94 137.25 32.53 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -175.668 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 854' ' ' ALA . . . . . 0.619 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -150.65 161.66 42.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.952 176.258 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 855' ' ' ASN . . . . . 0.452 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 16.1 p-10 -147.29 74.83 1.35 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.271 0.558 . . . . 0.0 111.647 -179.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 856' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' A' ' 855' ' ' ASN . 7.3 t0 172.86 147.9 0.05 Allowed 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 114.999 -1.0 . . . . 0.0 109.613 175.127 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -74.06 -35.31 53.88 Favored Glycine 0 N--CA 1.443 -0.861 0 C-N-CA 120.949 -0.643 . . . . 0.0 111.685 179.515 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 858' ' ' VAL . . . . . 0.427 HG22 ' OD1' ' A' ' 856' ' ' ASP . 19.4 m -73.09 -31.37 34.77 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 CA-C-O 120.899 0.38 . . . . 0.0 110.645 -179.749 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 859' ' ' ASP . . . . . 0.41 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 2.2 t70 -70.55 -38.52 74.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.051 179.003 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 860' ' ' ALA . . . . . 0.615 ' O ' ' HG ' ' A' ' 864' ' ' LEU . . . -61.33 -42.44 98.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.12 176.278 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 861' ' ' LEU . . . . . 0.47 HD23 HD12 ' A' ' 864' ' ' LEU . 1.3 mt -60.13 -41.63 93.06 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.719 177.604 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -63.88 -39.89 95.25 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.793 179.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 863' ' ' VAL . . . . . 0.586 HG11 HD13 ' A' ' 828' ' ' LEU . 0.3 OUTLIER -66.14 -33.9 66.63 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.764 -177.997 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 864' ' ' LEU . . . . . 0.615 ' HG ' ' O ' ' A' ' 860' ' ' ALA . 4.9 mt -69.85 -35.06 74.43 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.048 0.451 . . . . 0.0 110.109 176.27 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 4.1 m -81.5 -6.63 59.15 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.074 -178.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 17.2 mtpt -99.99 -45.59 5.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.729 176.009 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 867' ' ' ASN . . . . . 0.433 ' HB3' ' H ' ' A' ' 868' ' ' HIS . 22.9 t-20 -124.68 -112.16 0.3 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.518 -178.66 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 868' ' ' HIS . . . . . 0.433 ' H ' ' HB3' ' A' ' 867' ' ' ASN . 11.5 t60 -161.68 -67.27 0.06 Allowed 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 179.237 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 869' ' ' ILE . . . . . 0.7 HD13 ' HB3' ' A' ' 828' ' ' LEU . 35.7 mt 66.07 147.42 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 O-C-N 123.846 0.716 . . . . 0.0 110.468 -175.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -96.69 -36.42 10.69 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.251 -0.58 . . . . 0.0 112.421 -171.495 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 871' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -136.51 133.88 49.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.908 0.385 . . . . 0.0 110.837 -178.366 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 872' ' ' VAL . . . . . 0.581 HG13 HD21 ' A' ' 828' ' ' LEU . 12.0 t -101.81 124.83 55.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.444 177.67 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 873' ' ' LEU . . . . . 0.492 HD11 HD11 ' A' ' 936' ' ' LEU . 45.5 mt -104.85 100.06 9.68 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 174.616 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -95.52 96.31 8.98 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.626 -178.252 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 875' ' ' ASP . . . . . 0.746 ' HB3' ' HB2' ' A' ' 831' ' ' ASP . 25.0 t0 -93.19 106.91 18.81 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.988 -177.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 876' ' ' VAL . . . . . 0.581 ' HB ' HG23 ' A' ' 903' ' ' THR . 21.6 t -108.61 135.77 46.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.091 -170.662 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 877' ' ' ASN . . . . . 0.843 ' HB2' ' HE3' ' A' ' 925' ' ' LYS . 10.9 t-20 -163.6 80.37 0.44 Allowed 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.7 176.205 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 878' ' ' MET . . . . . 0.463 ' HA ' ' HD3' ' A' ' 879' ' ' PRO . 0.0 OUTLIER -145.54 142.96 18.73 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.81 178.598 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 879' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' A' ' 878' ' ' MET . 3.0 Cg_exo -75.78 39.33 0.63 Allowed 'Trans proline' 0 CA--C 1.53 0.303 0 C-N-CA 123.273 2.649 . . . . 0.0 112.587 -178.414 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -145.42 127.54 15.65 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 -179.576 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.44 78.96 3.16 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.66 0.743 . . . . 0.0 111.421 -178.08 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -86.22 21.83 1.94 Allowed 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.264 175.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -75.63 49.7 2.42 Favored Glycine 0 C--N 1.331 0.292 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.58 177.633 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 884' ' ' TYR . . . . . 0.417 ' O ' ' HB2' ' A' ' 888' ' ' GLN . 54.6 t80 -158.99 -54.99 0.06 Allowed 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 -179.752 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 885' ' ' ARG . . . . . 0.742 ' O ' ' HB2' ' A' ' 889' ' ' ARG . 0.0 OUTLIER -58.39 -50.73 72.64 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.409 -179.486 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.43 -52.61 17.57 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.815 -176.435 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -60.87 -48.36 82.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 0.0 112.141 -174.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 888' ' ' GLN . . . . . 0.502 ' O ' ' HB2' ' A' ' 892' ' ' GLN . 3.8 mm-40 -68.68 -45.22 72.26 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.956 -0.297 . . . . 0.0 110.745 -178.124 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 889' ' ' ARG . . . . . 0.742 ' HB2' ' O ' ' A' ' 885' ' ' ARG . 0.0 OUTLIER -61.38 -48.09 82.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.595 0.236 . . . . 0.0 111.223 -177.724 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 890' ' ' ILE . . . . . 0.644 HG12 HD13 ' A' ' 895' ' ' LEU . 0.7 OUTLIER -62.71 -42.69 97.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.25 -175.94 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 891' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.45 -28.53 59.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.652 0.263 . . . . 0.0 111.04 -178.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 892' ' ' GLN . . . . . 0.502 ' HB2' ' O ' ' A' ' 888' ' ' GLN . 0.0 OUTLIER -70.15 -36.05 74.46 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.046 179.312 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -83.58 -3.58 57.81 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.889 -176.536 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 109.32 30.76 3.48 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.122 -1.037 . . . . 0.0 114.313 172.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 895' ' ' LEU . . . . . 0.644 HD13 HG12 ' A' ' 890' ' ' ILE . 0.2 OUTLIER -66.79 112.03 4.03 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 117.393 0.596 . . . . 0.0 109.524 172.837 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 8.4 t -130.16 59.67 1.63 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 122.08 0.943 . . . . 0.0 110.537 -177.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 897' ' ' LEU . . . . . 0.406 HD21 HD22 ' A' ' 864' ' ' LEU . 1.0 OUTLIER -156.07 151.73 22.18 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.655 178.454 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -58.03 116.39 3.2 Favored 'Trans proline' 0 C--O 1.235 0.327 0 C-N-CA 122.956 2.437 . . . . 0.0 113.117 -176.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 899' ' ' VAL . . . . . 0.509 HG13 ' HB ' ' A' ' 872' ' ' VAL . 16.2 t -103.38 124.91 57.89 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.634 177.037 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 900' ' ' ILE . . . . . 0.668 HG23 ' HB2' ' A' ' 921' ' ' SER . 8.7 mt -104.74 102.03 13.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 177.06 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 901' ' ' GLY . . . . . 0.489 ' O ' ' HA ' ' A' ' 922' ' ' CYS . . . -83.5 112.73 3.59 Favored Glycine 0 N--CA 1.444 -0.799 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.0 -178.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 902' ' ' VAL . . . . . 0.868 ' HB ' HD12 ' A' ' 923' ' ' LEU . 0.2 OUTLIER -104.23 114.55 44.15 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.915 0 N-CA-C 109.268 -0.642 . . . . 0.0 109.268 178.311 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 903' ' ' THR . . . . . 0.581 HG23 ' HB ' ' A' ' 876' ' ' VAL . 0.1 OUTLIER -119.86 152.76 36.84 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.546 -176.347 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -76.14 103.84 6.38 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.749 -179.213 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 57.88 79.07 0.21 Allowed 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.751 178.649 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 906' ' ' ALA . . . . . 0.497 ' HB3' ' HG3' ' A' ' 909' ' ' GLU . . . -85.16 -11.92 53.95 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.744 179.161 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 907' ' ' LEU . . . . . 0.417 ' HB2' ' O ' ' A' ' 906' ' ' ALA . 1.5 mt 73.86 -54.25 0.68 Allowed 'General case' 0 N--CA 1.471 0.599 0 O-C-N 124.048 0.842 . . . . 0.0 111.27 176.631 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -132.85 72.3 1.49 Allowed 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 177.006 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 909' ' ' GLU . . . . . 0.497 ' HG3' ' HB3' ' A' ' 906' ' ' ALA . 1.8 mp0 -46.61 -52.46 13.56 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.377 -0.828 . . . . 0.0 112.304 -176.028 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 910' ' ' GLU . . . . . 0.446 ' O ' ' HB3' ' A' ' 913' ' ' ARG . 1.0 OUTLIER -56.77 -46.44 81.49 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 120.946 0.403 . . . . 0.0 111.575 -179.136 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -66.53 -37.32 84.77 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.23 0.538 . . . . 0.0 110.692 -178.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -63.3 -31.29 72.4 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.039 177.23 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 913' ' ' ARG . . . . . 0.663 ' HB2' ' SG ' ' A' ' 922' ' ' CYS . 13.6 ttp180 -67.12 -38.88 86.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.444 177.536 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 13.3 m -63.45 -27.94 69.63 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.037 0.446 . . . . 0.0 110.32 176.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.02 -49.68 42.34 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.641 177.31 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 916' ' ' GLU . . . . . 0.445 ' HG3' ' H ' ' A' ' 916' ' ' GLU . 0.0 OUTLIER -74.18 -50.28 19.93 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 121.106 -0.237 . . . . 0.0 111.266 -176.535 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 50.38 40.95 24.03 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.802 -175.575 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -136.9 -29.38 0.3 Allowed Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.572 -0.823 . . . . 0.0 113.483 -176.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 919' ' ' MET . . . . . 0.584 ' O ' ' HB2' ' A' ' 920' ' ' ASP . 0.3 OUTLIER -84.23 -87.53 0.11 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 117.183 0.491 . . . . 0.0 110.826 -176.763 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 920' ' ' ASP . . . . . 0.584 ' HB2' ' O ' ' A' ' 919' ' ' MET . 25.6 t70 164.32 -53.15 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.533 0.733 . . . . 0.0 110.39 176.081 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . 0.668 ' HB2' HG23 ' A' ' 900' ' ' ILE . 1.0 OUTLIER -134.81 171.06 14.91 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.871 179.819 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 922' ' ' CYS . . . . . 0.663 ' SG ' ' HB2' ' A' ' 913' ' ' ARG . 0.4 OUTLIER -149.59 145.43 26.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.815 0.34 . . . . 0.0 111.372 -178.213 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 923' ' ' LEU . . . . . 0.868 HD12 ' HB ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -145.82 -176.86 5.31 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.933 175.654 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 924' ' ' SER . . . . . 0.54 ' HB3' ' HD2' ' A' ' 926' ' ' PRO . 4.1 m -103.55 144.55 31.27 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.802 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 925' ' ' LYS . . . . . 0.843 ' HE3' ' HB2' ' A' ' 877' ' ' ASN . 12.9 tttm -54.44 -45.85 99.25 Favored Pre-proline 0 CA--C 1.539 0.547 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 -179.154 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 926' ' ' PRO . . . . . 0.54 ' HD2' ' HB3' ' A' ' 924' ' ' SER . 14.8 Cg_exo -69.93 71.96 1.57 Allowed 'Trans proline' 0 C--N 1.356 0.953 0 C-N-CA 121.851 1.701 . . . . 0.0 111.923 175.157 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 10.0 p -95.04 140.75 16.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.992 -178.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -92.56 159.56 15.43 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.857 179.182 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 929' ' ' LEU . . . . . 1.03 HD23 ' HG2' ' A' ' 843' ' ' GLN . 1.3 tm? -52.69 -43.26 65.48 Favored 'General case' 0 N--CA 1.464 0.271 0 O-C-N 123.468 0.48 . . . . 0.0 111.027 179.269 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.39 -37.71 88.47 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.97 0.414 . . . . 0.0 110.659 -177.282 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 44.2 t -75.6 -47.14 34.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.147 -176.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 932' ' ' ILE . . . . . 0.419 ' O ' ' HB2' ' A' ' 936' ' ' LEU . 0.0 OUTLIER -63.59 -40.1 87.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 121.148 -0.221 . . . . 0.0 110.702 -179.329 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 1.8 tmmt? -62.96 -48.47 78.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.066 0.46 . . . . 0.0 110.33 177.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -62.34 -49.35 75.92 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.379 -177.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 4.7 m -63.87 -44.8 92.0 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.386 -177.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 936' ' ' LEU . . . . . 0.492 HD11 HD11 ' A' ' 873' ' ' LEU . 0.1 OUTLIER -63.9 -47.64 79.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.558 -179.045 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 55.0 m -63.27 -45.95 89.09 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.308 -179.458 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 938' ' ' LEU . . . . . 0.473 ' O ' ' HB2' ' A' ' 942' ' ' ARG . 0.4 OUTLIER -64.01 -43.19 96.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.254 -178.372 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -73.89 -32.57 63.64 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 121.084 -0.246 . . . . 0.0 111.082 -177.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -69.54 -45.99 67.5 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.806 0.336 . . . . 0.0 110.678 177.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 941' ' ' GLU . . . . . 0.438 ' HA ' ' HB2' ' A' ' 944' ' ' ARG . 1.7 pt-20 -70.42 -23.78 62.8 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.833 0.349 . . . . 0.0 110.463 178.524 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 942' ' ' ARG . . . . . 0.473 ' HB2' ' O ' ' A' ' 938' ' ' LEU . 0.4 OUTLIER -66.13 -48.47 70.73 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.724 178.722 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 2.8 m -72.69 -30.44 33.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.046 0.45 . . . . 0.0 110.043 178.785 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 944' ' ' ARG . . . . . 0.438 ' HB2' ' HA ' ' A' ' 941' ' ' GLU . 0.9 OUTLIER -62.68 -48.74 77.96 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.981 177.37 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -74.48 -16.13 60.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.769 0.318 . . . . 0.0 111.26 -179.562 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 63.4 m -79.29 -26.78 42.26 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.15 0.5 . . . . 0.0 109.971 174.088 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 1.6 mpp_? -82.63 -38.49 23.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.647 175.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 948' ' ' ASP . . . . . 0.439 ' HB3' ' H ' ' A' ' 949' ' ' SER . 0.5 OUTLIER -96.12 -127.02 0.14 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.856 177.764 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 949' ' ' SER . . . . . 0.439 ' H ' ' HB3' ' A' ' 948' ' ' ASP . 2.3 m . . . . . 0 C--O 1.25 1.116 0 CA-C-O 118.89 -0.576 . . . . 0.0 109.983 176.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.928 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . -146.01 92.19 0.16 Allowed Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.996 -0.621 . . . . 0.0 111.679 -179.281 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . -94.2 82.54 0.97 Allowed Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.761 -0.733 . . . . 0.0 111.805 -177.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 5.8 m -147.34 101.65 3.4 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.055 0.455 . . . . 0.0 110.799 179.041 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . -142.25 50.02 0.73 Allowed Glycine 0 N--CA 1.445 -0.724 0 N-CA-C 110.763 -0.935 . . . . 0.0 110.763 175.628 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -142.1 135.52 28.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 120.939 0.399 . . . . 0.0 111.058 -176.028 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -83.62 80.1 9.23 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 173.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . -51.71 -46.12 54.34 Favored Glycine 0 C--N 1.332 0.333 0 CA-C-N 115.544 -0.753 . . . . 0.0 113.361 -175.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.656 HD22 HG12 ' A' ' 801' ' ' ILE . 1.7 pt? -151.73 -48.88 0.11 Allowed 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 121.291 -0.164 . . . . 0.0 110.581 179.69 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 705' ' ' SER . . . . . 0.581 ' N ' ' HG ' ' A' ' 704' ' ' LEU . 3.7 m 58.44 -177.45 0.08 Allowed 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.827 178.506 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 67.68 15.72 66.87 Favored Glycine 0 CA--C 1.52 0.346 0 CA-C-N 116.142 -0.481 . . . . 0.0 113.603 175.025 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 707' ' ' LYS . . . . . 0.536 ' HB2' HD12 ' A' ' 731' ' ' ILE . 10.0 mmmt -118.88 148.34 43.01 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 708' ' ' ARG . . . . . 0.401 ' HG2' HG13 ' A' ' 732' ' ' VAL . 0.5 OUTLIER -109.38 122.96 48.52 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.058 0.456 . . . . 0.0 110.863 -176.9 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -101.86 113.79 27.29 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 175.507 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 710' ' ' TRP . . . . . 0.456 ' O ' HD23 ' A' ' 747' ' ' LEU . 87.8 m95 -89.91 115.38 27.17 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -178.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 711' ' ' LEU . . . . . 0.497 HD11 ' HB2' ' A' ' 719' ' ' CYS . 0.0 OUTLIER -114.87 125.48 53.7 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.75 -172.158 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -126.29 43.37 3.11 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.191 177.256 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 713' ' ' VAL . . . . . 0.764 ' HA ' ' CB ' ' A' ' 750' ' ' ASP . 25.2 t -98.82 133.76 40.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.63 -0.713 . . . . 0.0 110.652 -178.053 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -98.3 -34.04 10.84 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.639 -176.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -69.96 122.52 19.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.436 178.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 716' ' ' ALA . . . . . 0.732 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -64.18 -37.59 88.02 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.087 -0.506 . . . . 0.0 112.066 -173.404 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 717' ' ' SER . . . . . 0.431 ' O ' ' HB2' ' A' ' 721' ' ' PHE . 1.7 m -63.09 -45.61 91.27 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.116 0.484 . . . . 0.0 110.24 179.126 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 718' ' ' LEU . . . . . 0.644 ' HB3' HG11 ' A' ' 713' ' ' VAL . 0.4 OUTLIER -68.93 -49.74 55.47 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.514 -0.767 . . . . 0.0 111.566 -179.534 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 719' ' ' CYS . . . . . 0.732 ' SG ' ' HA ' ' A' ' 716' ' ' ALA . 30.5 p -67.13 -51.02 59.17 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.212 -174.675 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 720' ' ' GLN . . . . . 0.419 ' HA ' ' CG ' ' A' ' 723' ' ' GLU . 4.6 tp60 -60.24 -39.23 86.0 Favored 'General case' 0 C--N 1.332 -0.163 0 O-C-N 122.997 0.185 . . . . 0.0 111.37 -178.21 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 721' ' ' PHE . . . . . 0.431 ' HB2' ' O ' ' A' ' 717' ' ' SER . 10.6 t80 -55.87 -55.8 28.19 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.021 0.438 . . . . 0.0 110.433 179.755 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 722' ' ' LEU . . . . . 0.635 HD13 HG21 ' A' ' 748' ' ' ILE . 20.5 mt -68.42 -46.54 69.62 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.427 -176.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 723' ' ' GLU . . . . . 0.419 ' CG ' ' HA ' ' A' ' 720' ' ' GLN . 0.0 OUTLIER -64.66 -44.23 91.07 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.549 0.203 . . . . 0.0 111.549 -173.892 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 724' ' ' THR . . . . . 0.64 ' O ' ' HG3' ' A' ' 728' ' ' ARG . 55.4 m -67.36 -36.76 82.04 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.769 0.318 . . . . 0.0 110.804 -179.189 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 24.5 m -70.67 -49.08 51.08 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.737 0.304 . . . . 0.0 111.467 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 726' ' ' LEU . . . . . . . . . . . . . 9.6 mt -68.6 -37.09 79.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.649 -175.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.61 -18.96 65.71 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.044 0.45 . . . . 0.0 110.88 -179.707 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 728' ' ' ARG . . . . . 0.64 ' HG3' ' O ' ' A' ' 724' ' ' THR . 8.9 mtm180 -74.69 -11.25 60.13 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.013 0.435 . . . . 0.0 110.74 178.297 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -103.7 8.02 37.34 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.045 0.45 . . . . 0.0 110.803 178.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 730' ' ' GLY . . . . . 0.477 ' O ' ' HA ' ' A' ' 705' ' ' SER . . . 89.86 13.17 61.24 Favored Glycine 0 C--N 1.329 0.169 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.784 179.006 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 731' ' ' ILE . . . . . 0.536 HD12 ' HB2' ' A' ' 707' ' ' LYS . 15.2 mm -90.35 128.94 41.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 O-C-N 122.791 -0.24 . . . . 0.0 110.475 179.686 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 732' ' ' VAL . . . . . 0.401 HG13 ' HG2' ' A' ' 708' ' ' ARG . 1.4 p -90.01 115.81 30.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.201 0.524 . . . . 0.0 110.566 -179.604 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 733' ' ' VAL . . . . . . . . . . . . . 10.1 t -86.81 137.14 21.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.195 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -141.48 137.34 32.04 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.827 0.346 . . . . 0.0 110.948 -177.845 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.72 116.6 7.82 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.632 178.548 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -85.4 80.01 9.27 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.401 0.619 . . . . 0.0 110.873 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 737' ' ' GLU . . . . . 0.462 ' H ' ' HG3' ' A' ' 737' ' ' GLU . 0.0 OUTLIER -79.01 -29.41 43.65 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.065 176.26 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 146.77 67.49 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.57 178.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 739' ' ' GLN . . . . . 0.451 ' HB2' ' H ' ' A' ' 740' ' ' GLU . 0.1 OUTLIER -112.99 -119.96 0.3 Allowed 'General case' 0 C--N 1.329 -0.312 0 O-C-N 122.879 -0.189 . . . . 0.0 110.817 179.304 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 740' ' ' GLU . . . . . 0.496 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 17.2 mm-40 -112.5 134.14 21.67 Favored Pre-proline 0 C--N 1.326 -0.432 0 CA-C-O 120.659 0.266 . . . . 0.0 111.045 -177.065 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 741' ' ' PRO . . . . . 0.496 ' HD3' ' HA ' ' A' ' 740' ' ' GLU . 4.5 Cg_endo -88.0 125.81 1.98 Allowed 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 123.434 2.756 . . . . 0.0 111.98 175.607 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 742' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -95.71 125.17 50.14 Favored Pre-proline 0 N--CA 1.449 -0.525 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.377 176.777 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 743' ' ' PRO . . . . . 0.675 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 34.0 Cg_endo -64.28 -9.41 19.79 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.834 2.356 . . . . 0.0 112.465 -179.314 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -104.85 -6.96 19.74 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.055 -179.902 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -117.13 167.28 11.32 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.519 -173.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 746' ' ' VAL . . . . . 0.652 HG21 HD11 ' A' ' 795' ' ' LEU . 33.0 m -118.91 148.21 21.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.352 0.596 . . . . 0.0 112.417 -171.454 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 747' ' ' LEU . . . . . 0.456 HD23 ' O ' ' A' ' 710' ' ' TRP . 0.3 OUTLIER -107.89 115.14 29.59 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.481 175.141 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 748' ' ' ILE . . . . . 0.635 HG21 HD13 ' A' ' 722' ' ' LEU . 19.3 mt -98.86 107.55 20.67 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 172.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 749' ' ' THR . . . . . 0.501 HG21 ' HB ' ' A' ' 753' ' ' VAL . 0.0 OUTLIER -102.68 160.55 14.48 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.319 -0.855 . . . . 0.0 112.192 -170.388 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 750' ' ' ASP . . . . . 0.764 ' CB ' ' HA ' ' A' ' 713' ' ' VAL . 36.7 t0 -124.14 121.61 35.59 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 171.426 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 64.84 -165.77 0.23 Allowed 'General case' 0 C--N 1.327 -0.385 0 O-C-N 123.785 0.678 . . . . 0.0 110.715 -174.288 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 752' ' ' VAL . . . . . 0.929 HG21 ' HB ' ' A' ' 770' ' ' ILE . 42.0 t -82.46 122.4 37.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.06 0.457 . . . . 0.0 111.317 -175.164 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 753' ' ' VAL . . . . . 0.501 ' HB ' HG21 ' A' ' 749' ' ' THR . 8.7 p -93.21 -7.16 10.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.269 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 54.72 51.24 14.17 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.388 -178.666 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.72 167.87 28.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.713 178.196 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -101.77 -29.47 11.86 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 123.108 0.255 . . . . 0.0 110.987 -179.686 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 757' ' ' TRP . . . . . 0.526 ' CD1' ' HB ' ' A' ' 762' ' ' VAL . 68.9 t-105 65.03 94.01 0.06 Allowed 'General case' 0 N--CA 1.464 0.271 0 O-C-N 123.794 0.684 . . . . 0.0 111.007 -179.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.81 64.58 8.13 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.255 0.55 . . . . 0.0 110.326 177.447 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 759' ' ' GLY . . . . . 0.675 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -123.44 -151.82 8.33 Favored Glycine 0 N--CA 1.446 -0.644 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.457 178.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.14 -51.01 19.49 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.993 0.425 . . . . 0.0 110.051 178.563 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -162.39 151.17 15.03 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.377 178.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 762' ' ' VAL . . . . . 0.526 ' HB ' ' CD1' ' A' ' 757' ' ' TRP . 2.7 p -128.15 117.04 44.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.606 176.754 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 1.6 t -109.49 104.19 16.69 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.693 -178.2 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 764' ' ' THR . . . . . 0.622 ' HB ' HG12 ' A' ' 782' ' ' VAL . 90.4 m -95.43 121.44 37.12 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.951 -175.132 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 765' ' ' PHE . . . . . 0.852 ' HE1' HG23 ' A' ' 785' ' ' VAL . 5.6 m-85 -91.13 89.3 7.31 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.334 173.629 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -110.61 133.54 53.22 Favored 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.57 -175.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.79 61.06 4.08 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.98 0.419 . . . . 0.0 110.053 179.565 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 768' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 768' ' ' ARG . 3.3 mtm180 57.39 29.9 17.69 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.868 178.648 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -96.17 118.66 33.19 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.114 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 770' ' ' ILE . . . . . 0.929 ' HB ' HG21 ' A' ' 752' ' ' VAL . 53.6 mt 71.31 -70.01 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 O-C-N 123.76 0.662 . . . . 0.0 111.477 178.123 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . 126.73 96.93 0.99 Allowed Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 120.504 -0.855 . . . . 0.0 113.248 178.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 772' ' ' ILE . . . . . 0.736 HG12 HG22 ' A' ' 752' ' ' VAL . 39.2 mm -104.42 129.28 25.33 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 171.49 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 773' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -75.12 170.91 19.35 Favored 'Trans proline' 0 CA--C 1.53 0.279 0 C-N-CA 122.578 2.186 . . . . 0.0 113.184 -178.311 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . 0.578 ' O ' ' HB3' ' A' ' 780' ' ' GLU . 0.7 OUTLIER -101.93 -148.88 0.38 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.459 -178.706 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 775' ' ' GLU . . . . . 0.495 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 1.7 mp0 -65.38 60.56 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -179.688 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -102.01 -16.06 16.59 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 170.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -132.26 149.25 72.67 Favored Pre-proline 0 N--CA 1.449 -0.514 0 CA-C-N 114.188 -1.369 . . . . 0.0 108.423 175.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -60.67 100.41 0.16 Allowed 'Trans proline' 0 C--O 1.232 0.206 0 C-N-CA 122.572 2.181 . . . . 0.0 112.956 -176.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 123.05 -17.28 8.09 Favored Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.693 -0.765 . . . . 0.0 113.109 175.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 780' ' ' GLU . . . . . 0.578 ' HB3' ' O ' ' A' ' 774' ' ' LEU . 1.1 tt0 -81.07 126.29 31.26 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 117.13 0.465 . . . . 0.0 111.418 -175.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 32.3 m95 -138.68 143.07 39.0 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 176.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . 0.622 HG12 ' HB ' ' A' ' 764' ' ' THR . 1.2 m -143.93 155.35 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-O 121.121 0.486 . . . . 0.0 111.633 178.015 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 783' ' ' HIS . . . . . 0.485 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 1.4 t-160 -161.52 139.98 9.54 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.565 174.167 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -105.4 99.36 8.97 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 175.623 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 785' ' ' VAL . . . . . 0.852 HG23 ' HE1' ' A' ' 765' ' ' PHE . 0.0 OUTLIER -171.29 -160.98 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.953 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 786' ' ' ALA . . . . . 0.447 ' H ' ' HB ' ' A' ' 785' ' ' VAL . . . -133.33 68.15 1.51 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.796 -0.184 . . . . 0.0 110.659 177.713 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 50.2 67.95 3.9 Favored Pre-proline 0 N--CA 1.468 0.447 0 CA-C-N 115.878 -0.601 . . . . 0.0 112.011 178.095 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 788' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -87.36 46.77 1.41 Allowed 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 122.595 2.197 . . . . 0.0 112.947 -174.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 71.21 -32.26 0.24 Allowed 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.415 0.686 . . . . 0.0 112.85 175.726 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 790' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -71.19 -37.92 72.13 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -175.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 791' ' ' LEU . . . . . 0.715 HD22 ' HE2' ' A' ' 765' ' ' PHE . 0.2 OUTLIER -71.12 -48.3 13.58 Favored Pre-proline 0 C--N 1.327 -0.372 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -176.362 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 792' ' ' PRO . . . . . 0.466 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 2.9 Cg_endo -53.65 -33.08 67.75 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 121.373 1.382 . . . . 0.0 112.119 173.855 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -66.79 -44.65 80.74 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 120.909 0.385 . . . . 0.0 110.464 175.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -59.75 -44.36 93.86 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.292 177.155 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 795' ' ' LEU . . . . . 0.652 HD11 HG21 ' A' ' 746' ' ' VAL . 0.2 OUTLIER -59.84 -47.36 86.04 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.096 -179.282 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -62.13 -45.06 95.14 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.097 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.02 -24.63 62.4 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.352 -178.008 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -77.62 -28.65 15.96 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 CA-C-O 120.732 0.301 . . . . 0.0 111.116 -179.135 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 799' ' ' TYR . . . . . 0.462 ' HD1' ' HA ' ' A' ' 799' ' ' TYR . 0.2 OUTLIER -81.45 -16.96 50.42 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.445 178.488 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 1.8 mt 58.69 83.37 0.12 Allowed 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.426 -0.807 . . . . 0.0 111.92 174.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 801' ' ' ILE . . . . . 0.656 HG12 HD22 ' A' ' 704' ' ' LEU . 1.8 mt -102.58 109.26 26.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.815 -179.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -107.84 9.85 28.77 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.293 177.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 803' ' ' MET . . . . . 0.468 ' HB3' ' H ' ' A' ' 804' ' ' GLU . 0.0 OUTLIER 56.91 -121.14 1.48 Allowed 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.475 -177.397 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 804' ' ' GLU . . . . . 0.468 ' H ' ' HB3' ' A' ' 803' ' ' MET . 0.0 OUTLIER -155.55 161.33 40.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.716 0.293 . . . . 0.0 110.345 178.872 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 3.2 m -147.89 109.01 4.26 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.121 0.486 . . . . 0.0 109.936 177.169 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -105.76 119.84 40.17 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.767 -175.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 33.0 t0 -171.22 84.51 0.5 Allowed Pre-proline 0 C--N 1.327 -0.396 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.938 178.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 808' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_exo -65.78 147.4 85.51 Favored 'Trans proline' 0 C--O 1.233 0.269 0 C-N-CA 123.045 2.497 . . . . 0.0 112.779 -177.108 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -88.11 159.8 18.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.262 176.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 14.6 t30 -124.9 114.77 19.62 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.803 0.335 . . . . 0.0 110.562 -177.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -116.55 149.61 39.33 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.95 -178.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 812' ' ' LEU . . . . . 0.562 HD22 ' HD2' ' A' ' 813' ' ' PRO . 0.4 OUTLIER -139.77 108.3 7.08 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.459 179.228 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 813' ' ' PRO . . . . . 0.562 ' HD2' HD22 ' A' ' 812' ' ' LEU . 67.8 Cg_endo -77.15 146.48 25.4 Favored 'Trans proline' 0 CA--C 1.53 0.314 0 C-N-CA 122.494 2.129 . . . . 0.0 112.324 176.792 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -114.5 133.03 56.08 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.466 -0.333 . . . . 0.0 110.617 179.278 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 1.1 m -95.51 139.16 32.18 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.099 -179.344 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -116.63 159.3 22.38 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 176.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.11 139.2 52.64 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.252 0.548 . . . . 0.0 112.07 -172.131 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -145.22 161.99 38.2 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.023 174.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -148.8 136.74 14.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.184 0.516 . . . . 0.0 111.282 -176.384 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -127.66 153.63 46.23 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.812 174.476 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -163.98 133.59 4.0 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.767 -0.197 . . . . 0.0 110.601 179.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -167.44 108.11 0.6 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.297 176.503 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -145.25 138.25 26.32 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 172.582 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -159.07 -97.49 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.779 0.324 . . . . 0.0 111.576 -175.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.32 103.53 12.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.743 0.306 . . . . 0.0 111.049 -176.462 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 826' ' ' MET . . . . . 0.43 ' SD ' ' HA ' ' A' ' 869' ' ' ILE . 0.0 OUTLIER -100.55 117.08 33.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.495 178.949 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 827' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -113.66 120.14 62.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.93 178.811 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 828' ' ' LEU . . . . . 0.808 ' HB3' HG22 ' A' ' 872' ' ' VAL . 2.2 tm? -95.55 129.72 42.64 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 -179.03 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 829' ' ' VAL . . . . . 0.611 ' HB ' ' CZ ' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -123.44 124.22 69.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-O 120.725 0.298 . . . . 0.0 110.667 179.329 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 830' ' ' VAL . . . . . 0.553 HG13 ' HA ' ' A' ' 874' ' ' SER . 2.2 p -122.25 105.29 16.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.993 0.425 . . . . 0.0 111.338 -176.799 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 831' ' ' ASP . . . . . 0.693 ' HA ' ' O ' ' A' ' 875' ' ' ASP . 4.7 t0 -110.11 155.42 21.93 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.276 0.56 . . . . 0.0 111.415 -175.541 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -93.24 -21.45 19.61 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.031 -0.986 . . . . 0.0 109.496 175.184 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 10.9 m170 -110.75 118.1 49.21 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.837 -179.025 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -61.2 -40.5 49.86 Favored 'Trans proline' 0 C--O 1.234 0.313 0 C-N-CA 122.892 2.394 . . . . 0.0 112.66 -178.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -61.04 -40.92 87.26 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.421 178.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 836' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -66.46 -46.1 77.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.638 178.282 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 837' ' ' ARG . . . . . 0.697 HH21 HD11 ' A' ' 840' ' ' LEU . 0.0 OUTLIER -52.06 -53.3 43.86 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.653 179.926 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 838' ' ' ARG . . . . . 0.487 ' HG3' ' N ' ' A' ' 839' ' ' LEU . 0.0 OUTLIER -64.24 -42.46 96.52 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.728 0.299 . . . . 0.0 111.37 -175.728 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 839' ' ' LEU . . . . . 0.487 ' N ' ' HG3' ' A' ' 838' ' ' ARG . 0.2 OUTLIER -76.3 -49.02 18.06 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -171.347 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 840' ' ' LEU . . . . . 0.697 HD11 HH21 ' A' ' 837' ' ' ARG . 1.7 pp -75.15 -30.04 60.64 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.387 -0.525 . . . . 0.0 111.168 -176.624 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -71.87 -25.26 61.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.822 0.344 . . . . 0.0 110.24 175.493 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -63.59 -44.66 93.37 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.468 -0.568 . . . . 0.0 109.468 172.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 843' ' ' GLN . . . . . 0.452 ' HG2' HD23 ' A' ' 929' ' ' LEU . 1.4 mt-30 -62.7 -38.3 89.88 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.286 176.397 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 844' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.81 -34.91 76.78 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.229 0.538 . . . . 0.0 110.416 175.12 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -68.45 -31.77 74.44 Favored Glycine 0 N--CA 1.446 -0.644 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.993 176.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -68.65 -24.85 64.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.939 0.4 . . . . 0.0 110.413 177.088 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 847' ' ' LEU . . . . . 0.513 HD22 HD22 ' A' ' 936' ' ' LEU . 0.2 OUTLIER -68.29 -38.38 81.61 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.442 174.995 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 92.0 55.66 1.71 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.742 -0.742 . . . . 0.0 113.094 175.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 849' ' ' TYR . . . . . 0.402 ' HE2' HD23 ' A' ' 847' ' ' LEU . 92.8 m-85 -136.14 164.18 28.62 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 177.396 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 850' ' ' GLN . . . . . 0.406 ' O ' ' HA ' ' A' ' 826' ' ' MET . 0.0 OUTLIER -80.65 108.34 14.22 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 -179.45 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -112.16 148.37 34.15 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.634 -176.122 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 852' ' ' LYS . . . . . 0.405 ' HB3' HD23 ' A' ' 828' ' ' LEU . 0.0 OUTLIER -121.51 116.83 25.41 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 175.007 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 32.8 p -92.68 128.62 38.61 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.836 -178.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 854' ' ' ALA . . . . . 0.507 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -137.35 132.35 33.45 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.367 176.796 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -112.21 73.7 0.83 Allowed 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 172.235 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 856' ' ' ASP . . . . . 0.645 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 2.1 t0 -173.56 126.82 0.41 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.074 -0.966 . . . . 0.0 109.689 -170.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -71.86 -61.87 3.61 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.197 -177.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 858' ' ' VAL . . . . . 0.449 HG22 ' H ' ' A' ' 858' ' ' VAL . 0.0 OUTLIER -59.23 -31.51 46.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 111.933 0.346 . . . . 0.0 111.933 -178.43 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 859' ' ' ASP . . . . . 0.645 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 0.2 OUTLIER -68.91 -20.85 64.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.578 0.227 . . . . 0.0 111.364 -178.049 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 860' ' ' ALA . . . . . 0.457 ' O ' ' HB2' ' A' ' 864' ' ' LEU . . . -64.77 -36.27 83.78 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.975 0.417 . . . . 0.0 110.078 176.165 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 861' ' ' LEU . . . . . . . . . . . . . 1.3 mt -71.56 -37.22 71.1 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.706 175.582 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 36.4 t-20 -56.18 -53.16 60.46 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 114.98 -1.009 . . . . 0.0 111.034 179.636 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 8.3 p -72.79 -32.71 41.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.49 -178.054 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 864' ' ' LEU . . . . . 0.457 ' HB2' ' O ' ' A' ' 860' ' ' ALA . 0.2 OUTLIER -62.71 -45.87 90.75 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.024 0.44 . . . . 0.0 110.857 -179.956 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 1.4 m -80.2 -20.05 45.61 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.015 -178.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -74.09 -52.14 13.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.072 0.463 . . . . 0.0 110.58 178.104 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -109.84 -88.22 0.5 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.02 -179.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 868' ' ' HIS . . . . . 0.506 ' O ' ' HB ' ' A' ' 869' ' ' ILE . 0.2 OUTLIER 172.73 -64.87 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 O-C-N 123.267 0.355 . . . . 0.0 110.662 -179.409 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 869' ' ' ILE . . . . . 0.776 HG12 ' HB2' ' A' ' 828' ' ' LEU . 1.7 mp 71.89 142.66 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 O-C-N 123.783 0.677 . . . . 0.0 110.496 -175.368 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -87.01 -42.66 12.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.883 0.373 . . . . 0.0 111.323 -176.118 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 871' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -141.07 136.16 33.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.158 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 872' ' ' VAL . . . . . 0.808 HG22 ' HB3' ' A' ' 828' ' ' LEU . 3.2 t -115.1 131.57 66.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.725 -178.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 873' ' ' LEU . . . . . 0.489 HD12 HG13 ' A' ' 829' ' ' VAL . 1.9 mt -113.35 118.84 35.69 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 173.635 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 874' ' ' SER . . . . . 0.553 ' HA ' HG13 ' A' ' 830' ' ' VAL . 72.1 p -105.56 97.02 6.91 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.046 0.45 . . . . 0.0 110.282 -178.726 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 875' ' ' ASP . . . . . 0.693 ' O ' ' HA ' ' A' ' 831' ' ' ASP . 0.0 OUTLIER -87.9 105.8 17.67 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.841 -179.317 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 876' ' ' VAL . . . . . 0.673 HG22 ' H ' ' A' ' 878' ' ' MET . 5.1 p -127.19 143.11 41.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-O 121.226 0.536 . . . . 0.0 111.14 -176.203 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -98.12 -0.41 44.43 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.599 179.205 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 878' ' ' MET . . . . . 0.673 ' H ' HG22 ' A' ' 876' ' ' VAL . 2.2 tpp -132.57 80.64 61.73 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.516 -179.692 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 879' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -98.98 57.6 0.06 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.838 0 C-N-CA 123.377 2.718 . . . . 0.0 113.187 -178.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -156.32 -88.52 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.183 -177.799 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -71.15 -39.4 71.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.051 0.453 . . . . 0.0 110.373 179.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -108.8 -177.46 3.32 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 174.231 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . 79.58 -52.88 4.2 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 121.088 -0.577 . . . . 0.0 113.039 176.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 1.7 p90 -63.52 -22.11 66.71 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.982 0.42 . . . . 0.0 111.541 -174.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 885' ' ' ARG . . . . . 0.435 ' H ' ' HG3' ' A' ' 885' ' ' ARG . 0.2 OUTLIER -66.27 -31.8 72.83 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.865 0.364 . . . . 0.0 110.139 176.594 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -69.39 -49.59 53.89 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 178.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.57 -39.62 94.26 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.072 0.463 . . . . 0.0 110.935 179.797 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 888' ' ' GLN . . . . . 0.788 ' HA ' ' HD3' ' A' ' 891' ' ' ARG . 1.4 tp-100 -61.01 -45.51 94.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.972 175.23 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.34 -42.95 96.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.777 179.564 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 890' ' ' ILE . . . . . 0.507 HG22 ' HB3' ' A' ' 895' ' ' LEU . 11.4 mm -58.69 -52.3 61.59 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.024 179.657 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 891' ' ' ARG . . . . . 0.788 ' HD3' ' HA ' ' A' ' 888' ' ' GLN . 0.4 OUTLIER -68.38 -30.09 68.94 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.42 -178.153 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -74.23 -34.85 63.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.594 -177.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.16 -46.73 32.29 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.838 177.608 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 133.23 89.01 0.38 Allowed Glycine 0 N--CA 1.443 -0.89 0 C-N-CA 120.638 -0.792 . . . . 0.0 112.42 179.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 895' ' ' LEU . . . . . 0.507 ' HB3' HG22 ' A' ' 890' ' ' ILE . 0.0 OUTLIER -77.93 150.26 34.06 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.041 0.448 . . . . 0.0 110.783 177.918 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -135.54 13.74 3.46 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.985 -178.569 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 897' ' ' LEU . . . . . 0.721 HD11 HG23 ' A' ' 872' ' ' VAL . 1.7 pt? -149.03 154.41 39.48 Favored Pre-proline 0 C--N 1.32 -0.706 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.409 -173.609 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 898' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 897' ' ' LEU . 18.4 Cg_exo -67.2 122.57 9.87 Favored 'Trans proline' 0 C--O 1.238 0.517 0 C-N-CA 122.873 2.382 . . . . 0.0 112.153 178.346 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 899' ' ' VAL . . . . . 0.828 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 18.9 t -103.19 108.3 24.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 121.266 0.555 . . . . 0.0 110.451 178.048 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 900' ' ' ILE . . . . . 0.481 ' O ' ' HA ' ' A' ' 873' ' ' LEU . 8.1 mt -96.15 102.84 14.0 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.717 178.355 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -89.94 124.71 7.55 Favored Glycine 0 N--CA 1.44 -1.049 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.475 -176.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 902' ' ' VAL . . . . . 0.635 ' HB ' HD12 ' A' ' 923' ' ' LEU . 0.1 OUTLIER -103.33 106.84 20.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 174.438 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 903' ' ' THR . . . . . 0.424 HG22 HG12 ' A' ' 876' ' ' VAL . 17.8 p -108.53 144.63 35.94 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.063 -173.447 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 904' ' ' ALA . . . . . 0.494 ' HA ' ' HB2' ' A' ' 925' ' ' LYS . . . -74.59 103.26 4.83 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.789 -0.364 . . . . 0.0 110.586 177.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 42.34 73.33 0.14 Allowed 'General case' 0 N--CA 1.468 0.44 0 O-C-N 124.225 0.953 . . . . 0.0 112.854 176.428 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -81.2 -14.08 57.92 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.244 177.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 51.8 mt 74.29 -60.44 0.52 Allowed 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.501 179.135 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -107.64 54.97 0.65 Allowed 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 175.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -44.71 -46.74 10.52 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.506 -0.77 . . . . 0.0 112.287 -177.09 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 910' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -44.97 95.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.809 0.338 . . . . 0.0 111.413 -177.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.82 -38.26 79.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.012 0.434 . . . . 0.0 110.462 -178.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 912' ' ' GLN . . . . . 0.648 ' O ' ' HG2' ' A' ' 916' ' ' GLU . 1.7 tt0 -60.81 -45.91 92.59 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.0 176.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -57.76 -35.27 70.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.305 178.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 61.7 m -68.72 -35.64 77.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.475 177.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 915' ' ' LEU . . . . . 0.488 ' HA ' HD22 ' A' ' 915' ' ' LEU . 0.3 OUTLIER -70.17 -32.69 70.75 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.055 0.455 . . . . 0.0 110.424 177.769 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 916' ' ' GLU . . . . . 0.648 ' HG2' ' O ' ' A' ' 912' ' ' GLN . 53.3 mm-40 -67.9 -38.72 83.32 Favored 'General case' 0 C--O 1.226 -0.178 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.651 176.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 50.06 24.66 1.45 Allowed 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.379 0.671 . . . . 0.0 112.755 176.55 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 918' ' ' GLY . . . . . 0.46 ' HA3' ' HB3' ' A' ' 891' ' ' ARG . . . -147.49 25.94 1.52 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.143 -177.502 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 919' ' ' MET . . . . . 0.828 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 2.1 mtt -118.18 -116.89 0.32 Allowed 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.614 0.245 . . . . 0.0 110.671 -175.234 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 920' ' ' ASP . . . . . 0.519 ' H ' ' HB3' ' A' ' 919' ' ' MET . 3.6 t70 175.56 -59.36 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.261 177.017 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 37.6 m -136.6 157.81 45.91 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.876 178.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 922' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -132.12 142.58 49.55 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.688 0.28 . . . . 0.0 111.031 -177.343 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 923' ' ' LEU . . . . . 0.635 HD12 ' HB ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -145.14 170.35 16.4 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 174.362 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 17.3 m -93.33 153.87 18.3 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 120.636 0.255 . . . . 0.0 111.13 -178.173 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 925' ' ' LYS . . . . . 0.588 ' HE3' ' HB3' ' A' ' 875' ' ' ASP . 0.0 OUTLIER -50.02 -49.2 76.34 Favored Pre-proline 0 CA--C 1.538 0.513 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 -178.64 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 926' ' ' PRO . . . . . 0.498 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 16.0 Cg_endo -58.15 103.03 0.14 Allowed 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 121.984 1.789 . . . . 0.0 111.714 174.558 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -125.73 154.72 34.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.709 -175.169 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 928' ' ' THR . . . . . 0.44 ' H ' HG12 ' A' ' 931' ' ' VAL . 0.8 OUTLIER -115.03 161.32 18.51 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.129 177.676 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 929' ' ' LEU . . . . . 0.452 HD23 ' HG2' ' A' ' 843' ' ' GLN . 0.6 OUTLIER -61.74 -42.24 98.71 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.849 0.357 . . . . 0.0 110.418 178.877 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -60.21 -50.01 75.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.275 -179.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 931' ' ' VAL . . . . . 0.44 HG12 ' H ' ' A' ' 928' ' ' THR . 1.4 p -71.65 -30.46 38.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-O 120.516 0.198 . . . . 0.0 111.254 -177.592 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 932' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -70.48 -38.42 73.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 177.723 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 933' ' ' LYS . . . . . 0.511 ' HA ' HD21 ' A' ' 847' ' ' LEU . 1.5 tmtm? -67.82 -42.16 81.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.02 176.163 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -48.96 79.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.929 179.383 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 11.9 m -63.72 -43.95 95.02 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.333 -179.239 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 936' ' ' LEU . . . . . 0.513 HD22 HD22 ' A' ' 847' ' ' LEU . 0.0 OUTLIER -62.22 -56.83 14.76 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.773 179.995 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 25.5 m -59.04 -48.23 82.35 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.708 -178.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.02 -45.97 86.04 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.353 -175.283 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 939' ' ' TYR . . . . . 0.451 ' HA ' ' HB3' ' A' ' 942' ' ' ARG . 0.6 OUTLIER -80.81 -31.48 35.59 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.696 -0.402 . . . . 0.0 111.524 -176.647 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -61.26 -43.75 98.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.94 0.4 . . . . 0.0 110.451 176.407 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 941' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.45 -34.59 70.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.341 177.736 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 942' ' ' ARG . . . . . 0.451 ' HB3' ' HA ' ' A' ' 939' ' ' TYR . 6.8 ttt85 -65.08 -48.06 75.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.979 -177.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 26.9 m -71.27 -30.76 41.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.799 0.333 . . . . 0.0 110.558 -178.412 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 19.5 mtp85 -71.38 -37.5 71.58 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.819 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.15 -23.95 35.31 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.683 0.278 . . . . 0.0 111.135 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 57.1 m -76.24 -28.54 57.18 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.192 0.52 . . . . 0.0 110.281 175.576 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 1.7 mtp180 -84.94 -19.52 32.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.571 173.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 27.7 t0 69.8 79.77 0.19 Allowed 'General case' 0 CA--C 1.521 -0.165 0 CA-C-N 114.587 -1.188 . . . . 0.0 110.843 -177.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.253 1.272 0 CA-C-O 117.68 -1.153 . . . . 0.0 109.148 176.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 1.9 ttp . . . . . 0 N--CA 1.478 0.944 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 143.02 -99.84 0.23 Allowed Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.957 -0.64 . . . . 0.0 111.802 -179.165 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 698' ' ' GLY . . . . . 0.46 ' O ' HG22 ' A' ' 701' ' ' VAL . . . 84.57 -64.9 4.18 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.942 -0.647 . . . . 0.0 112.812 179.03 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.93 119.82 11.99 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.805 0.336 . . . . 0.0 110.705 -179.26 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . 135.49 -24.28 3.37 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.349 -178.533 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . 0.46 HG22 ' O ' ' A' ' 698' ' ' GLY . 35.5 m -87.27 -169.61 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.649 0.262 . . . . 0.0 110.976 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -58.45 129.13 40.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.38 177.565 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 703' ' ' GLY . . . . . 0.537 ' HA2' ' SD ' ' A' ' 803' ' ' MET . . . -85.24 132.71 11.27 Favored Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.804 -175.878 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.894 HD13 ' HA ' ' A' ' 801' ' ' ILE . 5.7 tp 53.74 -100.2 0.1 Allowed 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 123.392 0.677 . . . . 0.0 112.432 175.054 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 705' ' ' SER . . . . . 0.505 ' HA ' ' HA3' ' A' ' 730' ' ' GLY . 2.6 m 69.95 160.05 0.2 Allowed 'General case' 0 CA--C 1.533 0.325 0 O-C-N 123.818 0.699 . . . . 0.0 111.846 -176.332 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 100.1 -23.09 37.29 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.872 -0.68 . . . . 0.0 113.098 174.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 17.4 mmtt -82.3 153.0 26.06 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 122.803 -0.234 . . . . 0.0 110.438 -179.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 708' ' ' ARG . . . . . 0.487 ' HG2' HG13 ' A' ' 732' ' ' VAL . 0.0 OUTLIER -103.38 159.42 15.58 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.871 0.367 . . . . 0.0 110.863 -176.828 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 709' ' ' CYS . . . . . 0.495 ' HB2' HG22 ' A' ' 731' ' ' ILE . 0.0 OUTLIER -142.44 119.54 11.4 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.635 175.049 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 710' ' ' TRP . . . . . . . . . . . . . 86.5 m95 -98.21 123.57 42.35 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.894 0.378 . . . . 0.0 110.047 -179.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 711' ' ' LEU . . . . . 0.507 ' O ' ' HG ' ' A' ' 711' ' ' LEU . 0.6 OUTLIER -119.99 123.33 43.22 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 121.527 0.679 . . . . 0.0 110.899 -179.164 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -105.82 32.73 4.16 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.111 175.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 713' ' ' VAL . . . . . 0.766 HG13 ' HB2' ' A' ' 750' ' ' ASP . 4.0 t -79.53 102.28 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.894 179.173 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 714' ' ' ARG . . . . . 0.537 ' H ' ' HB3' ' A' ' 750' ' ' ASP . 2.9 mtp180 -73.35 -18.28 61.2 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.682 -178.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -77.36 111.1 12.67 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.591 -0.732 . . . . 0.0 109.789 176.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 716' ' ' ALA . . . . . 0.572 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -63.61 -37.85 88.9 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.769 0.285 . . . . 0.0 111.769 -173.579 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.89 -47.31 75.27 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.008 0.432 . . . . 0.0 110.372 179.64 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 718' ' ' LEU . . . . . 0.49 HD11 ' HA ' ' A' ' 786' ' ' ALA . 0.2 OUTLIER -69.22 -43.54 73.88 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.198 179.229 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 719' ' ' CYS . . . . . 0.572 ' SG ' ' HA ' ' A' ' 716' ' ' ALA . 2.5 p -65.5 -46.54 79.28 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.094 -176.263 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 720' ' ' GLN . . . . . 0.407 ' N ' ' SG ' ' A' ' 719' ' ' CYS . 2.0 tt0 -61.66 -43.32 99.07 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 121.041 -0.263 . . . . 0.0 110.692 -179.73 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -59.53 -57.65 12.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.029 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 9.5 mt -56.73 -46.1 81.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.078 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 723' ' ' GLU . . . . . 0.546 ' HA ' HG11 ' A' ' 733' ' ' VAL . 0.0 OUTLIER -59.85 -40.42 88.48 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.861 -177.264 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 724' ' ' THR . . . . . 0.418 ' HA ' ' HG2' ' A' ' 727' ' ' GLN . 9.6 m -67.55 -43.28 81.07 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.793 0.33 . . . . 0.0 111.071 -179.223 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 48.7 m -64.2 -32.92 74.69 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.657 -179.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 726' ' ' LEU . . . . . . . . . . . . . 3.5 mt -82.15 -45.79 14.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.576 -178.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 727' ' ' GLN . . . . . 0.437 HE21 ' HG3' ' A' ' 723' ' ' GLU . 14.8 pt20 -64.95 -22.23 66.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.698 0.285 . . . . 0.0 111.343 -177.43 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 1.7 ptt-85 -65.61 -21.88 66.62 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.109 0.481 . . . . 0.0 110.629 177.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 3.2 m -100.98 16.13 26.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.15 0.5 . . . . 0.0 110.727 178.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 730' ' ' GLY . . . . . 0.505 ' HA3' ' HA ' ' A' ' 705' ' ' SER . . . 83.74 14.88 71.93 Favored Glycine 0 N--CA 1.449 -0.451 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.921 176.333 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 731' ' ' ILE . . . . . 0.495 HG22 ' HB2' ' A' ' 709' ' ' CYS . 8.0 mm -95.37 105.28 16.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-O 120.841 0.353 . . . . 0.0 110.114 179.491 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 732' ' ' VAL . . . . . 0.487 HG13 ' HG2' ' A' ' 708' ' ' ARG . 1.1 p -69.07 110.14 2.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.684 0.754 . . . . 0.0 110.555 -177.061 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 733' ' ' VAL . . . . . 0.546 HG11 ' HA ' ' A' ' 723' ' ' GLU . 0.1 OUTLIER -87.47 134.63 27.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.755 -178.138 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -138.72 139.15 38.27 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.555 -178.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 1.9 m -69.12 123.49 21.24 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.641 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 33.1 t80 -84.66 101.75 12.41 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.886 -178.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.2 -50.46 4.13 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.841 176.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -169.6 42.9 0.21 Allowed Glycine 0 N--CA 1.447 -0.592 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.352 178.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 13.9 mp0 -86.39 175.1 8.58 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.731 0.301 . . . . 0.0 110.871 -177.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.38 146.16 50.04 Favored Pre-proline 0 C--N 1.325 -0.496 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.001 -176.508 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 741' ' ' PRO . . . . . 0.535 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 85.3 Cg_endo -83.82 146.91 11.92 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 122.809 2.339 . . . . 0.0 112.731 178.365 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 742' ' ' THR . . . . . 0.694 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.2 OUTLIER -133.18 141.91 42.49 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.407 178.538 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 743' ' ' PRO . . . . . 0.694 ' HD2' HG22 ' A' ' 742' ' ' THR . 38.2 Cg_endo -66.57 -9.23 23.53 Favored 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 123.025 2.483 . . . . 0.0 113.447 -178.649 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -107.21 -3.55 19.69 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.963 0.411 . . . . 0.0 110.456 176.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -102.36 144.12 31.25 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.847 -174.221 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 746' ' ' VAL . . . . . . . . . . . . . 3.4 p -114.9 139.49 40.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.44 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 747' ' ' LEU . . . . . 0.504 HD12 ' HB2' ' A' ' 757' ' ' TRP . 0.1 OUTLIER -104.17 110.7 23.0 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.28 177.893 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -97.26 107.53 20.12 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 176.388 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 749' ' ' THR . . . . . 0.401 HG21 HG11 ' A' ' 753' ' ' VAL . 17.6 p -104.56 148.57 26.35 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.001 0.429 . . . . 0.0 111.735 -172.715 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 750' ' ' ASP . . . . . 0.766 ' HB2' HG13 ' A' ' 713' ' ' VAL . 2.9 t70 -96.52 108.78 21.41 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 170.389 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 751' ' ' GLU . . . . . 0.476 ' HB3' ' H ' ' A' ' 752' ' ' VAL . 18.2 mm-40 62.93 -147.3 0.36 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.238 -174.757 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 752' ' ' VAL . . . . . 0.476 ' H ' ' HB3' ' A' ' 751' ' ' GLU . 2.1 t -79.86 133.78 28.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.758 -174.367 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 753' ' ' VAL . . . . . 0.401 HG11 HG21 ' A' ' 749' ' ' THR . 11.3 p -117.97 141.32 37.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.417 178.291 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.67 53.31 2.72 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.225 -178.804 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -157.85 131.76 8.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.422 -179.193 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 756' ' ' LYS . . . . . 0.487 ' HA ' ' HD2' ' A' ' 756' ' ' LYS . 0.1 OUTLIER -91.01 81.9 5.61 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.229 0.537 . . . . 0.0 110.114 177.869 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 757' ' ' TRP . . . . . 0.535 ' CH2' ' HA ' ' A' ' 741' ' ' PRO . 64.3 t-105 -65.24 124.57 22.53 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.604 178.304 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -131.49 62.56 1.62 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.206 0.527 . . . . 0.0 110.227 176.394 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 759' ' ' GLY . . . . . . . . . . . . . . . -109.8 -118.98 4.07 Favored Glycine 0 N--CA 1.444 -0.783 0 C-N-CA 120.786 -0.721 . . . . 0.0 111.565 178.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -78.45 -49.66 13.05 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.078 0.466 . . . . 0.0 110.102 177.145 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -168.16 164.64 13.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.533 179.425 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 2.5 p -141.1 126.66 19.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.453 175.195 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 763' ' ' VAL . . . . . 0.408 HG11 HD13 ' A' ' 791' ' ' LEU . 3.6 t -119.52 114.7 45.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.631 -176.308 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 764' ' ' THR . . . . . . . . . . . . . 23.7 m -95.45 113.29 24.93 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.226 -179.114 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 765' ' ' PHE . . . . . 0.443 ' HA ' ' O ' ' A' ' 783' ' ' HIS . 30.4 m-85 -84.85 109.3 18.0 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 174.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 766' ' ' CYS . . . . . 0.564 ' O ' ' HA ' ' A' ' 784' ' ' SER . 0.0 OUTLIER -96.48 153.9 17.58 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.911 -174.075 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 11.9 ptt85 -140.39 -37.98 0.45 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.123 176.231 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.26 34.52 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -179.313 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . 0.438 ' HB2' ' CD ' ' A' ' 751' ' ' GLU . 0.1 OUTLIER -135.65 -71.41 0.47 Allowed 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 110.089 -0.337 . . . . 0.0 110.089 174.016 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 3.9 mt 64.09 101.19 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.403 176.264 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 771' ' ' GLY . . . . . 0.452 ' N ' HG22 ' A' ' 752' ' ' VAL . . . -125.13 -4.92 6.95 Favored Glycine 0 N--CA 1.451 -0.306 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.014 176.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 772' ' ' ILE . . . . . 0.434 HG23 ' HD2' ' A' ' 773' ' ' PRO . 1.1 mp -104.33 146.45 32.62 Favored Pre-proline 0 C--N 1.325 -0.461 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 178.266 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 773' ' ' PRO . . . . . 0.519 ' HB2' ' H ' ' A' ' 774' ' ' LEU . 32.8 Cg_exo -60.01 -100.77 0.0 OUTLIER 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.932 2.421 . . . . 0.0 112.627 179.387 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . 0.877 ' HA ' HG13 ' A' ' 782' ' ' VAL . 0.4 OUTLIER 172.49 -167.52 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -179.582 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 775' ' ' GLU . . . . . 0.671 ' HG3' ' HA ' ' A' ' 781' ' ' TRP . 1.5 mp0 -61.42 69.24 0.01 OUTLIER 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.824 0.821 . . . . 0.0 112.393 173.455 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.04 6.02 2.36 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 114.573 -1.194 . . . . 0.0 108.771 173.441 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 777' ' ' ALA . . . . . 0.626 ' HB3' ' HB2' ' A' ' 780' ' ' GLU . . . -127.72 162.49 48.97 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-N 114.745 -1.116 . . . . 0.0 109.409 -179.625 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 778' ' ' PRO . . . . . 0.557 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 55.6 Cg_endo -68.99 66.67 1.31 Allowed 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 122.977 2.451 . . . . 0.0 113.474 -177.196 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 118.48 31.23 1.54 Allowed Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.631 178.038 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 780' ' ' GLU . . . . . 0.626 ' HB2' ' HB3' ' A' ' 777' ' ' ALA . 1.4 tt0 -115.29 129.04 56.5 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 178.445 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 781' ' ' TRP . . . . . 0.671 ' HA ' ' HG3' ' A' ' 775' ' ' GLU . 26.6 m95 -134.3 144.58 48.4 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 -179.356 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . 0.877 HG13 ' HA ' ' A' ' 774' ' ' LEU . 10.7 m -134.55 151.76 32.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 120.834 0.35 . . . . 0.0 110.63 172.613 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 783' ' ' HIS . . . . . 0.443 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.3 OUTLIER -162.98 121.88 2.12 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.664 176.362 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 784' ' ' SER . . . . . 0.564 ' HA ' ' O ' ' A' ' 766' ' ' CYS . 0.3 OUTLIER -88.65 100.91 13.47 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.582 177.274 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 785' ' ' VAL . . . . . 0.893 HG13 ' H ' ' A' ' 787' ' ' ALA . 2.0 p 178.55 170.34 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.158 -0.473 . . . . 0.0 109.893 -173.501 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 786' ' ' ALA . . . . . 0.49 ' HA ' HD11 ' A' ' 718' ' ' LEU . . . -103.59 32.23 3.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.575 0.226 . . . . 0.0 111.265 179.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 787' ' ' ALA . . . . . 0.893 ' H ' HG13 ' A' ' 785' ' ' VAL . . . 57.2 70.45 1.36 Allowed Pre-proline 0 N--CA 1.468 0.43 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.145 177.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 788' ' ' PRO . . . . . 0.615 ' HD2' ' OE1' ' A' ' 790' ' ' GLU . 24.2 Cg_exo -63.29 -50.15 3.9 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.727 2.284 . . . . 0.0 112.534 -178.213 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 6.5 p-80 -177.12 -29.5 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -178.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 790' ' ' GLU . . . . . 0.615 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -74.22 -50.38 19.37 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 111.833 0.308 . . . . 0.0 111.833 -171.105 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 791' ' ' LEU . . . . . 0.487 ' N ' ' HD2' ' A' ' 792' ' ' PRO . 0.2 OUTLIER -65.4 -47.47 69.44 Favored Pre-proline 0 CA--C 1.538 0.503 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -176.81 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 792' ' ' PRO . . . . . 0.487 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 9.2 Cg_endo -58.35 -32.01 95.15 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 121.254 1.302 . . . . 0.0 112.03 174.013 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -70.45 -37.0 74.26 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 120.83 0.347 . . . . 0.0 110.749 177.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 794' ' ' LEU . . . . . 0.413 HD13 ' HG2' ' A' ' 797' ' ' ARG . 0.1 OUTLIER -61.51 -42.26 98.55 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.021 176.016 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 795' ' ' LEU . . . . . 0.438 HD22 ' HA ' ' A' ' 795' ' ' LEU . 0.1 OUTLIER -59.66 -42.56 93.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.395 178.354 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -64.76 -37.64 88.27 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.002 178.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 797' ' ' ARG . . . . . 0.413 ' HG2' HD13 ' A' ' 794' ' ' LEU . 0.0 OUTLIER -70.3 -26.5 63.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.393 179.075 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -69.12 -36.45 73.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.35 0.595 . . . . 0.0 109.915 177.137 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -77.34 -18.53 57.35 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.195 177.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 800' ' ' LEU . . . . . 0.718 ' HB3' ' HG2' ' A' ' 802' ' ' GLU . 2.9 tp 73.02 -41.04 0.49 Allowed 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 124.244 1.018 . . . . 0.0 112.904 175.455 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 801' ' ' ILE . . . . . 0.894 ' HA ' HD13 ' A' ' 704' ' ' LEU . 2.2 mt 55.57 56.97 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.903 0.859 . . . . 0.0 110.159 -175.454 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 802' ' ' GLU . . . . . 0.718 ' HG2' ' HB3' ' A' ' 800' ' ' LEU . 0.0 OUTLIER -79.85 -0.41 34.6 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.81 -177.572 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 803' ' ' MET . . . . . 0.537 ' SD ' ' HA2' ' A' ' 703' ' ' GLY . 45.5 mmm 67.31 161.56 0.17 Allowed 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.432 -0.804 . . . . 0.0 112.109 179.079 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 804' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -115.79 -163.7 0.91 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.803 -178.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -88.57 172.83 9.02 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.574 -179.673 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 20.4 t0 -77.19 88.03 3.65 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 177.252 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -56.18 117.66 17.39 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.585 -176.157 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 808' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -65.73 118.8 5.79 Favored 'Trans proline' 0 C--O 1.235 0.329 0 C-N-CA 122.71 2.273 . . . . 0.0 111.749 177.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -73.87 165.27 25.43 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.075 -179.303 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -97.59 84.15 3.35 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.476 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -92.85 140.95 28.97 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.029 177.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.09 137.01 40.4 Favored Pre-proline 0 C--N 1.323 -0.572 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.252 -176.337 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -85.14 -150.39 0.04 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 122.83 2.353 . . . . 0.0 111.059 171.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 6.5 m -69.14 93.7 0.62 Allowed 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 121.311 0.576 . . . . 0.0 109.927 177.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -95.67 170.38 9.37 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.677 -177.112 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.23 121.55 15.92 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 178.154 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 817' ' ' LYS . . . . . 0.443 ' HD3' ' HA ' ' A' ' 817' ' ' LYS . 9.0 mmtp -69.01 -38.47 79.26 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.786 -176.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -136.85 155.98 49.08 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.162 177.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 2.8 t -94.95 142.11 14.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 175.172 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -50.76 148.11 4.3 Favored 'General case' 0 C--O 1.241 0.615 0 O-C-N 123.602 0.563 . . . . 0.0 112.061 -176.571 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 20.0 p-10 -74.18 61.59 0.87 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.479 178.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -77.82 56.57 1.55 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.438 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -101.41 109.61 21.47 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.224 -0.898 . . . . 0.0 108.999 177.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -112.99 -68.79 0.9 Allowed 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.353 -178.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 17.5 ttm -109.8 108.25 18.51 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.734 178.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 826' ' ' MET . . . . . 0.404 ' O ' HG23 ' A' ' 869' ' ' ILE . 0.5 OUTLIER -95.72 108.79 21.13 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.19 0.519 . . . . 0.0 110.139 -179.346 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 827' ' ' ILE . . . . . . . . . . . . . 1.6 mt -110.32 125.65 67.57 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.299 179.112 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 828' ' ' LEU . . . . . 0.519 HD23 ' HB3' ' A' ' 852' ' ' LYS . 1.7 tm? -94.9 123.09 38.17 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.859 -178.126 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -117.93 118.03 56.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.05 0.452 . . . . 0.0 110.651 179.704 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 830' ' ' VAL . . . . . 0.817 HG23 ' HA ' ' A' ' 874' ' ' SER . 0.0 OUTLIER -119.52 84.92 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.498 178.497 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 831' ' ' ASP . . . . . 0.918 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 27.1 t0 -95.28 120.62 35.82 Favored 'General case' 0 CA--C 1.515 -0.39 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 -179.685 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 832' ' ' ASP . . . . . 0.474 ' OD2' ' HB2' ' A' ' 877' ' ' ASN . 0.0 OUTLIER -52.69 -27.49 17.68 Favored 'General case' 0 CA--C 1.537 0.466 0 O-C-N 123.482 0.489 . . . . 0.0 112.187 -177.582 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 833' ' ' HIS . . . . . 0.441 ' HA ' ' HD2' ' A' ' 834' ' ' PRO . 0.5 OUTLIER -98.43 109.56 53.09 Favored Pre-proline 0 C--N 1.325 -0.471 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 -177.99 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 834' ' ' PRO . . . . . 0.441 ' HD2' ' HA ' ' A' ' 833' ' ' HIS . 9.5 Cg_endo -51.59 -44.18 45.77 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 123.443 2.762 . . . . 0.0 113.445 -175.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 835' ' ' ILE . . . . . 0.47 ' HA ' HD13 ' A' ' 835' ' ' ILE . 0.2 OUTLIER -68.32 -39.17 80.56 Favored 'Isoleucine or valine' 0 C--O 1.237 0.415 0 CA-C-O 120.754 0.311 . . . . 0.0 110.972 -177.222 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 836' ' ' ASN . . . . . 0.565 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 1.5 t30 -73.55 -39.83 64.42 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 179.618 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 837' ' ' ARG . . . . . 0.918 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 1.5 ttt180 -53.85 -42.62 68.74 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.171 176.473 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.56 -43.52 89.6 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.839 178.841 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.38 -48.17 71.0 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.143 -172.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 840' ' ' LEU . . . . . 0.565 ' HG ' ' O ' ' A' ' 836' ' ' ASN . 0.3 OUTLIER -74.38 -27.27 60.58 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.502 -0.479 . . . . 0.0 111.016 -179.072 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -68.88 -29.9 68.29 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.138 0.494 . . . . 0.0 109.848 175.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -64.77 -42.55 95.02 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.729 174.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 843' ' ' GLN . . . . . 0.584 ' HG2' HD23 ' A' ' 929' ' ' LEU . 41.5 mt-30 -62.75 -45.49 92.47 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.267 175.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 844' ' ' LEU . . . . . 0.613 HD12 HD11 ' A' ' 932' ' ' ILE . 0.1 OUTLIER -58.24 -46.16 86.43 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.244 179.008 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -64.15 -39.75 97.43 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 121.09 -0.576 . . . . 0.0 112.365 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 5.8 m -67.26 -23.44 65.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.884 0.373 . . . . 0.0 110.959 179.101 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 81.4 mt -75.13 -21.43 58.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.927 0.394 . . . . 0.0 110.455 177.445 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 106.62 3.7 37.28 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.618 177.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 849' ' ' TYR . . . . . 0.584 ' HB2' HD23 ' A' ' 844' ' ' LEU . 39.2 m-85 -95.55 140.4 30.45 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.936 0.398 . . . . 0.0 110.753 -178.305 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 5.3 mp0 -76.43 115.66 16.38 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.066 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 851' ' ' CYS . . . . . 0.471 ' HB3' HD22 ' A' ' 844' ' ' LEU . 0.0 OUTLIER -107.97 135.51 49.23 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.774 -175.32 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 852' ' ' LYS . . . . . 0.519 ' HB3' HD23 ' A' ' 828' ' ' LEU . 0.0 OUTLIER -107.17 110.74 22.89 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 173.463 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 853' ' ' THR . . . . . 0.616 HG22 ' HG3' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -90.69 121.55 32.69 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.991 -0.55 . . . . 0.0 112.479 -171.563 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 854' ' ' ALA . . . . . 0.462 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -147.97 171.27 16.07 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.062 174.688 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 13.9 p-10 -144.95 75.8 1.46 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.754 0.788 . . . . 0.0 111.258 178.142 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 856' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -171.41 136.1 0.98 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.49 177.323 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -66.69 -41.44 93.83 Favored Glycine 0 N--CA 1.448 -0.512 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.895 -178.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 858' ' ' VAL . . . . . 0.404 ' H ' HG23 ' A' ' 858' ' ' VAL . 1.5 t -74.29 -36.24 42.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.645 0.26 . . . . 0.0 111.285 -177.418 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -63.18 -23.95 67.66 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.847 0.356 . . . . 0.0 111.196 -179.194 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -61.82 -35.61 78.73 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.151 0.5 . . . . 0.0 110.347 176.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 861' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.05 -35.8 61.87 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.478 177.074 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -63.01 -49.32 75.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.528 179.106 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 6.5 p -66.13 -31.3 53.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.941 178.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 864' ' ' LEU . . . . . 0.662 ' HG ' HD11 ' A' ' 895' ' ' LEU . 0.7 OUTLIER -59.55 -40.77 88.37 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.061 0.458 . . . . 0.0 110.327 175.041 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 1.5 m -79.27 -30.22 42.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.99 -179.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.44 -60.53 2.37 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.309 0.576 . . . . 0.0 110.773 178.489 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 867' ' ' ASN . . . . . 0.452 ' HB3' ' H ' ' A' ' 868' ' ' HIS . 1.4 t-20 -104.95 -119.44 0.22 Allowed 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 177.914 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 868' ' ' HIS . . . . . 0.452 ' H ' ' HB3' ' A' ' 867' ' ' ASN . 0.1 OUTLIER -163.8 -45.58 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 110.499 -0.186 . . . . 0.0 110.499 173.183 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 869' ' ' ILE . . . . . 0.447 ' HB ' ' O ' ' A' ' 868' ' ' HIS . 2.7 mp 73.32 146.93 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 O-C-N 123.613 0.571 . . . . 0.0 111.293 174.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 65.2 m-20 -85.54 -49.97 7.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.204 0.526 . . . . 0.0 110.672 -179.491 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 871' ' ' ILE . . . . . 0.69 HG12 ' HD2' ' A' ' 939' ' ' TYR . 0.8 OUTLIER -135.42 133.64 52.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.936 -0.575 . . . . 0.0 109.905 -179.729 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 872' ' ' VAL . . . . . 0.43 HG13 HD12 ' A' ' 828' ' ' LEU . 64.6 t -115.87 127.94 73.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.592 -178.315 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 873' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -120.14 115.07 22.93 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.144 0.497 . . . . 0.0 110.196 175.298 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 874' ' ' SER . . . . . 0.817 ' HA ' HG23 ' A' ' 830' ' ' VAL . 0.3 OUTLIER -100.19 125.93 46.4 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.162 179.364 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 875' ' ' ASP . . . . . 0.732 ' HB3' ' HA ' ' A' ' 831' ' ' ASP . 1.2 t70 -109.6 123.89 50.22 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.336 0.588 . . . . 0.0 111.012 -179.291 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 876' ' ' VAL . . . . . 0.421 HG23 HG23 ' A' ' 903' ' ' THR . 0.1 OUTLIER -116.29 94.56 3.18 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.285 177.827 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 877' ' ' ASN . . . . . 0.474 ' HB2' ' OD2' ' A' ' 832' ' ' ASP . 68.6 m-80 -63.11 -27.18 69.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.792 174.28 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 878' ' ' MET . . . . . 0.527 ' SD ' ' HB3' ' A' ' 880' ' ' ASN . 0.0 OUTLIER -120.74 104.65 41.88 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.447 174.893 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 879' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -70.4 -13.75 33.38 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.885 2.39 . . . . 0.0 112.731 -177.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 880' ' ' ASN . . . . . 0.527 ' HB3' ' SD ' ' A' ' 878' ' ' MET . 21.7 t30 -75.18 127.05 32.3 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.092 -178.542 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 20.4 ttp 73.25 -65.67 0.34 Allowed 'General case' 0 N--CA 1.467 0.375 0 O-C-N 123.914 0.759 . . . . 0.0 111.708 175.21 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 882' ' ' ASP . . . . . 0.402 ' C ' ' H ' ' A' ' 884' ' ' TYR . 0.4 OUTLIER -70.81 -34.11 71.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.586 0.231 . . . . 0.0 110.572 -177.129 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -77.3 40.89 1.77 Allowed Glycine 0 C--N 1.331 0.264 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.017 176.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 884' ' ' TYR . . . . . 0.402 ' H ' ' C ' ' A' ' 882' ' ' ASP . 8.7 t80 -160.78 -49.01 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 179.453 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -61.6 -46.48 89.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.877 179.436 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.93 -43.9 82.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.72 -178.031 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.23 -47.2 83.5 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.242 -179.021 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -59.41 -44.21 92.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.11 -179.314 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -70.13 -38.28 75.52 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.298 -177.518 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 890' ' ' ILE . . . . . 0.702 HG23 HD13 ' A' ' 895' ' ' LEU . 9.8 mt -59.63 -49.21 84.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.041 0.448 . . . . 0.0 110.985 -179.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 891' ' ' ARG . . . . . . . . . . . . . 35.9 ptt85 -75.69 -23.67 56.18 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.102 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.25 -44.66 94.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.158 176.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.15 -31.06 64.04 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.943 174.55 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 90.7 66.64 1.18 Allowed Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.25 177.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 895' ' ' LEU . . . . . 0.702 HD13 HG23 ' A' ' 890' ' ' ILE . 0.1 OUTLIER -65.78 111.54 3.29 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 110.016 -0.365 . . . . 0.0 110.016 177.889 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.63 -11.99 54.86 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.755 -175.668 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 897' ' ' LEU . . . . . 0.599 HD11 HD21 ' A' ' 864' ' ' LEU . 0.0 OUTLIER -92.64 148.03 35.37 Favored Pre-proline 0 C--N 1.323 -0.548 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.403 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -60.08 128.62 27.11 Favored 'Trans proline' 0 C--O 1.239 0.552 0 C-N-CA 122.844 2.363 . . . . 0.0 112.731 -177.274 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 899' ' ' VAL . . . . . 0.695 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 1.8 t -111.56 129.55 66.73 Favored 'Isoleucine or valine' 0 C--O 1.236 0.387 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.922 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 900' ' ' ILE . . . . . 0.505 HG12 ' CE2' ' A' ' 939' ' ' TYR . 0.0 OUTLIER -107.57 111.31 35.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.096 176.978 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -97.0 105.97 3.28 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.14 -177.201 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 902' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -93.32 130.41 42.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 177.611 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 903' ' ' THR . . . . . 0.642 HG21 ' HG2' ' A' ' 909' ' ' GLU . 0.2 OUTLIER -123.46 138.36 54.6 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.199 -178.431 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 904' ' ' ALA . . . . . 0.829 ' HA ' ' HB2' ' A' ' 925' ' ' LYS . . . -79.08 117.26 19.97 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.973 176.799 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 61.73 54.93 2.81 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-O 121.327 0.584 . . . . 0.0 110.323 -178.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 906' ' ' ALA . . . . . 0.485 ' HB1' ' HB2' ' A' ' 909' ' ' GLU . . . -69.94 85.23 0.51 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.465 178.732 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 907' ' ' LEU . . . . . 0.464 HD13 ' HA ' ' A' ' 907' ' ' LEU . 0.8 OUTLIER -83.91 -41.1 17.75 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.891 -178.979 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -127.7 4.02 6.1 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-O 121.412 0.625 . . . . 0.0 110.472 -178.378 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 909' ' ' GLU . . . . . 0.642 ' HG2' HG21 ' A' ' 903' ' ' THR . 5.7 mp0 -69.7 -17.01 63.44 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.794 -173.136 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 910' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.11 -37.8 84.51 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.14 0.495 . . . . 0.0 109.921 176.393 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.07 -34.42 66.24 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.806 177.186 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 6.4 mm100 -65.06 -36.82 85.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.483 177.036 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -62.34 -41.45 98.59 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.454 177.182 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 58.8 m -70.89 -31.15 67.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.748 178.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 915' ' ' LEU . . . . . 0.419 HD12 ' HA ' ' A' ' 915' ' ' LEU . 2.9 tp -70.67 -52.12 23.2 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.065 -179.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -74.18 -44.76 52.2 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.336 -177.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 51.22 46.6 26.22 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.336 -175.546 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -115.89 24.86 9.86 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.785 -177.127 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 919' ' ' MET . . . . . 0.695 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -141.15 -94.71 0.14 Allowed 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.955 -0.298 . . . . 0.0 110.878 -177.876 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 920' ' ' ASP . . . . . 0.489 ' H ' ' CG ' ' A' ' 919' ' ' MET . 29.7 t70 171.42 -57.2 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 123.934 0.894 . . . . 0.0 108.656 176.176 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -133.17 163.13 29.96 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.517 176.046 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 922' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -123.94 136.63 54.45 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.412 176.466 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 923' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -123.45 173.45 8.0 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.554 -179.094 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 924' ' ' SER . . . . . 0.812 ' HB2' ' HD2' ' A' ' 926' ' ' PRO . 0.4 OUTLIER -95.11 158.77 15.32 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.336 179.709 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 925' ' ' LYS . . . . . 0.829 ' HB2' ' HA ' ' A' ' 904' ' ' ALA . 0.0 OUTLIER -60.34 -46.95 97.64 Favored Pre-proline 0 CA--C 1.538 0.516 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.544 173.537 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 926' ' ' PRO . . . . . 0.812 ' HD2' ' HB2' ' A' ' 924' ' ' SER . 52.8 Cg_exo -58.05 88.82 0.05 OUTLIER 'Trans proline' 0 C--N 1.36 1.142 0 C-N-CA 122.161 1.907 . . . . 0.0 112.552 174.122 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 12.6 t -128.56 114.62 34.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.225 177.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.74 -177.08 3.37 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.83 -179.088 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 929' ' ' LEU . . . . . 0.584 HD23 ' HG2' ' A' ' 843' ' ' GLN . 1.0 OUTLIER -54.07 -45.75 71.81 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 111.917 0.339 . . . . 0.0 111.917 -175.994 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.98 -36.19 81.62 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.131 0.491 . . . . 0.0 110.669 -177.499 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 69.2 t -76.01 -43.0 38.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.588 -175.249 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 932' ' ' ILE . . . . . 0.613 HD11 HD12 ' A' ' 844' ' ' LEU . 15.4 tt -63.01 -38.95 83.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 178.524 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 2.2 tmmt? -65.12 -48.42 73.68 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.407 178.179 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -59.26 -49.33 78.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.328 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 17.6 m -64.92 -44.02 90.91 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.526 -178.394 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 936' ' ' LEU . . . . . 0.496 HD21 ' HG ' ' A' ' 844' ' ' LEU . 0.8 OUTLIER -62.62 -43.33 99.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.452 179.7 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 937' ' ' THR . . . . . 0.421 ' O ' ' HG2' ' A' ' 941' ' ' GLU . 27.5 m -68.34 -36.25 78.97 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.208 -179.776 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 3.5 tp -64.55 -35.42 80.93 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.956 0.408 . . . . 0.0 110.748 178.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 939' ' ' TYR . . . . . 0.69 ' HD2' HG12 ' A' ' 871' ' ' ILE . 1.1 m-85 -79.17 -36.6 40.06 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.732 178.72 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -64.91 -41.6 95.44 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.928 179.211 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 941' ' ' GLU . . . . . 0.421 ' HG2' ' O ' ' A' ' 937' ' ' THR . 9.7 pt-20 -69.06 -36.07 77.26 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.159 -0.312 . . . . 0.0 110.159 177.518 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 942' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -49.17 78.48 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.801 179.093 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 30.9 m -72.38 -30.61 35.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 C-N-CA 120.821 -0.351 . . . . 0.0 110.717 179.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 1.9 ttt-85 -63.56 -50.34 69.89 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.895 179.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.07 -19.89 61.08 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.856 0.36 . . . . 0.0 111.278 -178.141 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 17.6 m -81.37 -24.84 36.76 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.061 0.457 . . . . 0.0 110.416 175.6 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -84.05 -53.51 5.49 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.2 0.524 . . . . 0.0 110.443 178.502 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -141.45 145.01 34.73 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.659 -174.73 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 71.4 m . . . . . 0 C--O 1.247 0.921 0 CA-C-O 118.786 -0.625 . . . . 0.0 109.369 176.628 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.48 1.043 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 84.38 -100.19 2.33 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.556 -0.83 . . . . 0.0 111.066 -175.486 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . 121.21 -32.01 4.88 Favored Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.675 175.211 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.43 138.64 47.27 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.034 0.445 . . . . 0.0 110.728 179.707 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . 179.2 150.52 9.02 Favored Glycine 0 N--CA 1.445 -0.749 0 N-CA-C 110.894 -0.882 . . . . 0.0 110.894 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 2.6 t 54.19 53.51 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-O 121.529 0.681 . . . . 0.0 110.196 -177.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -83.08 -12.49 57.07 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.933 -178.422 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . 162.9 -48.97 0.32 Allowed Glycine 0 N--CA 1.448 -0.561 0 CA-C-N 115.866 -0.607 . . . . 0.0 111.806 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 20.0 mt -104.58 -177.92 3.51 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 178.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 59.97 34.48 21.52 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 121.1 0.476 . . . . 0.0 110.995 -178.286 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . -173.31 19.51 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.951 -0.643 . . . . 0.0 112.159 -179.787 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 8.6 mmtm -121.45 145.59 47.77 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 178.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 708' ' ' ARG . . . . . 0.523 ' HG2' HG13 ' A' ' 732' ' ' VAL . 24.3 mtm180 -102.13 161.77 13.43 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.372 0.605 . . . . 0.0 110.685 -178.549 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 1.6 m -135.77 110.5 8.68 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.241 -0.891 . . . . 0.0 108.822 170.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 710' ' ' TRP . . . . . 0.51 ' CZ3' ' HB ' ' A' ' 734' ' ' THR . 97.2 m95 -90.53 103.77 16.43 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.951 -175.489 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 711' ' ' LEU . . . . . 0.525 ' O ' ' HG ' ' A' ' 711' ' ' LEU . 0.8 OUTLIER -102.3 120.48 40.56 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 121.596 0.713 . . . . 0.0 110.655 -177.969 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -104.29 43.46 1.1 Allowed 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.355 -0.839 . . . . 0.0 108.926 175.018 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 713' ' ' VAL . . . . . 0.746 ' HA ' ' CB ' ' A' ' 750' ' ' ASP . 16.4 t -101.42 124.18 54.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.426 -177.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 5.5 mtm-85 -108.43 0.57 21.12 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.404 0.621 . . . . 0.0 110.115 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -82.09 111.11 17.93 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.436 173.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -54.46 -55.03 33.09 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -171.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 717' ' ' SER . . . . . 0.417 ' O ' ' HB2' ' A' ' 721' ' ' PHE . 0.3 OUTLIER -60.4 -36.97 79.37 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.174 0.511 . . . . 0.0 110.926 -178.66 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 718' ' ' LEU . . . . . 0.594 ' HG ' ' HB2' ' A' ' 787' ' ' ALA . 0.9 OUTLIER -73.97 -49.81 22.82 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.206 -177.547 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 719' ' ' CYS . . . . . 0.452 ' O ' ' HB3' ' A' ' 723' ' ' GLU . 19.7 p -67.7 -44.09 78.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.622 -176.393 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.6 -43.65 98.47 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.101 -179.035 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 721' ' ' PHE . . . . . 0.417 ' HB2' ' O ' ' A' ' 717' ' ' SER . 0.8 OUTLIER -58.62 -55.97 28.2 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.911 0.386 . . . . 0.0 111.058 -179.806 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.36 -44.81 93.74 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.127 -177.214 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 723' ' ' GLU . . . . . 0.612 ' HA ' HG11 ' A' ' 733' ' ' VAL . 0.4 OUTLIER -60.68 -48.26 82.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.288 -176.247 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 724' ' ' THR . . . . . . . . . . . . . 8.3 m -63.48 -36.99 85.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.995 0.426 . . . . 0.0 111.087 -177.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 725' ' ' SER . . . . . 0.451 ' HA ' ' HD3' ' A' ' 728' ' ' ARG . 12.4 m -70.09 -37.11 75.32 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.203 -179.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 726' ' ' LEU . . . . . . . . . . . . . 20.9 mt -75.15 -43.94 49.6 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.239 -177.445 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -69.04 -10.63 58.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.133 0.492 . . . . 0.0 111.029 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 728' ' ' ARG . . . . . 0.451 ' HD3' ' HA ' ' A' ' 725' ' ' SER . 0.0 OUTLIER -67.84 -33.05 74.02 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.303 176.6 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.31 5.94 49.81 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.655 -176.152 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 730' ' ' GLY . . . . . . . . . . . . . . . 86.98 14.66 64.27 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.439 -0.886 . . . . 0.0 112.422 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 731' ' ' ILE . . . . . . . . . . . . . 14.9 mm -86.63 129.41 38.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 174.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 732' ' ' VAL . . . . . 0.523 HG13 ' HG2' ' A' ' 708' ' ' ARG . 1.4 p -83.97 103.94 11.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.636 0.731 . . . . 0.0 110.441 -177.426 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 733' ' ' VAL . . . . . 0.612 HG11 ' HA ' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -80.71 115.41 23.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.358 178.543 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 734' ' ' THR . . . . . 0.51 ' HB ' ' CZ3' ' A' ' 710' ' ' TRP . 0.2 OUTLIER -122.9 131.22 53.64 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.431 -177.605 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.27 122.53 17.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.304 -179.06 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 736' ' ' TYR . . . . . 0.446 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 21.8 t80 -86.57 98.0 10.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.157 0.504 . . . . 0.0 110.919 -178.572 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -95.71 -28.64 14.69 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.382 174.359 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 161.2 52.96 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.512 0 N-CA-C 110.774 -0.93 . . . . 0.0 110.774 179.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 8.4 mp0 -101.75 -171.32 1.96 Allowed 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -171.149 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 740' ' ' GLU . . . . . 0.5 ' HA ' ' HD3' ' A' ' 741' ' ' PRO . 1.0 OUTLIER -69.5 134.68 88.61 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.799 -176.719 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 741' ' ' PRO . . . . . 0.5 ' HD3' ' HA ' ' A' ' 740' ' ' GLU . 3.9 Cg_endo -88.42 137.41 3.58 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 123.478 2.785 . . . . 0.0 111.614 174.017 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 742' ' ' THR . . . . . 0.658 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.2 OUTLIER -131.55 140.21 37.67 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-O 120.777 0.322 . . . . 0.0 111.082 -179.362 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 743' ' ' PRO . . . . . 0.658 ' HD2' HG22 ' A' ' 742' ' ' THR . 38.3 Cg_endo -66.13 -11.19 30.11 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 123.364 2.71 . . . . 0.0 113.254 -177.401 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -108.95 2.71 21.58 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.05 0.453 . . . . 0.0 110.399 178.328 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 745' ' ' ASP . . . . . 0.444 ' CG ' ' HB2' ' A' ' 708' ' ' ARG . 56.5 m-20 -109.63 152.04 26.06 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.45 -175.625 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 746' ' ' VAL . . . . . 0.658 HG21 HD11 ' A' ' 795' ' ' LEU . 29.2 m -120.25 147.02 24.23 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.082 -178.159 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 747' ' ' LEU . . . . . 0.56 HD12 ' HB2' ' A' ' 757' ' ' TRP . 0.3 OUTLIER -105.05 108.72 20.38 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.112 177.153 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 19.8 mt -94.56 106.54 18.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 N-CA-C 108.82 -0.808 . . . . 0.0 108.82 173.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.94 153.76 19.24 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 116.056 -0.52 . . . . 0.0 112.23 -170.842 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 750' ' ' ASP . . . . . 0.746 ' CB ' ' HA ' ' A' ' 713' ' ' VAL . 9.3 t0 -113.27 113.41 25.25 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 175.361 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 751' ' ' GLU . . . . . 0.552 ' HG3' ' H ' ' A' ' 752' ' ' VAL . 3.1 tp10 68.15 -173.71 0.19 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.274 179.754 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 752' ' ' VAL . . . . . 0.552 ' H ' ' HG3' ' A' ' 751' ' ' GLU . 0.9 OUTLIER -61.0 127.17 20.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.5 178.092 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 8.8 p -114.93 -12.91 11.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.896 179.256 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 6.6 m 55.53 53.43 9.72 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.404 -178.193 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.03 167.96 28.6 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.407 178.612 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 756' ' ' LYS . . . . . 0.464 ' O ' ' HB3' ' A' ' 757' ' ' TRP . 6.1 tptm -111.3 -40.16 4.49 Favored 'General case' 0 C--N 1.322 -0.587 0 O-C-N 123.118 0.261 . . . . 0.0 110.705 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 757' ' ' TRP . . . . . 0.56 ' HB2' HD12 ' A' ' 747' ' ' LEU . 5.5 t-105 73.11 134.86 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.294 0 O-C-N 124.094 0.871 . . . . 0.0 111.005 179.024 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -114.0 115.4 27.55 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.065 178.014 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 759' ' ' GLY . . . . . . . . . . . . . . . -177.25 -139.65 3.37 Favored Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.826 -0.702 . . . . 0.0 111.813 -178.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 8.2 ttt180 -79.22 -54.5 5.91 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.885 0.374 . . . . 0.0 110.08 177.025 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -162.69 163.95 26.71 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.583 179.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 2.5 p -131.88 126.43 56.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.233 -0.44 . . . . 0.0 109.996 176.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 1.9 t -119.97 109.59 26.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.953 -178.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 764' ' ' THR . . . . . 0.412 ' O ' ' HA ' ' A' ' 782' ' ' VAL . 42.5 m -104.35 121.29 43.05 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.169 0.509 . . . . 0.0 112.072 -174.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 765' ' ' PHE . . . . . 0.448 ' CE1' HD22 ' A' ' 791' ' ' LEU . 29.9 m-85 -75.98 150.21 37.47 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 171.772 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -132.75 137.8 46.97 Favored 'General case' 0 C--N 1.318 -0.803 0 C-N-CA 120.923 -0.311 . . . . 0.0 110.591 179.65 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 767' ' ' ARG . . . . . 0.506 ' HB2' ' OE1' ' A' ' 751' ' ' GLU . 6.6 mmm-85 -117.78 43.73 2.33 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.162 0.506 . . . . 0.0 109.732 175.786 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 70.69 12.0 7.24 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 114.976 -1.011 . . . . 0.0 112.331 176.671 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . 0.512 ' HB2' ' CD ' ' A' ' 751' ' ' GLU . 41.1 m80 -102.8 60.66 0.8 Allowed 'General case' 0 C--N 1.328 -0.345 0 O-C-N 122.219 -0.301 . . . . 0.0 110.391 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 49.6 mt 73.11 130.45 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.101 -178.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -92.91 145.25 17.51 Favored Glycine 0 N--CA 1.444 -0.81 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.973 -179.037 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 772' ' ' ILE . . . . . 0.961 HG13 ' HD2' ' A' ' 773' ' ' PRO . 1.0 OUTLIER -89.31 161.9 38.69 Favored Pre-proline 0 C--N 1.323 -0.563 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 174.658 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 773' ' ' PRO . . . . . 0.961 ' HD2' HG13 ' A' ' 772' ' ' ILE . 10.3 Cg_endo -54.37 125.39 18.76 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.512 2.141 . . . . 0.0 112.581 177.021 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . 0.553 ' HB3' HG22 ' A' ' 782' ' ' VAL . 0.8 OUTLIER -93.29 -151.0 0.29 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.162 178.486 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 775' ' ' GLU . . . . . 0.536 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 2.8 mp0 -68.68 50.76 0.07 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.85 0.833 . . . . 0.0 112.947 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . 0.446 ' H ' ' HG2' ' A' ' 776' ' ' LYS . 0.0 OUTLIER -103.88 2.12 32.23 Favored 'General case' 0 C--N 1.308 -1.207 0 N-CA-C 107.152 -1.425 . . . . 0.0 107.152 168.342 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 777' ' ' ALA . . . . . 0.446 ' HB1' ' CD ' ' A' ' 778' ' ' PRO . . . -136.51 170.36 11.08 Favored Pre-proline 0 N--CA 1.447 -0.62 0 CA-C-N 113.816 -1.538 . . . . 0.0 109.003 -179.181 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 778' ' ' PRO . . . . . 0.446 ' CD ' ' HB1' ' A' ' 777' ' ' ALA . 31.1 Cg_exo -59.6 -26.94 83.69 Favored 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 122.943 2.429 . . . . 0.0 115.707 -169.011 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . -155.47 32.28 0.64 Allowed Glycine 0 C--N 1.331 0.266 0 C-N-CA 119.777 -1.201 . . . . 0.0 112.671 -174.39 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 780' ' ' GLU . . . . . 0.536 ' O ' ' HG3' ' A' ' 775' ' ' GLU . 10.9 mp0 -103.62 130.04 51.01 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 -177.592 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 22.9 m95 -134.94 151.64 51.03 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.655 -0.248 . . . . 0.0 110.438 -176.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . 0.553 HG22 ' HB3' ' A' ' 774' ' ' LEU . 35.2 m -139.33 157.72 27.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.377 173.643 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 783' ' ' HIS . . . . . 0.4 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 2.6 t-160 -167.3 121.63 1.01 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.97 0.414 . . . . 0.0 110.633 173.484 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -90.37 101.38 14.11 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.476 176.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -157.84 179.39 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.937 179.48 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -108.12 31.81 5.26 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.013 179.682 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 787' ' ' ALA . . . . . 0.594 ' HB2' ' HG ' ' A' ' 718' ' ' LEU . . . 63.6 71.74 0.6 Allowed Pre-proline 0 C--O 1.232 0.141 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.8 178.032 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 788' ' ' PRO . . . . . 0.469 ' HB2' ' H ' ' A' ' 789' ' ' HIS . 5.9 Cg_exo -79.95 -119.25 0.01 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 123.033 2.489 . . . . 0.0 110.885 172.455 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 789' ' ' HIS . . . . . 0.583 ' HA ' ' HG2' ' A' ' 792' ' ' PRO . 1.0 OUTLIER -130.77 12.57 5.3 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.037 -0.665 . . . . 0.0 111.835 175.993 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 790' ' ' GLU . . . . . 0.44 ' H ' ' HG3' ' A' ' 790' ' ' GLU . 0.0 OUTLIER -83.95 -54.02 5.16 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.103 -179.275 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 791' ' ' LEU . . . . . 0.521 ' N ' ' HD2' ' A' ' 792' ' ' PRO . 0.3 OUTLIER -63.31 -47.38 84.58 Favored Pre-proline 0 CA--C 1.535 0.396 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 179.32 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 792' ' ' PRO . . . . . 0.583 ' HG2' ' HA ' ' A' ' 789' ' ' HIS . 9.4 Cg_endo -55.81 -29.95 74.34 Favored 'Trans proline' 0 C--N 1.357 0.975 0 C-N-CA 121.775 1.65 . . . . 0.0 112.19 175.102 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -69.24 -41.23 77.27 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-O 120.881 0.372 . . . . 0.0 110.317 176.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.71 -43.33 97.96 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.825 176.23 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 795' ' ' LEU . . . . . 0.658 HD11 HG21 ' A' ' 746' ' ' VAL . 1.1 mm? -63.34 -45.07 92.94 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.782 178.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 796' ' ' ALA . . . . . 0.832 ' HA ' HD12 ' A' ' 801' ' ' ILE . . . -63.4 -37.38 87.06 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.227 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 797' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.91 -34.66 71.76 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.455 -0.338 . . . . 0.0 110.372 178.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -62.47 -42.37 95.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.585 179.661 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -88.15 4.63 44.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.766 0.317 . . . . 0.0 110.913 179.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 40.1 mt 57.17 46.08 19.52 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.843 178.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 801' ' ' ILE . . . . . 0.832 HD12 ' HA ' ' A' ' 796' ' ' ALA . 12.9 mt -73.21 -46.88 49.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 176.682 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 54.62 62.55 2.5 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.663 -0.699 . . . . 0.0 112.096 175.028 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 803' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -134.23 91.65 2.83 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.899 0.38 . . . . 0.0 111.335 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 804' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -142.68 19.09 2.01 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.452 0.644 . . . . 0.0 110.025 177.723 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.14 140.46 30.18 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.636 -174.134 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -160.25 122.48 3.27 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.727 176.023 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -127.76 126.96 24.03 Favored Pre-proline 0 C--N 1.326 -0.443 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -175.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 808' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -78.85 88.14 1.48 Allowed 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 122.666 2.244 . . . . 0.0 111.299 172.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -79.99 -37.62 33.89 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.082 -0.508 . . . . 0.0 112.225 -173.31 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 21.2 t30 -108.31 120.49 42.54 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.936 0.398 . . . . 0.0 111.879 -173.32 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -169.74 78.95 0.1 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.439 176.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -143.79 102.95 4.91 Favored Pre-proline 0 C--N 1.327 -0.376 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 -171.721 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -91.75 144.07 2.95 Favored 'Trans proline' 0 CA--C 1.535 0.544 0 C-N-CA 123.222 2.615 . . . . 0.0 111.703 170.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -141.2 115.97 9.7 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 111.842 0.312 . . . . 0.0 111.842 -179.443 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -157.34 124.47 5.15 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.058 175.314 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -135.39 125.08 25.29 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.864 0.364 . . . . 0.0 110.382 177.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.26 61.37 1.03 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.376 0.607 . . . . 0.0 110.134 -177.091 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -93.14 100.78 13.11 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.711 -178.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 5.4 p -142.04 143.94 25.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 120.935 0.397 . . . . 0.0 110.672 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -130.6 175.7 8.79 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.442 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -85.53 159.99 19.77 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.016 0.436 . . . . 0.0 110.725 178.308 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 822' ' ' ASN . . . . . 0.535 ' HB3' ' H ' ' A' ' 823' ' ' ASP . 0.6 OUTLIER -84.79 -105.95 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.216 -178.411 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 823' ' ' ASP . . . . . 0.535 ' H ' ' HB3' ' A' ' 822' ' ' ASN . 37.9 t70 50.8 99.32 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.766 0 O-C-N 123.92 0.762 . . . . 0.0 112.513 -176.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -155.51 91.71 1.34 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.133 0.492 . . . . 0.0 110.805 -179.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -98.12 101.13 12.52 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.346 177.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 826' ' ' MET . . . . . . . . . . . . . 2.6 tpp -104.76 116.54 32.19 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.84 -178.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 827' ' ' ILE . . . . . 0.672 ' HB ' HD21 ' A' ' 844' ' ' LEU . 14.4 mm -114.44 137.19 48.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.309 -179.536 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 828' ' ' LEU . . . . . 0.644 HD11 HG13 ' A' ' 863' ' ' VAL . 0.4 OUTLIER -98.24 131.84 44.24 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.709 -179.479 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 829' ' ' VAL . . . . . 0.744 HG23 HD12 ' A' ' 840' ' ' LEU . 0.2 OUTLIER -122.1 104.09 14.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 174.919 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 830' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -120.67 100.57 9.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.196 -177.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 831' ' ' ASP . . . . . 0.807 ' HB2' ' HB3' ' A' ' 875' ' ' ASP . 0.2 OUTLIER -117.63 154.4 31.64 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.36 -177.173 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -94.01 -16.42 23.91 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -173.411 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 833' ' ' HIS . . . . . 0.421 ' HB2' ' HB2' ' A' ' 877' ' ' ASN . 1.1 m170 -124.5 98.87 37.05 Favored Pre-proline 0 C--N 1.328 -0.354 0 O-C-N 122.068 -0.395 . . . . 0.0 111.196 -178.427 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_exo -30.64 -39.34 0.06 OUTLIER 'Trans proline' 0 C--N 1.353 0.793 1 C-N-CA 126.032 4.488 . . . . 0.0 116.871 -168.654 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 835' ' ' ILE . . . . . 0.532 ' O ' ' HG3' ' A' ' 838' ' ' ARG . 8.2 tp -59.38 -41.57 84.78 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-N 117.846 0.293 . . . . 0.0 111.689 -176.625 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 836' ' ' ASN . . . . . 0.586 ' HA ' ' HB2' ' A' ' 839' ' ' LEU . 0.8 OUTLIER -79.79 -31.95 40.8 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 -178.802 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 837' ' ' ARG . . . . . 0.435 ' HB2' ' OD2' ' A' ' 831' ' ' ASP . 0.7 OUTLIER -52.73 -48.01 66.98 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.4 176.217 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 838' ' ' ARG . . . . . 0.532 ' HG3' ' O ' ' A' ' 835' ' ' ILE . 0.0 OUTLIER -73.99 -28.72 61.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.737 177.609 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 839' ' ' LEU . . . . . 0.586 ' HB2' ' HA ' ' A' ' 836' ' ' ASN . 0.2 OUTLIER -62.35 -53.92 47.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.728 -0.215 . . . . 0.0 111.442 -178.342 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 840' ' ' LEU . . . . . 0.744 HD12 HG23 ' A' ' 829' ' ' VAL . 0.0 OUTLIER -74.21 -29.55 61.78 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.393 -0.523 . . . . 0.0 110.731 -179.502 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -64.49 -38.65 91.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.233 0.539 . . . . 0.0 110.509 177.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -61.6 -49.53 76.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.408 -0.814 . . . . 0.0 109.941 176.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 843' ' ' GLN . . . . . 0.869 ' HG3' HD23 ' A' ' 929' ' ' LEU . 0.0 OUTLIER -58.99 -46.46 88.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.84 -179.811 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 844' ' ' LEU . . . . . 0.672 HD21 ' HB ' ' A' ' 827' ' ' ILE . 0.0 OUTLIER -60.07 -39.87 87.55 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.635 178.073 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -61.71 -39.29 97.22 Favored Glycine 0 N--CA 1.448 -0.506 0 CA-C-N 115.697 -0.683 . . . . 0.0 112.317 176.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.24 -30.49 66.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.972 0.415 . . . . 0.0 110.485 179.769 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 29.3 mt -73.98 -21.25 60.07 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.812 178.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 86.86 38.28 8.1 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 121.087 -0.578 . . . . 0.0 112.962 175.675 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 849' ' ' TYR . . . . . 0.414 ' HB2' HD23 ' A' ' 844' ' ' LEU . 75.0 m-85 -118.2 150.54 39.23 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 178.263 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -72.25 109.67 6.15 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 179.344 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 851' ' ' CYS . . . . . 0.609 ' HB3' HD22 ' A' ' 844' ' ' LEU . 0.0 OUTLIER -102.15 112.07 24.6 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.241 -174.61 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -86.99 108.9 19.04 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 176.079 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 853' ' ' THR . . . . . 0.422 ' HA ' HG13 ' A' ' 829' ' ' VAL . 0.3 OUTLIER -104.1 123.43 47.24 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.015 0.436 . . . . 0.0 111.89 -171.355 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 854' ' ' ALA . . . . . . . . . . . . . . . -140.16 146.9 39.38 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.474 176.62 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 855' ' ' ASN . . . . . 0.436 ' HA ' ' O ' ' A' ' 831' ' ' ASP . 6.1 t-20 -114.76 76.47 0.99 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.109 0.48 . . . . 0.0 110.479 179.629 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 856' ' ' ASP . . . . . . . . . . . . . 8.8 t0 178.95 167.97 0.93 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.154 178.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -91.25 -53.39 2.18 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 121.21 -0.519 . . . . 0.0 111.831 178.344 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 6.6 m -58.23 -32.12 43.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.73 0.3 . . . . 0.0 111.707 -179.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -68.23 -20.1 64.79 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.41 -177.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -67.39 -39.9 85.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.171 0.51 . . . . 0.0 110.059 176.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 861' ' ' LEU . . . . . 0.582 HD11 ' HG ' ' A' ' 893' ' ' LEU . 0.2 OUTLIER -74.31 -37.37 63.64 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.126 176.784 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -65.37 -43.26 91.36 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.137 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 863' ' ' VAL . . . . . 0.644 HG13 HD11 ' A' ' 828' ' ' LEU . 9.3 p -71.88 -31.54 41.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.739 -0.209 . . . . 0.0 110.662 179.229 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 864' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.92 -36.06 71.95 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.175 0.512 . . . . 0.0 109.886 173.546 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 3.6 m -87.13 -16.7 34.67 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.718 178.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 866' ' ' LYS . . . . . 0.637 ' HB2' ' HA ' ' A' ' 863' ' ' VAL . 17.8 mttt -70.76 -55.42 8.65 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.39 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -143.67 -174.81 4.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.197 179.225 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -98.03 125.31 42.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.076 0.465 . . . . 0.0 111.354 -177.064 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 869' ' ' ILE . . . . . 0.638 HG21 ' HB2' ' A' ' 828' ' ' LEU . 3.4 mp -122.27 148.54 25.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.825 179.288 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -94.58 -58.79 2.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.782 0.325 . . . . 0.0 111.314 -176.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 871' ' ' ILE . . . . . 0.649 HG13 ' HG2' ' A' ' 898' ' ' PRO . 0.9 OUTLIER -116.27 135.72 55.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 179.227 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 872' ' ' VAL . . . . . . . . . . . . . 97.3 t -119.08 125.26 74.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.802 -178.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 873' ' ' LEU . . . . . 0.464 HD23 HD12 ' A' ' 900' ' ' ILE . 0.0 OUTLIER -109.79 116.0 30.87 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.908 0.385 . . . . 0.0 109.979 174.791 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -104.11 112.57 25.62 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 177.825 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 875' ' ' ASP . . . . . 0.807 ' HB3' ' HB2' ' A' ' 831' ' ' ASP . 58.6 t0 -109.52 124.54 51.26 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.576 -175.144 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -124.75 133.86 68.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.024 0.44 . . . . 0.0 110.721 -177.767 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 877' ' ' ASN . . . . . 0.502 ' HA ' ' HD2' ' A' ' 925' ' ' LYS . 0.1 OUTLIER -88.38 -18.32 28.65 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.067 176.886 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 28.1 mmt -102.06 156.52 35.13 Favored Pre-proline 0 C--N 1.321 -0.665 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.85 179.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 879' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -58.79 164.26 9.97 Favored 'Trans proline' 0 C--O 1.236 0.415 0 C-N-CA 122.775 2.317 . . . . 0.0 112.128 176.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 10.4 t30 -76.01 54.63 0.86 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.277 0.56 . . . . 0.0 111.749 -175.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 1.2 tpp -95.58 -40.53 9.38 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.002 177.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -84.54 -34.29 23.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.894 177.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -80.36 59.54 4.59 Favored Glycine 0 C--O 1.223 -0.566 0 CA-C-N 115.465 -0.789 . . . . 0.0 113.025 -176.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 22.2 t80 -118.16 -50.37 2.47 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 173.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 885' ' ' ARG . . . . . 0.418 ' O ' ' HB2' ' A' ' 889' ' ' ARG . 0.0 OUTLIER -64.53 -34.44 78.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.438 179.067 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -62.54 -52.76 62.17 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 116.253 -0.43 . . . . 0.0 109.848 177.19 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -60.67 -42.79 97.79 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.171 0.51 . . . . 0.0 111.094 -178.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 888' ' ' GLN . . . . . 0.413 ' HA ' ' OE1' ' A' ' 888' ' ' GLN . 2.5 tp-100 -62.66 -42.81 99.82 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.892 178.592 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 889' ' ' ARG . . . . . 0.509 ' HD3' ' HA ' ' A' ' 889' ' ' ARG . 0.0 OUTLIER -71.82 -44.18 64.34 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.546 -176.32 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 890' ' ' ILE . . . . . 0.467 HG23 HD12 ' A' ' 895' ' ' LEU . 3.3 tt -67.08 -37.54 79.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.826 -0.17 . . . . 0.0 111.449 -176.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 891' ' ' ARG . . . . . 0.812 ' HA ' ' HB2' ' A' ' 895' ' ' LEU . 5.6 ptm180 -72.01 -35.49 69.45 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.808 -0.357 . . . . 0.0 110.493 178.602 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -73.24 -22.71 60.36 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.994 -179.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 893' ' ' LEU . . . . . 0.582 ' HG ' HD11 ' A' ' 861' ' ' LEU . 0.1 OUTLIER -82.53 0.94 40.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.131 -178.538 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 101.11 51.45 1.15 Allowed Glycine 0 N--CA 1.448 -0.511 0 CA-C-N 115.712 -0.677 . . . . 0.0 112.484 176.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 895' ' ' LEU . . . . . 0.812 ' HB2' ' HA ' ' A' ' 891' ' ' ARG . 0.4 OUTLIER -72.91 114.21 10.81 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.975 0.417 . . . . 0.0 110.34 178.435 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -120.66 -12.74 8.83 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.075 -179.789 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 897' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -100.08 153.5 37.73 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.474 -175.877 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 898' ' ' PRO . . . . . 0.649 ' HG2' HG13 ' A' ' 871' ' ' ILE . 55.1 Cg_endo -71.12 126.56 12.54 Favored 'Trans proline' 0 C--O 1.239 0.527 0 C-N-CA 122.592 2.195 . . . . 0.0 112.697 -178.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 899' ' ' VAL . . . . . 0.74 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 97.7 t -112.4 119.38 60.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.117 177.305 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 900' ' ' ILE . . . . . 0.464 HD12 HD23 ' A' ' 873' ' ' LEU . 5.5 mt -95.8 115.58 35.3 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.977 179.597 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -95.06 93.79 1.66 Allowed Glycine 0 N--CA 1.444 -0.796 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.666 -174.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 902' ' ' VAL . . . . . 0.618 ' O ' ' HA ' ' A' ' 875' ' ' ASP . 1.3 t -76.8 125.24 36.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 175.584 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -139.35 149.24 43.93 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.233 0.539 . . . . 0.0 111.134 -179.019 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -71.13 113.67 8.41 Favored 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 168.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -52.43 102.64 0.05 Allowed 'General case' 0 C--O 1.234 0.246 0 O-C-N 123.463 0.477 . . . . 0.0 110.531 -176.161 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 906' ' ' ALA . . . . . 0.502 ' HB3' ' OE1' ' A' ' 909' ' ' GLU . . . -102.53 -77.68 0.55 Allowed 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.824 -174.625 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 5.7 mt -147.9 -86.97 0.09 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.847 0.356 . . . . 0.0 111.748 -176.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 908' ' ' ALA . . . . . 0.406 ' O ' ' HG2' ' A' ' 912' ' ' GLN . . . -102.0 24.88 9.4 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -170.073 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 909' ' ' GLU . . . . . 0.502 ' OE1' ' HB3' ' A' ' 906' ' ' ALA . 3.8 mp0 -56.73 -33.46 66.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.97 -179.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 910' ' ' GLU . . . . . 0.439 ' H ' ' HG3' ' A' ' 910' ' ' GLU . 0.0 OUTLIER -63.21 -50.89 68.46 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.667 179.14 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -58.21 -47.73 82.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.822 178.215 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 912' ' ' GLN . . . . . 0.406 ' HG2' ' O ' ' A' ' 908' ' ' ALA . 10.7 mm100 -61.14 -45.73 93.46 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.227 -178.211 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 913' ' ' ARG . . . . . 0.473 ' HD2' ' SG ' ' A' ' 922' ' ' CYS . 0.0 OUTLIER -55.78 -44.35 77.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.225 -178.729 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 10.8 m -73.83 -34.04 64.38 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.161 -178.37 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 2.8 tp -70.31 -40.47 74.21 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.796 0.331 . . . . 0.0 111.4 -178.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -77.95 -44.5 26.64 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.122 179.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 50.45 45.1 26.76 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.8 -0.637 . . . . 0.0 111.278 -177.635 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -116.42 24.68 9.65 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.814 -0.708 . . . . 0.0 111.948 -179.011 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 919' ' ' MET . . . . . 0.74 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -137.0 -100.44 0.2 Allowed 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 179.555 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 920' ' ' ASP . . . . . 0.471 ' H ' ' HB2' ' A' ' 919' ' ' MET . 15.4 t70 171.46 -64.96 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.45 175.358 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -121.59 175.34 6.27 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.649 -177.532 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 922' ' ' CYS . . . . . 0.473 ' SG ' ' HD2' ' A' ' 913' ' ' ARG . 0.4 OUTLIER -137.14 135.26 37.22 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.325 176.78 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 923' ' ' LEU . . . . . 0.669 HD11 HG21 ' A' ' 935' ' ' THR . 13.7 mt -120.67 167.62 12.25 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.284 -179.029 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -93.43 135.01 35.09 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 174.748 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 925' ' ' LYS . . . . . 0.502 ' HD2' ' HA ' ' A' ' 877' ' ' ASN . 0.1 OUTLIER -49.16 -44.17 71.76 Favored Pre-proline 0 CA--C 1.539 0.555 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -177.647 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -66.01 75.85 0.33 Allowed 'Trans proline' 0 C--N 1.356 0.935 0 C-N-CA 122.03 1.82 . . . . 0.0 112.402 174.215 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -87.96 159.43 3.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.395 179.495 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 928' ' ' THR . . . . . 0.47 ' O ' ' HB ' ' A' ' 932' ' ' ILE . 0.0 OUTLIER -131.97 172.9 11.77 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.639 -179.623 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 929' ' ' LEU . . . . . 0.869 HD23 ' HG3' ' A' ' 843' ' ' GLN . 1.3 tm? -61.67 -48.25 81.68 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.695 0.283 . . . . 0.0 111.699 -176.201 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -78.01 -32.0 50.89 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.864 -0.334 . . . . 0.0 111.327 -175.264 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -74.74 -36.19 39.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 C-N-CA 120.964 -0.295 . . . . 0.0 110.667 179.48 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 932' ' ' ILE . . . . . 0.789 HG21 ' HB3' ' A' ' 843' ' ' GLN . 0.4 OUTLIER -69.03 -34.73 65.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 174.611 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.9 -46.01 91.23 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.991 -0.55 . . . . 0.0 109.876 174.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -54.81 -58.27 8.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.766 177.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 935' ' ' THR . . . . . 0.669 HG21 HD11 ' A' ' 923' ' ' LEU . 1.9 m -57.55 -51.46 69.39 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.96 -178.363 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 936' ' ' LEU . . . . . 0.572 HD11 HG21 ' A' ' 827' ' ' ILE . 1.8 tp -61.68 -45.72 92.79 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.513 -177.014 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 41.3 m -67.4 -36.31 81.05 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.377 -178.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 938' ' ' LEU . . . . . 0.465 ' O ' ' HG3' ' A' ' 941' ' ' GLU . 3.6 tp -71.43 -36.64 71.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.158 0.504 . . . . 0.0 111.307 -178.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 939' ' ' TYR . . . . . 0.714 ' HA ' ' HB2' ' A' ' 942' ' ' ARG . 40.0 m-85 -86.49 -25.63 25.03 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 121.877 -0.514 . . . . 0.0 111.521 -178.076 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -67.53 -39.82 85.04 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.947 0.403 . . . . 0.0 110.282 173.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 941' ' ' GLU . . . . . 0.465 ' HG3' ' O ' ' A' ' 938' ' ' LEU . 0.2 OUTLIER -72.53 -27.91 62.53 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 174.647 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 942' ' ' ARG . . . . . 0.714 ' HB2' ' HA ' ' A' ' 939' ' ' TYR . 0.0 OUTLIER -60.5 -49.42 77.63 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.881 -179.578 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 6.5 m -72.46 -31.87 39.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.711 178.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.61 -36.17 82.94 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.226 -179.404 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.58 -23.51 29.61 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.596 0.236 . . . . 0.0 111.067 179.393 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 51.0 m -72.66 -39.03 67.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.129 0.49 . . . . 0.0 109.963 177.004 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 2.3 mtp180 -84.35 -30.05 25.8 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.579 177.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 58.63 77.27 0.31 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.466 -175.256 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 13.0 m . . . . . 0 C--O 1.253 1.26 0 CA-C-N 114.966 -1.015 . . . . 0.0 110.889 -178.3 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.935 0 CA-C-O 120.8 0.334 . . . . 0.0 110.276 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 143.41 92.77 0.17 Allowed Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 111.254 -0.738 . . . . 0.0 111.254 -179.065 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . -113.39 152.37 18.03 Favored Glycine 0 N--CA 1.446 -0.684 0 C-N-CA 120.997 -0.621 . . . . 0.0 112.773 -177.519 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -107.56 135.27 49.3 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.634 0.254 . . . . 0.0 110.357 179.354 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . -134.41 145.67 17.73 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.896 -0.669 . . . . 0.0 112.111 -178.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 10.1 t 59.55 77.77 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-O 121.248 0.547 . . . . 0.0 110.587 -179.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -80.58 -77.22 0.2 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.845 -178.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 703' ' ' GLY . . . . . 0.463 ' O ' ' HE2' ' A' ' 707' ' ' LYS . . . -128.92 -84.67 0.41 Allowed Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.018 -179.448 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.57 HD13 ' HB3' ' A' ' 729' ' ' SER . 58.0 mt -79.63 73.4 6.33 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.252 0.549 . . . . 0.0 110.184 -179.003 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -151.81 70.41 0.94 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.933 -178.369 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 119.31 20.72 3.9 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.269 -178.134 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 707' ' ' LYS . . . . . 0.686 ' HB2' HG12 ' A' ' 731' ' ' ILE . 15.0 mmtt -81.79 165.38 20.95 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 177.67 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 708' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -121.01 130.51 53.82 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -172.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -118.02 111.71 19.29 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.345 177.074 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 710' ' ' TRP . . . . . 0.447 ' O ' HD23 ' A' ' 747' ' ' LEU . 98.3 m95 -97.24 112.08 24.04 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 175.337 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 711' ' ' LEU . . . . . 0.565 HD11 ' SG ' ' A' ' 719' ' ' CYS . 0.1 OUTLIER -121.87 131.64 54.14 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.16 0.505 . . . . 0.0 111.285 -174.741 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -125.23 57.57 1.3 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.598 179.152 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 713' ' ' VAL . . . . . 0.823 ' HA ' ' HB2' ' A' ' 750' ' ' ASP . 12.5 t -103.97 125.15 58.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.566 -177.004 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 714' ' ' ARG . . . . . 0.485 ' NH2' ' HG3' ' A' ' 751' ' ' GLU . 18.9 mtm180 -82.66 -38.38 23.54 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.029 0.442 . . . . 0.0 109.883 179.262 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -65.83 102.75 0.8 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.74 176.03 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 716' ' ' ALA . . . . . 0.53 ' HA ' ' HB3' ' A' ' 719' ' ' CYS . . . -63.63 -26.32 68.62 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.071 -174.856 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 4.3 m -65.01 -46.22 82.3 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.118 0.485 . . . . 0.0 109.913 176.006 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 718' ' ' LEU . . . . . 0.419 ' HB3' HG11 ' A' ' 713' ' ' VAL . 0.9 OUTLIER -74.14 -39.57 63.2 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.543 178.385 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 719' ' ' CYS . . . . . 0.648 ' HB2' ' HB ' ' A' ' 713' ' ' VAL . 0.7 OUTLIER -59.59 -51.56 69.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.7 179.683 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 720' ' ' GLN . . . . . 0.793 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -64.99 -33.7 76.67 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.524 -179.383 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -54.73 -55.8 26.07 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.172 0.511 . . . . 0.0 110.145 177.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -68.26 -48.5 64.9 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.177 -177.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 723' ' ' GLU . . . . . 0.793 ' HG2' ' HA ' ' A' ' 720' ' ' GLN . 10.4 pt-20 -60.77 -41.86 96.33 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 111.601 0.222 . . . . 0.0 111.601 -174.495 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 724' ' ' THR . . . . . . . . . . . . . 53.7 m -67.35 -44.37 79.2 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.948 0.404 . . . . 0.0 110.732 -179.239 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 74.0 m -66.57 -39.48 88.51 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.717 -177.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 726' ' ' LEU . . . . . . . . . . . . . 67.1 mt -74.96 -39.37 61.36 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.264 -178.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 1.6 pp0? -72.07 -23.75 61.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.792 -0.185 . . . . 0.0 111.062 -179.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 9.1 ptt85 -66.74 -22.25 66.05 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 121.278 0.561 . . . . 0.0 110.42 177.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 729' ' ' SER . . . . . 0.57 ' HB3' HD13 ' A' ' 704' ' ' LEU . 19.9 m -88.01 -78.39 0.32 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.299 179.695 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 730' ' ' GLY . . . . . 0.535 ' HA3' ' O ' ' A' ' 704' ' ' LEU . . . 177.76 39.85 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 111.053 -0.819 . . . . 0.0 111.053 179.176 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 731' ' ' ILE . . . . . 0.686 HG12 ' HB2' ' A' ' 707' ' ' LYS . 27.0 mt -119.24 127.98 75.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 115.165 -0.518 . . . . 0.0 110.165 -177.454 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 732' ' ' VAL . . . . . 0.403 HG22 ' O ' ' A' ' 707' ' ' LYS . 10.6 m -81.21 118.45 29.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.339 0.59 . . . . 0.0 110.538 179.311 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 733' ' ' VAL . . . . . 0.521 ' CG1' HD22 ' A' ' 711' ' ' LEU . 21.9 t -89.71 125.04 42.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.628 -178.105 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 734' ' ' THR . . . . . 0.431 ' HB ' ' CZ3' ' A' ' 710' ' ' TRP . 0.3 OUTLIER -133.11 136.26 45.72 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.438 0.637 . . . . 0.0 110.571 -178.898 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.29 113.56 3.68 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.759 -1.11 . . . . 0.0 111.075 178.145 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -80.09 78.95 6.7 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.455 0.645 . . . . 0.0 109.605 176.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -78.36 -28.78 47.17 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.031 179.694 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 164.89 55.08 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.53 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 179.395 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 17.3 mp0 -96.63 -171.41 2.26 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.851 0.358 . . . . 0.0 111.331 -174.058 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -98.94 147.37 33.12 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.776 -176.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 741' ' ' PRO . . . . . 0.581 ' HA ' ' CZ3' ' A' ' 757' ' ' TRP . 73.0 Cg_endo -78.43 131.1 10.35 Favored 'Trans proline' 0 N--CA 1.463 -0.314 0 C-N-CA 122.825 2.35 . . . . 0.0 113.132 179.266 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 742' ' ' THR . . . . . 0.493 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.2 OUTLIER -118.21 135.39 23.49 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.394 176.411 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 743' ' ' PRO . . . . . 0.876 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 19.6 Cg_endo -60.7 -18.15 53.8 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 123.149 2.566 . . . . 0.0 113.152 -177.64 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -105.89 10.52 32.43 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.55 -0.296 . . . . 0.0 110.608 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -118.74 156.31 29.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.203 -174.342 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 746' ' ' VAL . . . . . 0.405 HG12 ' HB3' ' A' ' 760' ' ' ARG . 1.5 m -122.29 147.67 26.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.277 -178.395 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 747' ' ' LEU . . . . . 0.653 ' HB3' HG23 ' A' ' 762' ' ' VAL . 0.3 OUTLIER -118.13 134.65 54.8 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.97 178.944 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -127.58 107.79 17.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 172.846 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 749' ' ' THR . . . . . 0.429 HG23 ' HA ' ' A' ' 764' ' ' THR . 1.4 t -109.07 146.04 34.66 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.467 0.651 . . . . 0.0 112.016 -172.629 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 750' ' ' ASP . . . . . 0.823 ' HB2' ' HA ' ' A' ' 713' ' ' VAL . 59.8 t0 -91.88 108.56 20.01 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.968 -1.015 . . . . 0.0 109.442 175.569 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 751' ' ' GLU . . . . . 0.485 ' HG3' ' NH2' ' A' ' 714' ' ' ARG . 3.1 mm-40 63.47 -159.74 0.31 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.865 -174.858 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 752' ' ' VAL . . . . . . . . . . . . . 3.8 t -86.58 119.78 35.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.02 0.438 . . . . 0.0 112.099 -170.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 3.4 m -107.51 -3.31 10.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.462 172.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 13.0 m 53.88 55.02 8.93 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.61 -179.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.48 137.62 52.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.541 -179.335 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 20.7 tptt -100.4 87.48 3.41 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.346 0.593 . . . . 0.0 109.674 176.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 757' ' ' TRP . . . . . 0.581 ' CZ3' ' HA ' ' A' ' 741' ' ' PRO . 76.1 t-105 -67.93 106.03 2.19 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.631 -178.747 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.95 87.83 6.36 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 173.64 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 759' ' ' GLY . . . . . 0.876 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -159.18 -139.58 2.71 Favored Glycine 0 N--CA 1.444 -0.811 0 C-N-CA 120.512 -0.852 . . . . 0.0 112.377 -178.159 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 760' ' ' ARG . . . . . 0.405 ' HB3' HG12 ' A' ' 746' ' ' VAL . 0.7 OUTLIER -71.18 -55.64 7.73 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.989 -0.284 . . . . 0.0 110.573 178.6 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -170.59 150.69 3.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.874 179.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 762' ' ' VAL . . . . . 0.653 HG23 ' HB3' ' A' ' 747' ' ' LEU . 4.5 p -130.23 127.44 63.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.248 175.446 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 763' ' ' VAL . . . . . 0.694 HG11 HD21 ' A' ' 791' ' ' LEU . 85.6 t -112.46 128.65 69.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.515 178.455 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 764' ' ' THR . . . . . 0.429 ' HA ' HG23 ' A' ' 749' ' ' THR . 35.5 m -109.17 118.27 36.31 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.105 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 765' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -84.51 107.29 16.67 Favored 'General case' 0 C--O 1.223 -0.313 0 N-CA-C 109.813 -0.439 . . . . 0.0 109.813 177.341 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.06 134.31 36.61 Favored 'General case' 0 C--N 1.317 -0.848 0 C-N-CA 120.844 -0.343 . . . . 0.0 110.196 -175.474 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.79 -65.35 1.07 Allowed 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.803 -0.359 . . . . 0.0 111.312 -179.632 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 3.7 mtp85 -143.67 -4.82 0.84 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -176.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 2.3 m170 -84.17 -67.74 0.77 Allowed 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.294 -0.562 . . . . 0.0 110.863 -178.448 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 25.4 mt 68.65 144.6 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 CA-C-O 121.202 0.525 . . . . 0.0 111.395 -179.447 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . 158.88 -32.2 0.47 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.825 -0.703 . . . . 0.0 111.624 -178.297 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 772' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -82.09 154.24 69.73 Favored Pre-proline 0 C--N 1.324 -0.531 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 176.136 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 773' ' ' PRO . . . . . 0.506 ' HB2' ' H ' ' A' ' 774' ' ' LEU . 12.7 Cg_exo -70.58 -119.88 0.01 OUTLIER 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.792 2.328 . . . . 0.0 112.913 -179.732 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . 0.767 ' HA ' HG13 ' A' ' 782' ' ' VAL . 1.1 pt? 178.25 -167.04 0.06 Allowed 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 122.676 0.39 . . . . 0.0 110.105 -177.606 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 775' ' ' GLU . . . . . 0.723 ' HG3' ' HA ' ' A' ' 781' ' ' TRP . 2.4 mp0 -63.03 68.87 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 121.603 0.716 . . . . 0.0 112.631 174.472 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -127.82 6.61 6.11 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 114.642 -1.163 . . . . 0.0 108.214 171.712 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -145.42 144.3 22.61 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 114.314 -1.312 . . . . 0.0 108.946 179.233 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -60.62 100.57 0.16 Allowed 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 122.496 2.131 . . . . 0.0 112.97 -177.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 116.75 -3.92 19.36 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.996 176.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 780' ' ' GLU . . . . . 0.622 ' O ' ' HG3' ' A' ' 775' ' ' GLU . 10.2 tt0 -103.71 123.67 47.45 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 -177.296 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 781' ' ' TRP . . . . . 0.723 ' HA ' ' HG3' ' A' ' 775' ' ' GLU . 23.2 m95 -134.76 137.41 43.41 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 -179.606 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . 0.767 HG13 ' HA ' ' A' ' 774' ' ' LEU . 3.6 m -136.28 151.65 28.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 120.775 0.322 . . . . 0.0 110.29 173.075 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 783' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -167.5 129.18 1.56 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.477 -0.328 . . . . 0.0 110.492 178.858 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.61 101.92 11.11 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 174.255 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 785' ' ' VAL . . . . . 0.846 HG13 ' H ' ' A' ' 787' ' ' ALA . 1.8 p -170.91 168.15 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.202 -175.802 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -108.58 27.78 9.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.754 0.311 . . . . 0.0 110.781 -179.677 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 787' ' ' ALA . . . . . 0.846 ' H ' HG13 ' A' ' 785' ' ' VAL . . . 49.12 57.27 18.35 Favored Pre-proline 0 N--CA 1.47 0.527 0 CA-C-N 115.209 -0.905 . . . . 0.0 112.905 178.877 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 788' ' ' PRO . . . . . 0.509 ' HD3' ' N ' ' A' ' 787' ' ' ALA . 2.7 Cg_exo -76.35 -42.26 0.39 Allowed 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 122.285 1.99 . . . . 0.0 113.414 -178.049 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 4.9 p-80 -151.64 -14.62 0.2 Allowed 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 -170.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 790' ' ' GLU . . . . . 0.457 ' CD ' ' H ' ' A' ' 790' ' ' GLU . 0.0 OUTLIER -112.75 -41.92 3.71 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -169.393 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 791' ' ' LEU . . . . . 0.694 HD21 HG11 ' A' ' 763' ' ' VAL . 0.3 OUTLIER -67.89 -50.42 33.04 Favored Pre-proline 0 C--N 1.325 -0.487 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.035 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 792' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -63.9 -26.73 66.94 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 121.3 1.333 . . . . 0.0 111.411 179.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -75.0 -39.11 61.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.33 176.359 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -62.66 -41.07 98.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.76 176.382 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 795' ' ' LEU . . . . . 0.516 HD22 ' HA ' ' A' ' 795' ' ' LEU . 0.2 OUTLIER -60.26 -45.53 92.96 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.454 177.624 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -63.54 -38.72 92.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.925 178.456 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 797' ' ' ARG . . . . . 0.514 ' HA ' HD12 ' A' ' 800' ' ' LEU . 0.0 OUTLIER -67.18 -32.71 73.98 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.9 0.381 . . . . 0.0 110.526 178.959 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -70.77 -28.04 32.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.063 0.459 . . . . 0.0 110.694 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 799' ' ' TYR . . . . . 0.528 ' CE2' ' HB3' ' A' ' 707' ' ' LYS . 0.2 OUTLIER -104.26 9.32 36.06 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.171 176.882 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 800' ' ' LEU . . . . . 0.514 HD12 ' HA ' ' A' ' 797' ' ' ARG . 3.9 mt -76.07 -18.68 59.1 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 177.121 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 801' ' ' ILE . . . . . . . . . . . . . 1.5 mm 56.06 54.55 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 CA-C-O 122.356 1.074 . . . . 0.0 110.322 176.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 802' ' ' GLU . . . . . 0.412 ' H ' ' HG3' ' A' ' 802' ' ' GLU . 0.0 OUTLIER -88.22 48.93 1.71 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 114.275 -1.329 . . . . 0.0 110.745 -176.373 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 803' ' ' MET . . . . . 0.511 ' O ' ' HG2' ' A' ' 803' ' ' MET . 0.0 OUTLIER -138.97 133.04 31.24 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.861 -179.075 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 804' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -170.05 -175.45 2.02 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.549 175.827 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 52.73 -94.97 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 123.557 0.743 . . . . 0.0 111.86 -176.322 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 806' ' ' ASP . . . . . 0.452 ' O ' ' HD3' ' A' ' 808' ' ' PRO . 6.2 t70 -161.15 -37.3 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.767 -172.036 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -109.77 104.16 54.8 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.006 -173.406 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 808' ' ' PRO . . . . . 0.452 ' HD3' ' O ' ' A' ' 806' ' ' ASP . 6.0 Cg_exo -80.73 -46.77 0.08 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.449 0 C-N-CA 123.052 2.501 . . . . 0.0 111.644 169.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . 56.83 -154.36 0.34 Allowed 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.477 0.711 . . . . 0.0 112.627 178.066 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 810' ' ' ASN . . . . . 0.486 ' HB3' ' H ' ' A' ' 811' ' ' ALA . 2.1 t-20 63.85 -95.73 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.846 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 811' ' ' ALA . . . . . 0.486 ' H ' ' HB3' ' A' ' 810' ' ' ASN . . . -75.86 86.47 2.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.942 0.401 . . . . 0.0 110.95 -176.62 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 9.5 tp -148.63 96.25 3.88 Favored Pre-proline 0 C--N 1.322 -0.615 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.159 -178.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_exo -72.51 -65.57 0.03 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 122.678 2.252 . . . . 0.0 111.203 176.465 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -148.43 154.66 40.19 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.835 178.379 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 815' ' ' THR . . . . . 0.407 HG22 ' HB2' ' A' ' 818' ' ' ALA . 0.0 OUTLIER -100.91 34.56 2.45 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.162 0.506 . . . . 0.0 111.082 -178.384 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -72.28 -22.68 61.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.494 -176.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 4.8 mttp -110.77 32.95 4.85 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.015 0.436 . . . . 0.0 110.613 179.744 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 818' ' ' ALA . . . . . 0.407 ' HB2' HG22 ' A' ' 815' ' ' THR . . . -80.89 126.66 31.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.286 -178.467 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 21.9 t -115.14 102.96 14.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.657 176.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -83.19 49.54 1.57 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.163 0.506 . . . . 0.0 110.914 -177.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -82.15 73.01 9.21 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.419 0.628 . . . . 0.0 110.672 -178.391 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -138.08 29.89 2.5 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.457 176.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -119.67 121.14 38.6 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.977 -1.01 . . . . 0.0 109.274 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 824' ' ' ASP . . . . . 0.449 ' HB3' ' H ' ' A' ' 825' ' ' MET . 4.7 t0 -144.73 -93.23 0.1 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.043 -178.189 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 825' ' ' MET . . . . . 0.449 ' H ' ' HB3' ' A' ' 824' ' ' ASP . 0.0 OUTLIER -93.28 129.92 39.18 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.02 179.508 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 826' ' ' MET . . . . . 0.509 ' HG3' ' O ' ' A' ' 868' ' ' HIS . 0.0 OUTLIER -124.54 139.25 54.06 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.561 0.696 . . . . 0.0 112.14 -174.777 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 827' ' ' ILE . . . . . 0.543 HG23 ' HB ' ' A' ' 871' ' ' ILE . 3.5 mm -121.25 137.43 54.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.051 -0.977 . . . . 0.0 109.534 177.894 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 13.5 tp -98.4 122.47 41.62 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 179.435 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 829' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -112.49 113.57 44.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 120.867 0.365 . . . . 0.0 110.424 -179.277 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 830' ' ' VAL . . . . . 0.501 ' HA ' ' O ' ' A' ' 854' ' ' ALA . 2.9 t -118.21 86.37 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.713 -177.247 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 831' ' ' ASP . . . . . 0.802 ' HA ' ' HB2' ' A' ' 875' ' ' ASP . 13.8 t70 -93.39 154.83 17.73 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.143 0.497 . . . . 0.0 111.475 -173.35 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 832' ' ' ASP . . . . . 1.068 ' HB3' ' HB ' ' A' ' 876' ' ' VAL . 0.0 OUTLIER -60.75 -33.67 73.28 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.818 -177.238 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 833' ' ' HIS . . . . . 0.678 ' HB2' HD21 ' A' ' 836' ' ' ASN . 34.8 m170 -136.4 138.61 27.36 Favored Pre-proline 0 N--CA 1.463 0.186 0 CA-C-O 120.517 0.198 . . . . 0.0 110.519 -178.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 834' ' ' PRO . . . . . 0.447 ' HA ' ' HB3' ' A' ' 837' ' ' ARG . 52.1 Cg_exo -56.12 -25.6 55.69 Favored 'Trans proline' 0 CA--C 1.532 0.415 0 C-N-CA 123.115 2.543 . . . . 0.0 113.511 -178.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -69.68 -48.18 66.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.946 0.403 . . . . 0.0 111.058 -179.092 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 836' ' ' ASN . . . . . 0.678 HD21 ' HB2' ' A' ' 833' ' ' HIS . 0.1 OUTLIER -74.35 -33.3 63.08 Favored 'General case' 0 CA--C 1.515 -0.396 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 178.508 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 837' ' ' ARG . . . . . 0.585 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 6.5 ttp180 -53.45 -43.2 67.89 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.193 175.042 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 838' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.75 -30.32 67.89 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.665 178.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.98 -49.13 66.36 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.312 178.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 840' ' ' LEU . . . . . 0.504 ' H ' ' HG ' ' A' ' 840' ' ' LEU . 0.0 OUTLIER -69.05 -32.94 72.79 Favored 'General case' 0 CA--C 1.521 -0.146 0 C-N-CA 120.704 -0.399 . . . . 0.0 110.139 178.216 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -64.97 -32.05 73.59 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.009 177.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.24 -42.62 88.35 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.04 0.447 . . . . 0.0 109.829 176.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 843' ' ' GLN . . . . . 0.545 ' HG3' ' CD2' ' A' ' 929' ' ' LEU . 0.0 OUTLIER -65.24 -46.88 78.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.842 178.868 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 844' ' ' LEU . . . . . 0.48 HD21 HD21 ' A' ' 936' ' ' LEU . 0.1 OUTLIER -59.18 -40.95 87.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.331 177.783 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -70.2 -27.39 72.92 Favored Glycine 0 N--CA 1.453 -0.205 0 C-N-CA 121.306 -0.473 . . . . 0.0 112.537 -179.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 18.4 m -79.34 -23.69 43.25 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.059 0.457 . . . . 0.0 110.449 177.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.04 -22.49 42.32 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.266 177.116 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 84.48 58.31 2.19 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.894 -0.669 . . . . 0.0 112.116 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 849' ' ' TYR . . . . . 0.44 ' HE1' ' HB3' ' A' ' 825' ' ' MET . 2.4 m-85 -132.75 147.26 52.32 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 29.1 mm-40 -72.99 115.39 12.24 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 176.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 851' ' ' CYS . . . . . 0.469 ' SG ' ' HB3' ' A' ' 844' ' ' LEU . 0.0 OUTLIER -109.48 136.08 49.45 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.986 0.422 . . . . 0.0 111.029 -176.277 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.3 116.45 31.03 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 173.757 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 853' ' ' THR . . . . . 0.482 ' HB ' ' CZ ' ' A' ' 837' ' ' ARG . 0.2 OUTLIER -91.02 134.11 34.76 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -171.464 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 854' ' ' ALA . . . . . 0.501 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -151.47 164.55 36.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.935 175.128 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 855' ' ' ASN . . . . . 0.54 ' O ' ' HB3' ' A' ' 856' ' ' ASP . 0.2 OUTLIER -153.5 74.02 0.99 Allowed 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.74 0.305 . . . . 0.0 110.978 176.63 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 856' ' ' ASP . . . . . 0.54 ' HB3' ' O ' ' A' ' 855' ' ' ASN . 4.3 p-10 163.82 173.65 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 124.28 1.032 . . . . 0.0 109.712 178.647 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -87.04 -44.2 5.75 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.732 -0.747 . . . . 0.0 113.898 -175.094 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -67.5 -38.21 80.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 112.011 0.374 . . . . 0.0 112.011 -174.324 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -67.89 -37.28 81.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.914 0.388 . . . . 0.0 110.622 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 860' ' ' ALA . . . . . . . . . . . . . . . -61.63 -38.83 89.1 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.417 177.577 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 861' ' ' LEU . . . . . 0.496 HD21 ' HA ' ' A' ' 890' ' ' ILE . 0.1 OUTLIER -74.73 -31.31 61.8 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.957 178.036 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -64.68 -49.75 69.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.301 177.901 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 863' ' ' VAL . . . . . 0.489 HG22 HD11 ' A' ' 869' ' ' ILE . 7.9 p -66.99 -31.2 52.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.428 177.638 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 864' ' ' LEU . . . . . 0.669 ' HG ' HD11 ' A' ' 890' ' ' ILE . 0.7 OUTLIER -65.63 -33.86 76.87 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.824 175.683 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 27.2 m -65.9 -37.79 87.04 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.072 0.463 . . . . 0.0 109.861 178.164 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.05 -28.7 68.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.721 174.016 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 7.2 t30 56.12 73.0 0.46 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 114.575 -1.193 . . . . 0.0 111.976 176.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 868' ' ' HIS . . . . . 0.509 ' O ' ' HG3' ' A' ' 826' ' ' MET . 64.7 m-70 -135.14 46.24 2.43 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 174.558 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 869' ' ' ILE . . . . . 0.489 HD11 HG22 ' A' ' 863' ' ' VAL . 2.0 mp -142.2 145.79 23.35 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.132 -0.94 . . . . 0.0 109.835 -177.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -101.43 -52.42 3.24 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.88 0.372 . . . . 0.0 110.426 177.173 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 871' ' ' ILE . . . . . 0.543 ' HB ' HG23 ' A' ' 827' ' ' ILE . 38.4 mm -115.42 129.49 71.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.139 179.029 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 872' ' ' VAL . . . . . 0.764 HG23 HD11 ' A' ' 897' ' ' LEU . 9.7 t -106.53 124.39 62.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 120.728 0.299 . . . . 0.0 110.697 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 873' ' ' LEU . . . . . 0.843 HD11 HD11 ' A' ' 936' ' ' LEU . 52.1 mt -109.96 132.34 54.25 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.141 -0.481 . . . . 0.0 109.719 174.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -120.8 95.2 4.61 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.065 0.459 . . . . 0.0 110.011 178.01 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 875' ' ' ASP . . . . . 0.802 ' HB2' ' HA ' ' A' ' 831' ' ' ASP . 0.9 OUTLIER -88.66 105.63 17.8 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.978 -179.512 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 876' ' ' VAL . . . . . 1.068 ' HB ' ' HB3' ' A' ' 832' ' ' ASP . 2.9 t 50.92 65.56 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.558 0.694 . . . . 0.0 111.519 -179.372 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 877' ' ' ASN . . . . . 0.434 ' HB3' HD22 ' A' ' 886' ' ' LEU . 1.6 t-20 -90.48 33.17 0.91 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.827 176.392 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 4.7 tpp -100.16 112.5 64.22 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.162 -0.927 . . . . 0.0 109.473 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 879' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo -62.3 -58.82 0.31 Allowed 'Trans proline' 0 N--CA 1.462 -0.332 0 C-N-CA 122.704 2.269 . . . . 0.0 111.412 179.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -176.47 -60.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.586 178.734 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 4.2 tmm? -98.4 88.46 4.14 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.37 177.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 68.85 147.29 0.06 Allowed 'General case' 0 N--CA 1.468 0.454 0 O-C-N 123.886 0.741 . . . . 0.0 111.361 178.817 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -118.81 24.42 8.4 Favored Glycine 0 CA--C 1.51 -0.273 0 C-N-CA 120.845 -0.693 . . . . 0.0 111.39 177.652 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 6.5 p90 -80.31 -18.84 48.04 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.296 -0.452 . . . . 0.0 110.687 -171.566 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.89 -32.12 73.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.857 0.36 . . . . 0.0 110.344 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 886' ' ' LEU . . . . . 0.434 HD22 ' HB3' ' A' ' 877' ' ' ASN . 0.0 OUTLIER -72.62 -50.73 23.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.15 179.807 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 887' ' ' THR . . . . . 0.631 ' HB ' ' HB3' ' A' ' 916' ' ' GLU . 0.0 OUTLIER -63.28 -40.6 97.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.139 -179.144 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 40.0 tp60 -65.31 -42.77 92.68 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.331 178.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 889' ' ' ARG . . . . . 0.404 ' HG2' HD22 ' A' ' 861' ' ' LEU . 0.7 OUTLIER -64.86 -45.75 84.75 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.992 -178.401 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 890' ' ' ILE . . . . . 0.669 HD11 ' HG ' ' A' ' 864' ' ' LEU . 1.1 tt -69.05 -34.15 62.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.62 0.247 . . . . 0.0 111.017 -177.882 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 891' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.17 -23.07 57.68 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.905 0.383 . . . . 0.0 110.475 178.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 -77.84 -52.21 9.25 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.456 176.326 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.82 -60.53 3.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.852 -175.116 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 171.3 77.99 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.712 0 C-N-CA 120.394 -0.908 . . . . 0.0 112.02 -176.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 895' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -92.27 110.28 21.67 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.023 0.44 . . . . 0.0 110.071 178.843 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -123.25 -26.5 4.29 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.617 178.08 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 897' ' ' LEU . . . . . 0.764 HD11 HG23 ' A' ' 872' ' ' VAL . 2.5 pt? -97.52 151.9 37.89 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.349 -177.35 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -66.91 128.55 18.98 Favored 'Trans proline' 0 C--O 1.239 0.555 0 C-N-CA 122.763 2.309 . . . . 0.0 112.732 -177.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 899' ' ' VAL . . . . . 0.655 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 58.7 t -105.9 109.37 27.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.225 176.748 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 900' ' ' ILE . . . . . 0.427 ' O ' ' HA ' ' A' ' 873' ' ' LEU . 3.6 mp -101.01 114.39 39.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 178.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -112.57 116.47 4.05 Favored Glycine 0 N--CA 1.442 -0.916 0 C-N-CA 120.448 -0.882 . . . . 0.0 112.599 -174.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 902' ' ' VAL . . . . . 0.675 HG22 ' HA ' ' A' ' 875' ' ' ASP . 0.8 OUTLIER -89.55 138.71 18.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 108.76 -0.829 . . . . 0.0 108.76 176.031 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -138.27 160.5 39.3 Favored 'General case' 0 C--N 1.319 -0.739 0 O-C-N 121.957 -0.464 . . . . 0.0 111.686 -176.597 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -85.4 105.85 16.33 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.327 174.319 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 905' ' ' ASN . . . . . 0.403 ' HB3' ' H ' ' A' ' 906' ' ' ALA . 11.8 t-20 62.29 -96.41 0.06 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.778 -174.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 906' ' ' ALA . . . . . 0.494 ' O ' ' HG3' ' A' ' 909' ' ' GLU . . . 53.22 55.61 8.57 Favored 'General case' 0 N--CA 1.462 0.141 0 O-C-N 123.487 0.492 . . . . 0.0 111.05 -179.413 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 907' ' ' LEU . . . . . 0.417 ' O ' ' HB3' ' A' ' 908' ' ' ALA . 2.1 tp -49.31 143.1 6.65 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.394 -179.281 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 908' ' ' ALA . . . . . 0.417 ' HB3' ' O ' ' A' ' 907' ' ' LEU . . . 76.5 39.38 0.26 Allowed 'General case' 0 N--CA 1.465 0.315 0 O-C-N 124.33 1.018 . . . . 0.0 109.685 -173.898 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 909' ' ' GLU . . . . . 0.494 ' HG3' ' O ' ' A' ' 906' ' ' ALA . 1.0 OUTLIER -57.79 -45.41 86.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.951 -178.307 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 910' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.42 -44.17 88.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.586 179.077 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 911' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.54 -33.95 76.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.847 -178.469 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.17 -57.9 8.99 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.327 177.396 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 913' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.83 -33.46 71.79 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.37 -176.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 77.0 m -76.24 -33.53 59.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.116 179.398 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 4.6 tp -70.8 -47.75 57.85 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.868 0.365 . . . . 0.0 110.63 179.372 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 916' ' ' GLU . . . . . 0.631 ' HB3' ' HB ' ' A' ' 887' ' ' THR . 28.5 mt-10 -69.87 -27.51 64.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.155 -178.225 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.59 35.63 15.18 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.294 178.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -140.77 24.71 2.59 Favored Glycine 0 C--O 1.226 -0.351 0 C-N-CA 120.517 -0.849 . . . . 0.0 112.488 -179.002 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 919' ' ' MET . . . . . 0.655 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -125.29 -119.29 0.27 Allowed 'General case' 0 C--N 1.323 -0.577 0 O-C-N 122.812 -0.228 . . . . 0.0 110.686 -177.233 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 920' ' ' ASP . . . . . 0.543 ' H ' ' HB3' ' A' ' 919' ' ' MET . 20.1 t70 173.29 -68.28 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 123.683 0.793 . . . . 0.0 109.429 174.252 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 25.5 m -128.67 137.73 51.79 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.065 -177.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 922' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -103.42 129.89 50.63 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.54 -179.666 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 923' ' ' LEU . . . . . . . . . . . . . 14.3 mt -126.11 178.0 6.04 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.126 -179.763 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -108.27 148.04 30.57 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 176.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 925' ' ' LYS . . . . . 0.456 ' N ' ' HD2' ' A' ' 926' ' ' PRO . 0.8 OUTLIER -67.16 -48.76 47.69 Favored Pre-proline 0 CA--C 1.533 0.316 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.298 177.881 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 926' ' ' PRO . . . . . 0.456 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 56.2 Cg_endo -71.58 64.88 3.01 Favored 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 121.914 1.743 . . . . 0.0 111.789 172.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -105.9 149.17 9.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.603 -178.801 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.91 153.9 40.8 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.89 179.688 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 929' ' ' LEU . . . . . 0.545 ' CD2' ' HG3' ' A' ' 843' ' ' GLN . 1.1 tm? -59.95 -31.78 70.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.005 -176.898 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -71.26 -26.53 62.93 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.971 -178.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 21.3 t -78.54 -44.98 26.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.839 -0.164 . . . . 0.0 111.314 -178.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 932' ' ' ILE . . . . . 0.465 HG12 HD22 ' A' ' 936' ' ' LEU . 0.0 OUTLIER -60.61 -41.86 89.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 174.775 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -44.72 96.18 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.651 176.402 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 934' ' ' GLN . . . . . 0.549 ' O ' ' HB2' ' A' ' 938' ' ' LEU . 0.7 OUTLIER -58.16 -53.09 62.25 Favored 'General case' 0 C--O 1.222 -0.39 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.05 179.888 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 4.0 m -61.46 -43.23 99.24 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.812 0.339 . . . . 0.0 111.309 -177.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 936' ' ' LEU . . . . . 0.843 HD11 HD11 ' A' ' 873' ' ' LEU . 0.0 OUTLIER -64.55 -51.32 63.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.954 -179.178 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 24.0 m -66.61 -39.38 88.34 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.381 -176.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 938' ' ' LEU . . . . . 0.549 ' HB2' ' O ' ' A' ' 934' ' ' GLN . 0.3 OUTLIER -61.94 -47.46 84.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.813 -179.277 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 939' ' ' TYR . . . . . 0.429 ' O ' HG22 ' A' ' 943' ' ' VAL . 5.1 m-85 -76.68 -32.78 58.14 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.002 -177.253 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -61.85 -49.38 76.48 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.86 0.362 . . . . 0.0 110.564 177.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 941' ' ' GLU . . . . . 0.599 ' O ' ' HB3' ' A' ' 945' ' ' LYS . 7.9 pt-20 -67.08 -30.71 70.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.36 179.29 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 942' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.71 -49.27 54.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.565 -178.443 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 943' ' ' VAL . . . . . 0.429 HG22 ' O ' ' A' ' 939' ' ' TYR . 18.5 m -70.38 -34.13 56.83 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 CA-C-O 121.263 0.554 . . . . 0.0 110.282 -178.653 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.56 -18.62 61.61 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.287 176.457 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 945' ' ' LYS . . . . . 0.599 ' HB3' ' O ' ' A' ' 941' ' ' GLU . 0.0 OUTLIER -85.17 -23.37 28.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.727 179.31 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -74.06 -39.74 63.28 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.971 0.415 . . . . 0.0 110.137 173.683 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 6.8 mtt180 -72.8 -50.01 26.97 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.202 176.006 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -117.03 102.44 9.34 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.977 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 C--O 1.251 1.142 0 CA-C-O 118.85 -0.595 . . . . 0.0 111.144 -174.975 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 0.98 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 178.68 -128.72 1.29 Allowed Glycine 0 N--CA 1.447 -0.633 0 N-CA-C 111.604 -0.599 . . . . 0.0 111.604 179.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . 92.37 94.84 1.4 Allowed Glycine 0 N--CA 1.448 -0.539 0 C-N-CA 120.828 -0.701 . . . . 0.0 111.805 179.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -83.78 103.03 12.74 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 120.86 0.362 . . . . 0.0 111.415 -177.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . -89.24 118.11 5.1 Favored Glycine 0 N--CA 1.449 -0.496 0 N-CA-C 110.391 -1.083 . . . . 0.0 110.391 172.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 18.0 m -132.97 157.07 42.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -172.28 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 76.22 157.05 0.18 Allowed 'General case' 0 C--O 1.234 0.271 0 CA-C-N 114.85 -1.068 . . . . 0.0 112.622 169.479 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . 89.94 -61.93 3.34 Favored Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 115.039 -0.982 . . . . 0.0 113.13 173.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.712 ' HA ' ' H ' ' A' ' 802' ' ' GLU . 1.5 mt 65.76 -74.62 0.06 Allowed 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -169.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 1.3 m 70.44 116.04 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 167.486 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 94.18 -11.19 70.93 Favored Glycine 0 C--N 1.33 0.238 0 CA-C-N 115.416 -0.811 . . . . 0.0 114.187 166.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 707' ' ' LYS . . . . . 0.413 ' HD2' ' H ' ' A' ' 708' ' ' ARG . 0.1 OUTLIER -81.85 142.16 32.78 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 117.377 0.589 . . . . 0.0 111.196 -176.968 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 708' ' ' ARG . . . . . 0.48 ' HA ' HG23 ' A' ' 732' ' ' VAL . 0.0 OUTLIER -95.18 143.1 26.88 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.164 178.87 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -117.82 119.06 33.73 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 174.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 710' ' ' TRP . . . . . 0.419 ' O ' HD23 ' A' ' 747' ' ' LEU . 77.4 m95 -91.56 115.7 28.26 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 711' ' ' LEU . . . . . 0.444 HD22 HG12 ' A' ' 733' ' ' VAL . 0.7 OUTLIER -119.74 129.72 54.64 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.476 0.655 . . . . 0.0 110.945 -178.576 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -126.43 56.88 1.44 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.019 175.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 713' ' ' VAL . . . . . 0.821 HG13 ' HB3' ' A' ' 750' ' ' ASP . 24.0 t -107.23 118.3 54.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 115.031 -0.986 . . . . 0.0 109.713 179.158 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.46 -3.17 58.5 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.402 0.62 . . . . 0.0 110.005 -179.425 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 715' ' ' ASN . . . . . 0.617 ' HB3' ' HB2' ' A' ' 718' ' ' LEU . 1.8 m-80 -86.74 103.13 14.89 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.507 -0.769 . . . . 0.0 109.553 175.687 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 716' ' ' ALA . . . . . 0.56 ' HA ' ' SG ' ' A' ' 719' ' ' CYS . . . -54.6 -46.78 73.87 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -172.346 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.2 -39.42 93.95 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.141 0.496 . . . . 0.0 110.714 -179.756 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 718' ' ' LEU . . . . . 0.617 ' HB2' ' HB3' ' A' ' 715' ' ' ASN . 0.2 OUTLIER -69.5 -50.06 48.82 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.089 -178.911 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 719' ' ' CYS . . . . . 0.732 ' HB3' ' HB ' ' A' ' 713' ' ' VAL . 31.9 p -67.61 -39.51 84.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.687 -176.411 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 720' ' ' GLN . . . . . 0.433 ' HA ' ' OE1' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -59.59 -43.98 93.51 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.335 178.277 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -59.33 -49.6 77.19 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.831 0.348 . . . . 0.0 110.998 -178.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 722' ' ' LEU . . . . . 0.485 HD23 ' HG3' ' A' ' 792' ' ' PRO . 4.8 mt -65.83 -45.34 82.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.785 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 723' ' ' GLU . . . . . 0.591 ' HG2' ' N ' ' A' ' 724' ' ' THR . 0.0 OUTLIER -57.82 -49.19 77.47 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.822 -177.204 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 724' ' ' THR . . . . . 0.591 ' N ' ' HG2' ' A' ' 723' ' ' GLU . 6.1 m -67.15 -36.77 82.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.304 -174.616 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 27.7 m -69.91 -35.95 74.98 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.02 0.438 . . . . 0.0 111.022 179.544 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 726' ' ' LEU . . . . . 0.58 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 29.4 mt -75.74 -44.16 43.18 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.305 -177.845 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.65 -25.88 65.05 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.888 0.375 . . . . 0.0 110.394 177.649 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 728' ' ' ARG . . . . . 0.582 ' HB2' ' O ' ' A' ' 724' ' ' THR . 0.0 OUTLIER -65.74 -33.57 76.17 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.582 175.57 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 19.0 m -85.4 -56.7 3.39 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.002 -177.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 730' ' ' GLY . . . . . . . . . . . . . . . 155.42 28.2 0.03 OUTLIER Glycine 0 N--CA 1.453 -0.172 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.617 -179.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 731' ' ' ILE . . . . . 0.58 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 11.1 mm -113.66 129.73 68.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 178.549 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 732' ' ' VAL . . . . . 0.48 HG23 ' HA ' ' A' ' 708' ' ' ARG . 3.9 m -85.62 114.83 26.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.445 0.641 . . . . 0.0 110.707 -179.203 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 733' ' ' VAL . . . . . 0.446 HG11 ' HB2' ' A' ' 723' ' ' GLU . 0.0 OUTLIER -78.19 115.22 19.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.661 -177.637 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -121.92 126.37 48.49 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.434 179.705 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.41 127.84 34.14 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.911 177.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -73.59 90.79 1.8 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.303 0.573 . . . . 0.0 110.037 177.641 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -73.53 -73.75 0.2 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.085 176.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -168.74 63.56 0.19 Allowed Glycine 0 N--CA 1.449 -0.494 0 N-CA-C 111.078 -0.809 . . . . 0.0 111.078 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -103.67 155.2 18.75 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.62 0.248 . . . . 0.0 110.632 -175.403 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 740' ' ' GLU . . . . . 0.491 ' CD ' ' H ' ' A' ' 740' ' ' GLU . 1.5 pm0 -71.47 129.58 88.59 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 116.112 -0.494 . . . . 0.0 109.708 177.53 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 741' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -57.64 122.81 12.39 Favored 'Trans proline' 0 C--O 1.233 0.244 0 C-N-CA 122.938 2.425 . . . . 0.0 112.912 -175.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 742' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -93.78 129.23 38.77 Favored Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.146 176.717 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 743' ' ' PRO . . . . . 0.595 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 41.2 Cg_endo -67.22 -5.73 14.48 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 123.087 2.525 . . . . 0.0 113.328 -175.324 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -112.57 4.98 17.63 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.662 0.268 . . . . 0.0 110.62 176.286 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 745' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -112.6 157.99 20.53 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.167 0.508 . . . . 0.0 110.849 -175.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 746' ' ' VAL . . . . . 0.54 HG21 HD11 ' A' ' 795' ' ' LEU . 10.2 m -120.57 147.76 24.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.601 -178.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 747' ' ' LEU . . . . . 0.419 HD23 ' O ' ' A' ' 710' ' ' TRP . 0.1 OUTLIER -119.78 107.82 13.65 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.098 178.91 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 6.7 mt -94.66 108.44 20.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 176.202 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 4.8 t -121.36 165.52 15.41 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.655 -0.248 . . . . 0.0 110.63 -176.154 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 750' ' ' ASP . . . . . 0.821 ' HB3' HG13 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -122.93 148.22 45.71 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.032 0.444 . . . . 0.0 111.306 179.357 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 61.2 -119.64 0.77 Allowed 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.064 -177.032 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 752' ' ' VAL . . . . . . . . . . . . . 29.9 t -125.51 93.8 2.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.041 0.448 . . . . 0.0 111.002 -175.542 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 9.8 p -74.74 -21.96 17.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.868 178.162 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 55.42 53.95 9.19 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.108 -179.025 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.25 134.33 32.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.847 -177.622 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 756' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -90.25 85.9 6.36 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 175.558 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 757' ' ' TRP . . . . . . . . . . . . . 77.1 t-105 -68.97 94.47 0.64 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.901 179.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 61.2 mt-30 -82.61 67.59 8.72 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.298 0.57 . . . . 0.0 109.964 176.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 759' ' ' GLY . . . . . 0.595 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -128.91 -136.9 4.22 Favored Glycine 0 N--CA 1.44 -1.071 0 CA-C-N 115.64 -0.709 . . . . 0.0 112.188 -178.44 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 7.5 ttm-85 -86.43 -47.84 8.96 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.818 0.342 . . . . 0.0 110.456 178.1 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 761' ' ' ALA . . . . . 0.402 ' O ' ' HA ' ' A' ' 746' ' ' VAL . . . -164.66 138.42 5.08 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.921 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 2.4 p -113.92 130.53 67.92 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 172.44 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 763' ' ' VAL . . . . . 0.641 HG11 HD21 ' A' ' 791' ' ' LEU . 0.7 OUTLIER -115.65 113.13 42.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-O 120.971 0.415 . . . . 0.0 110.5 -178.032 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 764' ' ' THR . . . . . 0.5 ' HB ' HG12 ' A' ' 782' ' ' VAL . 44.5 m -102.66 112.78 25.71 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.983 -175.509 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 765' ' ' PHE . . . . . 0.683 ' HE1' HG23 ' A' ' 785' ' ' VAL . 6.2 m-85 -88.58 105.72 17.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.818 174.706 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.23 134.02 37.13 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.691 0.281 . . . . 0.0 110.949 -173.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 767' ' ' ARG . . . . . 0.417 ' HA ' ' HD3' ' A' ' 767' ' ' ARG . 0.1 OUTLIER -112.66 -64.52 1.29 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.114 -178.092 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.15 -31.97 3.52 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.783 0.325 . . . . 0.0 111.395 -176.152 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 9.6 t-80 -115.31 133.5 55.97 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.182 0.515 . . . . 0.0 110.779 -177.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 2.0 mt -106.07 158.77 6.28 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.459 176.322 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -175.78 -37.76 0.05 OUTLIER Glycine 0 CA--C 1.507 -0.468 0 N-CA-C 110.806 -0.918 . . . . 0.0 110.806 -178.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 772' ' ' ILE . . . . . . . . . . . . . 1.6 mm -83.8 133.92 45.36 Favored Pre-proline 0 C--N 1.324 -0.52 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 172.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 773' ' ' PRO . . . . . 0.563 ' O ' ' HB3' ' A' ' 774' ' ' LEU . 23.6 Cg_endo -62.41 -92.86 0.0 OUTLIER 'Trans proline' 0 CA--C 1.535 0.531 0 C-N-CA 122.93 2.42 . . . . 0.0 113.75 -175.633 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . 0.665 ' HA ' HG13 ' A' ' 782' ' ' VAL . 1.3 pt? 165.98 -171.8 0.01 OUTLIER 'General case' 0 C--O 1.234 0.268 0 C-N-CA 123.147 0.579 . . . . 0.0 110.218 -174.569 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 775' ' ' GLU . . . . . 0.606 ' HG3' ' HA ' ' A' ' 781' ' ' TRP . 1.5 mp0 -62.07 69.18 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 O-C-N 123.834 0.709 . . . . 0.0 112.036 172.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 18.7 pttt -128.79 7.87 5.7 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 172.489 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 777' ' ' ALA . . . . . 0.433 ' HA ' ' HD3' ' A' ' 778' ' ' PRO . . . -145.07 149.37 41.84 Favored Pre-proline 0 N--CA 1.449 -0.515 0 CA-C-N 114.348 -1.296 . . . . 0.0 109.122 -179.157 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 778' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 777' ' ' ALA . 24.7 Cg_exo -64.16 93.92 0.19 Allowed 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.72 2.28 . . . . 0.0 112.407 -179.452 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 112.15 19.62 7.1 Favored Glycine 0 C--O 1.228 -0.255 0 C-N-CA 120.923 -0.656 . . . . 0.0 113.2 176.794 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 780' ' ' GLU . . . . . 0.522 ' O ' ' HA ' ' A' ' 775' ' ' GLU . 0.1 OUTLIER -119.73 124.88 47.29 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 177.593 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 781' ' ' TRP . . . . . 0.606 ' HA ' ' HG3' ' A' ' 775' ' ' GLU . 17.0 m95 -137.24 136.02 37.73 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 -176.556 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . 0.665 HG13 ' HA ' ' A' ' 774' ' ' LEU . 32.6 m -129.69 155.67 41.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.981 0.419 . . . . 0.0 110.875 176.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 783' ' ' HIS . . . . . 0.537 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.2 OUTLIER -161.18 126.92 3.77 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.931 176.189 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 784' ' ' SER . . . . . 0.404 ' O ' HG13 ' A' ' 785' ' ' VAL . 0.9 OUTLIER -96.67 99.48 11.09 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 120.874 0.369 . . . . 0.0 110.03 177.703 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 785' ' ' VAL . . . . . 0.683 HG23 ' HE1' ' A' ' 765' ' ' PHE . 0.0 OUTLIER -171.24 -170.52 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.225 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -179.747 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -123.67 56.72 1.2 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.733 0.301 . . . . 0.0 110.824 178.111 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 787' ' ' ALA . . . . . 0.463 ' HB2' HD23 ' A' ' 718' ' ' LEU . . . 53.57 63.23 8.31 Favored Pre-proline 0 N--CA 1.467 0.382 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.34 178.717 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 788' ' ' PRO . . . . . 0.615 ' HD2' ' OE1' ' A' ' 790' ' ' GLU . 5.2 Cg_exo -76.01 43.27 1.1 Allowed 'Trans proline' 0 CA--C 1.534 0.498 0 C-N-CA 123.086 2.524 . . . . 0.0 113.292 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 69.71 -0.02 2.82 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 171.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 790' ' ' GLU . . . . . 0.615 ' OE1' ' HD2' ' A' ' 788' ' ' PRO . 0.0 OUTLIER -94.55 -46.08 7.13 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 121.882 -0.511 . . . . 0.0 111.305 -177.447 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 791' ' ' LEU . . . . . 0.641 HD21 HG11 ' A' ' 763' ' ' VAL . 0.2 OUTLIER -58.82 -45.05 99.64 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -179.926 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 792' ' ' PRO . . . . . 0.485 ' HG3' HD23 ' A' ' 722' ' ' LEU . 51.7 Cg_exo -54.17 -31.87 67.7 Favored 'Trans proline' 0 C--N 1.356 0.941 0 C-N-CA 121.717 1.611 . . . . 0.0 111.974 175.917 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -70.44 -44.37 67.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.774 179.006 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 794' ' ' LEU . . . . . 0.552 ' HA ' ' HG2' ' A' ' 797' ' ' ARG . 0.3 OUTLIER -71.55 -28.76 64.09 Favored 'General case' 0 C--O 1.219 -0.51 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.732 179.784 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 795' ' ' LEU . . . . . 0.54 HD11 HG21 ' A' ' 746' ' ' VAL . 0.1 OUTLIER -62.99 -39.42 94.69 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.116 0.484 . . . . 0.0 110.072 177.037 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -62.94 -48.85 77.13 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.262 177.522 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 797' ' ' ARG . . . . . 0.748 ' HA ' HD23 ' A' ' 800' ' ' LEU . 8.8 ptp180 -71.45 -32.99 68.95 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.684 -177.541 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 798' ' ' ILE . . . . . 0.432 ' HB ' ' O ' ' A' ' 794' ' ' LEU . 0.1 OUTLIER -60.95 -34.01 57.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.622 0.249 . . . . 0.0 111.061 175.569 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 799' ' ' TYR . . . . . 0.44 ' HD1' ' HA ' ' A' ' 799' ' ' TYR . 0.5 OUTLIER -83.19 -61.48 1.84 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.658 -0.246 . . . . 0.0 110.424 177.631 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 800' ' ' LEU . . . . . 0.748 HD23 ' HA ' ' A' ' 797' ' ' ARG . 0.2 OUTLIER 48.45 74.94 0.15 Allowed 'General case' 0 N--CA 1.468 0.436 0 O-C-N 123.666 0.604 . . . . 0.0 112.122 178.661 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 801' ' ' ILE . . . . . 0.444 HD12 HD23 ' A' ' 704' ' ' LEU . 1.4 mp -104.89 -50.14 8.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 178.62 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 802' ' ' GLU . . . . . 0.712 ' H ' ' HA ' ' A' ' 704' ' ' LEU . 1.0 OUTLIER 49.0 42.75 21.32 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.521 176.909 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 803' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -81.87 138.16 35.11 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.166 -177.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 804' ' ' GLU . . . . . 0.475 ' H ' ' HG2' ' A' ' 804' ' ' GLU . 0.3 OUTLIER -74.31 107.41 6.46 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.016 178.663 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.64 170.26 14.86 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.186 0.517 . . . . 0.0 111.552 -177.361 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -139.36 -71.97 0.39 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.386 178.174 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 3.8 t70 52.54 81.13 0.27 Allowed Pre-proline 0 N--CA 1.468 0.454 0 O-C-N 123.597 0.561 . . . . 0.0 111.761 176.107 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 808' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.14 162.49 41.56 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.781 2.321 . . . . 0.0 112.71 -177.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -89.8 171.12 9.85 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.987 -179.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 33.9 t30 -151.9 142.74 22.96 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.14 179.047 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -125.71 151.29 46.81 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.995 0.426 . . . . 0.0 111.201 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -132.3 127.76 20.95 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.577 177.51 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -83.09 174.58 9.18 Favored 'Trans proline' 0 N--CA 1.462 -0.331 0 C-N-CA 123.016 2.477 . . . . 0.0 113.085 -176.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 1.2 m -135.98 145.38 46.09 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.915 176.691 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.87 82.8 1.83 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.391 0.615 . . . . 0.0 111.054 -179.2 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -90.72 154.55 19.46 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.07 -178.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.36 165.54 35.49 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 120.777 0.323 . . . . 0.0 110.966 -178.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -144.93 140.97 28.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.947 175.564 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -119.17 118.22 56.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.925 0.393 . . . . 0.0 111.253 -177.694 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -93.52 -156.98 0.51 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.475 -178.755 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -114.31 158.83 20.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.563 -179.778 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -104.81 -101.56 0.32 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.943 -176.677 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 5.1 t70 51.46 101.08 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.634 0.774 . . . . 0.0 111.869 -174.069 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 824' ' ' ASP . . . . . 0.4 ' HB3' ' H ' ' A' ' 825' ' ' MET . 19.2 t0 -90.77 -100.77 0.1 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.816 -173.428 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 825' ' ' MET . . . . . 0.563 ' O ' ' HB2' ' A' ' 850' ' ' GLN . 0.0 OUTLIER -115.76 139.0 50.58 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.915 -175.551 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 826' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -105.39 123.13 47.36 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.041 -176.496 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 827' ' ' ILE . . . . . 0.58 HG23 ' HB ' ' A' ' 871' ' ' ILE . 1.2 mm -119.87 124.28 72.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.699 177.786 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 828' ' ' LEU . . . . . 0.678 HD12 ' HB3' ' A' ' 852' ' ' LYS . 3.1 tp -109.01 123.31 48.92 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.648 0.261 . . . . 0.0 110.699 -178.229 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 829' ' ' VAL . . . . . 0.76 HG12 HD12 ' A' ' 873' ' ' LEU . 27.0 m -105.43 128.36 59.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.822 177.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 830' ' ' VAL . . . . . 0.502 ' HA ' ' O ' ' A' ' 854' ' ' ALA . 0.2 OUTLIER -126.09 87.48 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 116.771 -0.195 . . . . 0.0 111.047 -177.775 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 831' ' ' ASP . . . . . 0.578 ' HA ' ' O ' ' A' ' 875' ' ' ASP . 9.9 t70 -107.67 137.97 44.73 Favored 'General case' 0 CA--C 1.515 -0.397 0 C-N-CA 120.631 -0.428 . . . . 0.0 110.388 -178.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.38 -31.2 72.29 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.125 -178.307 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 833' ' ' HIS . . . . . 0.434 ' HA ' ' HD3' ' A' ' 834' ' ' PRO . 0.2 OUTLIER -108.81 128.77 24.9 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-O 120.781 0.324 . . . . 0.0 111.697 -173.549 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 834' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 833' ' ' HIS . 67.6 Cg_exo -53.81 -45.26 42.3 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 123.51 2.807 . . . . 0.0 113.584 -178.711 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 835' ' ' ILE . . . . . 0.445 ' HA ' ' HD2' ' A' ' 838' ' ' ARG . 1.1 pt -65.35 -37.17 79.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 121.074 0.464 . . . . 0.0 110.778 -179.29 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 836' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -72.06 -45.47 60.61 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.692 179.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 837' ' ' ARG . . . . . . . . . . . . . 19.2 ttp180 -53.73 -47.73 70.32 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.377 -0.828 . . . . 0.0 111.07 177.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 838' ' ' ARG . . . . . 0.445 ' HD2' ' HA ' ' A' ' 835' ' ' ILE . 0.0 OUTLIER -66.01 -29.6 70.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.806 -179.827 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.92 -51.4 62.06 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.727 179.475 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 840' ' ' LEU . . . . . 0.496 ' H ' ' HG ' ' A' ' 840' ' ' LEU . 0.0 OUTLIER -72.32 -29.6 63.99 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.673 0.273 . . . . 0.0 110.873 -179.859 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -66.65 -31.14 71.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.045 0.45 . . . . 0.0 110.442 176.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -68.5 -44.16 75.29 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.806 175.05 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 843' ' ' GLN . . . . . 0.622 ' HG3' HD23 ' A' ' 929' ' ' LEU . 0.0 OUTLIER -60.39 -52.42 65.32 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.861 178.929 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 844' ' ' LEU . . . . . 0.526 ' HG ' HD23 ' A' ' 847' ' ' LEU . 0.2 OUTLIER -61.63 -31.62 71.72 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.91 177.555 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -65.36 -33.63 87.17 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 121.122 -0.561 . . . . 0.0 112.364 177.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.29 -22.85 51.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.963 0.411 . . . . 0.0 110.291 175.721 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 847' ' ' LEU . . . . . 0.526 HD23 ' HG ' ' A' ' 844' ' ' LEU . 1.0 OUTLIER -72.98 -44.33 61.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.06 177.478 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 100.19 25.48 8.88 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.54 -0.838 . . . . 0.0 113.912 172.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 6.0 m-30 -103.68 169.12 8.71 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 117.254 0.527 . . . . 0.0 109.865 176.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 850' ' ' GLN . . . . . 0.563 ' HB2' ' O ' ' A' ' 825' ' ' MET . 2.2 mt-30 -69.1 111.33 5.0 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 110.368 -0.234 . . . . 0.0 110.368 -178.577 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -98.63 112.94 24.84 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.055 0.455 . . . . 0.0 111.409 -175.092 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 852' ' ' LYS . . . . . 0.678 ' HB3' HD12 ' A' ' 828' ' ' LEU . 0.2 OUTLIER -101.56 110.48 22.48 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 173.851 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.26 117.6 29.78 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.666 -175.868 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 854' ' ' ALA . . . . . 0.502 ' O ' ' HA ' ' A' ' 830' ' ' VAL . . . -136.83 162.28 33.65 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.626 178.796 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 26.7 p-10 -153.01 75.53 1.09 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.095 0.474 . . . . 0.0 111.689 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 856' ' ' ASP . . . . . . . . . . . . . 27.9 t70 173.1 150.94 0.07 Allowed 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.176 176.159 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -72.33 -47.85 27.28 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 121.183 -0.532 . . . . 0.0 112.656 -179.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -73.16 -34.14 43.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.027 0.442 . . . . 0.0 110.232 -177.099 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -61.49 -35.14 76.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.793 176.005 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 860' ' ' ALA . . . . . 0.427 ' O ' HG12 ' A' ' 863' ' ' VAL . . . -66.28 -39.5 89.43 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.681 177.573 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 861' ' ' LEU . . . . . 0.625 HD11 ' HB3' ' A' ' 889' ' ' ARG . 1.9 mt -67.17 -40.92 86.66 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.156 0.503 . . . . 0.0 110.337 177.348 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -63.0 -45.72 91.06 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.522 178.692 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 863' ' ' VAL . . . . . 0.427 HG12 ' O ' ' A' ' 860' ' ' ALA . 0.3 OUTLIER -66.36 -31.99 56.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.918 179.913 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 864' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.6 -35.75 80.55 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.913 0.387 . . . . 0.0 110.084 175.851 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 2.2 m -74.4 -37.97 63.24 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.438 178.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -65.03 -54.03 36.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.164 -179.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -144.17 143.19 30.98 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.505 -179.416 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -73.5 140.56 46.48 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.962 -179.742 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 869' ' ' ILE . . . . . . . . . . . . . 1.9 mp -120.55 134.05 65.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 179.023 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -74.88 -55.46 5.78 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.039 0.447 . . . . 0.0 110.617 -177.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 871' ' ' ILE . . . . . 0.58 ' HB ' HG23 ' A' ' 827' ' ' ILE . 28.4 mm -117.2 120.83 66.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.157 -177.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 872' ' ' VAL . . . . . 0.532 HG21 HD12 ' A' ' 897' ' ' LEU . 0.0 OUTLIER -105.82 125.56 61.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.821 -178.055 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 873' ' ' LEU . . . . . 0.76 HD12 HG12 ' A' ' 829' ' ' VAL . 26.5 mt -110.95 108.77 18.64 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 177.01 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 2.1 m -94.39 96.72 9.71 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 177.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 875' ' ' ASP . . . . . 0.578 ' O ' ' HA ' ' A' ' 831' ' ' ASP . 3.1 m-20 -93.03 104.41 16.63 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.822 0.82 . . . . 0.0 110.78 -173.762 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 876' ' ' VAL . . . . . 0.635 ' HB ' HG23 ' A' ' 903' ' ' THR . 0.2 OUTLIER -104.65 89.07 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.752 -178.244 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -68.54 -43.45 76.67 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 174.683 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 10.6 ptm -154.32 148.94 19.58 Favored Pre-proline 0 N--CA 1.452 -0.346 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.496 173.022 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 879' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -75.0 58.43 4.89 Favored 'Trans proline' 0 N--CA 1.464 -0.244 0 C-N-CA 122.682 2.255 . . . . 0.0 111.796 178.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 44.6 t30 -73.09 -57.09 4.28 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.993 -178.372 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.61 -59.64 2.66 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.699 -179.528 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -166.16 152.25 9.01 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.526 -178.347 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -149.36 22.77 1.22 Allowed Glycine 0 N--CA 1.443 -0.866 0 C-N-CA 121.056 -0.592 . . . . 0.0 111.951 178.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -149.17 -36.99 0.17 Allowed 'General case' 0 C--O 1.235 0.312 0 CA-C-O 120.47 0.176 . . . . 0.0 111.462 -179.727 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -68.44 -46.24 70.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.495 -176.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -55.89 -49.78 72.48 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.394 177.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.1 -45.35 87.36 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.437 -177.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -64.67 -49.99 68.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.929 179.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 889' ' ' ARG . . . . . 0.625 ' HB3' HD11 ' A' ' 861' ' ' LEU . 0.0 OUTLIER -64.15 -41.16 97.29 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.853 -174.659 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 890' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -68.5 -40.41 82.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 111.511 0.189 . . . . 0.0 111.511 -176.646 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 891' ' ' ARG . . . . . 0.428 ' HB3' ' HA2' ' A' ' 918' ' ' GLY . 0.4 OUTLIER -75.31 -24.38 57.44 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.068 0.461 . . . . 0.0 110.425 178.988 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -73.36 -54.79 7.48 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.795 178.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 893' ' ' LEU . . . . . 0.454 HD13 ' HA ' ' A' ' 893' ' ' LEU . 1.8 mm? -67.2 -50.85 59.37 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.306 -174.489 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 166.46 82.96 0.05 OUTLIER Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 119.775 -1.202 . . . . 0.0 112.887 -178.223 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 895' ' ' LEU . . . . . . . . . . . . . 4.6 tp -89.93 109.33 20.36 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 175.462 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.16 6.26 5.9 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.054 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 897' ' ' LEU . . . . . 0.532 HD12 HG21 ' A' ' 872' ' ' VAL . 0.0 OUTLIER -123.81 141.22 36.22 Favored Pre-proline 0 C--N 1.325 -0.461 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 179.89 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -61.8 114.67 2.38 Favored 'Trans proline' 0 C--O 1.236 0.422 0 C-N-CA 122.799 2.333 . . . . 0.0 112.847 -176.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 899' ' ' VAL . . . . . 0.665 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 27.1 t -98.64 113.4 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-O 121.361 0.601 . . . . 0.0 110.257 177.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 900' ' ' ILE . . . . . 0.422 HG13 ' OG ' ' A' ' 921' ' ' SER . 1.7 mp -85.63 112.5 22.45 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.688 176.648 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -89.87 104.33 3.11 Favored Glycine 0 N--CA 1.443 -0.878 0 C-N-CA 120.595 -0.812 . . . . 0.0 111.464 177.486 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 902' ' ' VAL . . . . . 0.813 HG22 ' HE2' ' A' ' 925' ' ' LYS . 0.2 OUTLIER -110.59 103.34 15.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.632 0.729 . . . . 0.0 109.663 179.537 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 903' ' ' THR . . . . . 0.635 HG23 ' HB ' ' A' ' 876' ' ' VAL . 0.2 OUTLIER -108.64 149.13 29.37 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.356 -174.44 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -94.76 135.87 35.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.668 175.336 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 61.28 -156.77 0.34 Allowed 'General case' 0 C--N 1.33 -0.268 0 O-C-N 123.676 0.61 . . . . 0.0 110.247 -176.328 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . 68.92 -71.84 0.11 Allowed 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.39 0.676 . . . . 0.0 111.959 176.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 97.6 mt 68.92 176.33 0.27 Allowed 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 123.203 0.601 . . . . 0.0 111.069 -179.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . 65.49 30.36 10.78 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.518 0.675 . . . . 0.0 109.759 -173.189 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -67.65 -18.02 64.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.842 -1.072 . . . . 0.0 111.546 -174.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 910' ' ' GLU . . . . . 0.441 ' HA ' ' SG ' ' A' ' 922' ' ' CYS . 0.4 OUTLIER -66.13 -42.02 89.69 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.956 0.408 . . . . 0.0 109.963 176.431 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 911' ' ' LYS . . . . . 0.418 ' HE2' HD12 ' A' ' 915' ' ' LEU . 0.0 OUTLIER -73.3 -34.05 65.53 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.043 178.902 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -66.1 -43.33 87.57 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.859 178.365 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 913' ' ' ARG . . . . . 0.465 ' HA ' ' SD ' ' A' ' 919' ' ' MET . 0.0 OUTLIER -63.12 -35.67 81.05 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.71 179.649 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 82.6 m -71.8 -37.23 70.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.902 0.382 . . . . 0.0 110.349 176.588 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 915' ' ' LEU . . . . . 0.418 HD12 ' HE2' ' A' ' 911' ' ' LYS . 0.2 OUTLIER -62.53 -51.76 66.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.168 -179.252 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -77.5 -33.0 54.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.299 -177.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.21 48.84 22.29 Favored 'General case' 0 N--CA 1.464 0.266 0 O-C-N 123.675 0.61 . . . . 0.0 111.433 -177.402 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 918' ' ' GLY . . . . . 0.428 ' HA2' ' HB3' ' A' ' 891' ' ' ARG . . . -140.15 25.02 2.66 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.295 -178.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 919' ' ' MET . . . . . 0.665 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -129.72 -111.66 0.26 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.623 0.249 . . . . 0.0 110.757 -177.473 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 920' ' ' ASP . . . . . . . . . . . . . 10.8 t70 169.33 -60.13 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 123.986 0.914 . . . . 0.0 109.034 177.375 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . 0.422 ' OG ' HG13 ' A' ' 900' ' ' ILE . 0.0 OUTLIER -123.17 170.08 10.6 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.808 178.363 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 922' ' ' CYS . . . . . 0.441 ' SG ' ' HA ' ' A' ' 910' ' ' GLU . 0.8 OUTLIER -144.64 130.39 19.15 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.7 0.286 . . . . 0.0 110.804 -179.34 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 923' ' ' LEU . . . . . 0.544 ' O ' ' HA ' ' A' ' 902' ' ' VAL . 0.0 OUTLIER -139.04 165.62 26.67 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 177.327 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -87.43 147.9 25.22 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.004 177.804 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 925' ' ' LYS . . . . . 0.813 ' HE2' HG22 ' A' ' 902' ' ' VAL . 0.0 OUTLIER -47.56 -38.81 18.1 Favored Pre-proline 0 CA--C 1.539 0.545 0 N-CA-C 114.02 1.118 . . . . 0.0 114.02 -179.008 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -58.66 77.28 0.04 OUTLIER 'Trans proline' 0 C--N 1.358 1.066 0 C-N-CA 122.039 1.826 . . . . 0.0 112.777 170.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 88.9 t -107.76 97.05 5.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.872 178.202 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 928' ' ' THR . . . . . 0.405 ' O ' HG22 ' A' ' 932' ' ' ILE . 0.2 OUTLIER -71.87 170.26 14.07 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.436 -179.674 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 929' ' ' LEU . . . . . 0.622 HD23 ' HG3' ' A' ' 843' ' ' GLN . 0.7 OUTLIER -52.29 -45.84 65.65 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.139 -0.482 . . . . 0.0 112.06 -177.314 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 930' ' ' ASP . . . . . 0.463 ' HA ' ' HE3' ' A' ' 933' ' ' LYS . 0.5 OUTLIER -69.89 -33.6 72.43 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.764 -0.375 . . . . 0.0 110.437 -177.738 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 43.1 t -66.48 -52.12 49.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.768 -179.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 932' ' ' ILE . . . . . 0.498 HD11 HD12 ' A' ' 844' ' ' LEU . 3.8 tt -65.15 -36.4 77.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.92 0.391 . . . . 0.0 110.582 -179.023 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 933' ' ' LYS . . . . . 0.463 ' HE3' ' HA ' ' A' ' 930' ' ' ASP . 0.3 OUTLIER -68.2 -47.6 67.46 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.139 -179.398 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 934' ' ' GLN . . . . . 0.53 ' HG3' ' N ' ' A' ' 935' ' ' THR . 0.4 OUTLIER -68.34 -36.52 79.37 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.694 -0.23 . . . . 0.0 111.231 -177.551 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 935' ' ' THR . . . . . 0.53 ' N ' ' HG3' ' A' ' 934' ' ' GLN . 22.9 m -67.34 -43.89 80.45 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.896 0.379 . . . . 0.0 110.531 178.534 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 936' ' ' LEU . . . . . 0.501 HD13 ' HA ' ' A' ' 936' ' ' LEU . 0.2 OUTLIER -63.5 -47.5 81.45 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.639 179.073 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 34.2 m -62.92 -42.12 99.69 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.004 -179.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 938' ' ' LEU . . . . . 0.466 ' HB2' ' O ' ' A' ' 934' ' ' GLN . 0.6 OUTLIER -60.39 -45.24 94.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.022 179.505 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -78.63 -27.33 45.38 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.699 -175.295 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -64.3 -43.61 94.18 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.382 0.611 . . . . 0.0 110.089 174.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 941' ' ' GLU . . . . . 0.418 ' HG3' ' N ' ' A' ' 942' ' ' ARG . 0.0 OUTLIER -73.63 -29.67 62.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.109 177.152 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 942' ' ' ARG . . . . . 0.439 HH11 ' HD3' ' A' ' 942' ' ' ARG . 0.2 OUTLIER -65.9 -47.09 75.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.137 179.973 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 943' ' ' VAL . . . . . . . . . . . . . 27.5 m -68.17 -29.83 45.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.893 0.378 . . . . 0.0 110.439 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.4 -31.39 71.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.583 174.453 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 20.4 mmtm -70.06 -36.37 74.93 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.071 178.657 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.96 -45.12 12.49 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.409 -176.223 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 947' ' ' ARG . . . . . 0.41 ' HE ' ' HB3' ' A' ' 947' ' ' ARG . 0.1 OUTLIER -73.88 -52.59 12.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.28 -177.893 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -102.11 -140.15 0.35 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.71 0.291 . . . . 0.0 110.842 -175.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.246 0.894 0 CA-C-O 118.753 -0.641 . . . . 0.0 110.441 -176.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 1.7 ttt . . . . . 0 N--CA 1.478 0.942 0 CA-C-O 120.982 0.42 . . . . 0.0 110.07 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 177.27 46.37 0.06 OUTLIER Glycine 0 N--CA 1.446 -0.659 0 N-CA-C 111.054 -0.818 . . . . 0.0 111.054 -179.25 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . 171.82 148.23 6.05 Favored Glycine 0 N--CA 1.445 -0.764 0 C-N-CA 121.224 -0.512 . . . . 0.0 111.824 -176.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -110.51 -77.59 0.59 Allowed 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.83 0.348 . . . . 0.0 110.446 -179.509 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . -170.05 -156.76 11.41 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.981 -0.628 . . . . 0.0 111.636 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER 50.46 37.73 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-O 121.318 0.58 . . . . 0.0 111.083 -179.685 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -84.14 -24.78 30.08 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.154 -179.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . 147.21 121.78 1.3 Allowed Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.947 -0.644 . . . . 0.0 111.949 178.154 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 1.3 tp -81.29 -29.17 34.37 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 177.077 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 705' ' ' SER . . . . . 0.755 ' HA ' ' O ' ' A' ' 730' ' ' GLY . 0.9 OUTLIER -63.88 89.4 0.05 Allowed 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.619 172.74 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 154.71 -19.77 0.59 Allowed Glycine 0 N--CA 1.448 -0.513 0 N-CA-C 111.033 -0.827 . . . . 0.0 111.033 -175.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 707' ' ' LYS . . . . . . . . . . . . . 4.1 mmtt -77.48 130.99 37.72 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 174.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 708' ' ' ARG . . . . . 0.448 ' HA ' HG13 ' A' ' 732' ' ' VAL . 5.9 mtm-85 -95.64 139.55 31.73 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.235 0.54 . . . . 0.0 111.86 -171.06 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -122.39 116.58 24.26 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.612 174.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 710' ' ' TRP . . . . . 0.694 ' HB3' ' HB2' ' A' ' 736' ' ' TYR . 93.0 m95 -99.65 118.55 36.43 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.721 0.295 . . . . 0.0 110.298 -177.296 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 711' ' ' LEU . . . . . 0.525 HD23 ' C ' ' A' ' 710' ' ' TRP . 5.2 mt -111.25 118.15 35.13 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.836 0.351 . . . . 0.0 111.424 -176.038 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 712' ' ' ALA . . . . . 0.56 ' HB3' ' HB ' ' A' ' 749' ' ' THR . . . -108.08 44.53 1.1 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.573 0.701 . . . . 0.0 109.382 174.769 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 713' ' ' VAL . . . . . 0.843 HG13 ' HB3' ' A' ' 750' ' ' ASP . 16.3 t -100.29 124.84 54.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.583 -177.655 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 714' ' ' ARG . . . . . 0.409 HH11 ' HD3' ' A' ' 714' ' ' ARG . 2.1 mtp180 -88.73 -21.02 24.07 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 177.645 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 715' ' ' ASN . . . . . 0.414 ' HB3' ' HB2' ' A' ' 718' ' ' LEU . 3.7 m-80 -71.39 102.4 2.62 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.876 174.665 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 716' ' ' ALA . . . . . 0.549 ' O ' ' HB2' ' A' ' 720' ' ' GLN . . . -59.95 -35.93 75.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.333 -177.21 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.44 -46.35 88.92 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.134 0.492 . . . . 0.0 110.549 178.615 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 718' ' ' LEU . . . . . 0.576 ' HB3' HG11 ' A' ' 713' ' ' VAL . 0.3 OUTLIER -69.38 -48.98 59.52 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.84 -179.76 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 719' ' ' CYS . . . . . 0.656 ' HB2' ' HB ' ' A' ' 713' ' ' VAL . 12.2 t -60.92 -51.77 67.85 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.702 -177.354 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 720' ' ' GLN . . . . . 0.783 ' HA ' ' HG2' ' A' ' 723' ' ' GLU . 1.2 mt-30 -63.03 -36.28 83.05 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.767 -176.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -59.48 -52.89 63.63 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 121.169 0.509 . . . . 0.0 110.4 179.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 48.9 mt -66.9 -48.25 69.3 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.316 -178.034 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 723' ' ' GLU . . . . . 0.783 ' HG2' ' HA ' ' A' ' 720' ' ' GLN . 1.4 pt-20 -60.94 -44.76 96.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.825 -173.684 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 724' ' ' THR . . . . . 0.618 ' N ' ' HG3' ' A' ' 723' ' ' GLU . 16.0 m -64.75 -43.3 93.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.79 0.329 . . . . 0.0 110.775 -179.394 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 18.5 m -63.73 -40.16 96.05 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.342 179.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 726' ' ' LEU . . . . . 0.462 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 11.0 mt -71.95 -37.96 69.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.842 0.354 . . . . 0.0 111.211 -179.041 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 727' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -66.17 -15.25 62.98 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.862 0.363 . . . . 0.0 111.319 179.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.44 -16.12 60.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.096 0.474 . . . . 0.0 110.612 176.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -104.39 -1.08 27.34 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.157 0.503 . . . . 0.0 110.783 177.435 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 730' ' ' GLY . . . . . 0.755 ' O ' ' HA ' ' A' ' 705' ' ' SER . . . 98.13 -0.63 58.88 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.52 179.23 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 731' ' ' ILE . . . . . 0.462 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 36.6 mm -66.22 120.05 12.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 120.683 0.278 . . . . 0.0 110.402 -178.539 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 732' ' ' VAL . . . . . 0.448 HG13 ' HA ' ' A' ' 708' ' ' ARG . 1.5 p -78.22 98.14 2.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 122.028 0.918 . . . . 0.0 110.06 -179.384 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 733' ' ' VAL . . . . . 0.55 HG21 ' HA ' ' A' ' 723' ' ' GLU . 82.8 t -81.96 119.95 32.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 114.915 -1.039 . . . . 0.0 110.601 179.746 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.33 125.46 44.39 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.945 177.603 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -59.74 114.42 2.76 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.646 177.334 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 736' ' ' TYR . . . . . 0.694 ' HB2' ' HB3' ' A' ' 710' ' ' TRP . 65.1 t80 -72.19 95.31 1.65 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.96 -179.871 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 737' ' ' GLU . . . . . 0.519 ' H ' ' HG3' ' A' ' 737' ' ' GLU . 0.0 OUTLIER -92.86 -52.83 4.42 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.139 0.495 . . . . 0.0 109.912 176.82 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . -165.62 68.53 0.2 Allowed Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 111.083 -0.807 . . . . 0.0 111.083 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 15.7 mp0 -117.12 179.71 3.95 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.778 0.323 . . . . 0.0 110.581 -175.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -98.91 142.99 25.56 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.479 -179.123 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 741' ' ' PRO . . . . . 0.581 ' HB2' ' O ' ' A' ' 758' ' ' GLN . 71.8 Cg_endo -79.27 147.5 20.55 Favored 'Trans proline' 0 CA--C 1.532 0.414 0 C-N-CA 122.865 2.377 . . . . 0.0 113.446 -177.911 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 742' ' ' THR . . . . . 0.76 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.1 OUTLIER -132.61 144.24 52.11 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.597 179.122 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 743' ' ' PRO . . . . . 0.835 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 28.7 Cg_endo -62.5 -12.6 28.69 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 123.573 2.849 . . . . 0.0 113.777 -175.13 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 31.8 tp10 -98.08 -9.99 25.02 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.061 0.457 . . . . 0.0 110.792 179.39 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 745' ' ' ASP . . . . . 0.405 ' HB3' ' HD1' ' A' ' 710' ' ' TRP . 74.6 m-20 -106.65 158.47 16.93 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.321 -167.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 746' ' ' VAL . . . . . 0.511 HG11 HD11 ' A' ' 795' ' ' LEU . 6.4 p -126.64 138.56 54.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.731 -179.053 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 747' ' ' LEU . . . . . 0.49 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 0.0 OUTLIER -103.79 103.35 13.22 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.916 177.167 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 27.5 mt -94.93 107.64 19.75 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 175.377 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 749' ' ' THR . . . . . 0.56 ' HB ' ' HB3' ' A' ' 712' ' ' ALA . 1.9 t -119.92 148.19 43.81 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.611 -174.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 750' ' ' ASP . . . . . 0.843 ' HB3' HG13 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -109.54 126.32 53.44 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 176.421 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 751' ' ' GLU . . . . . 0.491 ' HB2' ' O ' ' A' ' 750' ' ' ASP . 3.6 mm-40 74.5 173.93 0.27 Allowed 'General case' 0 C--O 1.235 0.325 0 CA-C-N 114.684 -1.143 . . . . 0.0 110.372 -170.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 752' ' ' VAL . . . . . 0.837 HG13 HG13 ' A' ' 772' ' ' ILE . 27.7 t -81.31 102.82 7.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.243 -176.208 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 753' ' ' VAL . . . . . 0.626 HG13 ' HB2' ' A' ' 755' ' ' LYS . 7.1 p -80.7 -1.21 4.67 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.09 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 40.7 m 58.88 40.3 22.86 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.404 178.618 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 755' ' ' LYS . . . . . 0.626 ' HB2' HG13 ' A' ' 753' ' ' VAL . 0.0 OUTLIER -130.14 153.87 48.08 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.579 178.28 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 756' ' ' LYS . . . . . 0.542 ' O ' ' HD2' ' A' ' 756' ' ' LYS . 0.0 OUTLIER -95.78 -49.26 5.42 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 123.071 0.232 . . . . 0.0 111.136 -178.079 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 757' ' ' TRP . . . . . 0.49 ' CD2' ' HB2' ' A' ' 747' ' ' LEU . 71.4 t-105 76.88 139.47 0.07 Allowed 'General case' 0 N--CA 1.467 0.402 0 O-C-N 123.88 0.737 . . . . 0.0 110.634 179.486 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 758' ' ' GLN . . . . . 0.581 ' O ' ' HB2' ' A' ' 741' ' ' PRO . 0.0 OUTLIER -128.37 105.02 8.05 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.81 178.341 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 759' ' ' GLY . . . . . 0.835 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -178.03 -140.77 3.93 Favored Glycine 0 N--CA 1.44 -1.085 0 C-N-CA 119.733 -1.222 . . . . 0.0 112.824 -178.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 760' ' ' ARG . . . . . 0.407 ' HD2' HH11 ' A' ' 760' ' ' ARG . 7.2 ttm105 -67.19 -52.76 37.36 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.927 0.394 . . . . 0.0 110.086 -179.219 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -170.44 165.32 8.63 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.53 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 2.2 p -131.66 120.52 45.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.845 174.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 57.9 t -104.92 104.03 16.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 116.165 -0.471 . . . . 0.0 109.929 -178.436 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 764' ' ' THR . . . . . 0.547 HG21 HD12 ' A' ' 772' ' ' ILE . 38.5 m -103.18 117.5 34.67 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.415 -177.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 765' ' ' PHE . . . . . 0.633 ' HZ ' ' HG ' ' A' ' 791' ' ' LEU . 75.9 m-85 -81.84 133.3 35.31 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.046 176.477 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -95.93 136.43 36.38 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 -179.032 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 767' ' ' ARG . . . . . 0.466 ' HB3' ' HD2' ' A' ' 768' ' ' ARG . 0.0 OUTLIER -136.92 -73.04 0.43 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.722 0.296 . . . . 0.0 110.953 -178.253 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 768' ' ' ARG . . . . . 0.466 ' HD2' ' HB3' ' A' ' 767' ' ' ARG . 0.0 OUTLIER -112.25 -35.28 5.66 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.028 -176.396 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 74.3 m80 -100.33 136.94 39.45 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.308 -178.298 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 2.6 mt -129.92 127.74 64.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.955 -179.199 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . 148.72 26.1 0.07 OUTLIER Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.317 -0.944 . . . . 0.0 112.972 179.293 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 772' ' ' ILE . . . . . 0.837 HG13 HG13 ' A' ' 752' ' ' VAL . 0.0 OUTLIER -104.56 146.49 32.72 Favored Pre-proline 0 C--N 1.324 -0.5 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 176.912 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 773' ' ' PRO . . . . . 0.499 ' HD2' HG12 ' A' ' 772' ' ' ILE . 26.4 Cg_endo -61.73 125.76 17.42 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.615 2.21 . . . . 0.0 112.82 -178.398 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . 0.588 ' HA ' HG13 ' A' ' 782' ' ' VAL . 0.4 OUTLIER -98.13 -162.14 0.93 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.893 176.666 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 775' ' ' GLU . . . . . 0.591 ' HG3' ' O ' ' A' ' 780' ' ' GLU . 2.4 mp0 -67.62 59.6 0.06 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 122.099 0.952 . . . . 0.0 112.691 177.903 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 14.5 ptpt -128.19 10.9 6.39 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 167.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 777' ' ' ALA . . . . . 0.728 ' HB1' ' HD2' ' A' ' 778' ' ' PRO . . . -133.79 164.63 42.61 Favored Pre-proline 0 N--CA 1.446 -0.645 0 CA-C-N 113.741 -1.572 . . . . 0.0 108.692 178.485 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 778' ' ' PRO . . . . . 0.728 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 14.2 Cg_endo -55.44 -24.35 43.22 Favored 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 123.591 2.861 . . . . 0.0 115.64 -169.756 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . -158.49 27.62 0.42 Allowed Glycine 0 CA--C 1.507 -0.407 0 C-N-CA 119.804 -1.189 . . . . 0.0 112.316 -174.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 780' ' ' GLU . . . . . 0.591 ' O ' ' HG3' ' A' ' 775' ' ' GLU . 13.8 mp0 -103.67 129.13 50.95 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -175.384 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 14.3 m95 -133.01 140.6 47.83 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 -177.561 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . 0.588 HG13 ' HA ' ' A' ' 774' ' ' LEU . 4.4 m -135.7 148.71 28.03 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.319 0 CA-C-O 120.53 0.205 . . . . 0.0 110.637 174.008 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 783' ' ' HIS . . . . . 0.564 ' O ' ' HA ' ' A' ' 765' ' ' PHE . 0.1 OUTLIER -169.98 148.72 3.5 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.793 0.33 . . . . 0.0 110.978 177.771 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 784' ' ' SER . . . . . 0.414 ' HB3' ' NH1' ' A' ' 767' ' ' ARG . 0.9 OUTLIER -105.48 102.32 11.8 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.078 175.94 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 785' ' ' VAL . . . . . 0.868 HG13 ' H ' ' A' ' 787' ' ' ALA . 1.4 p -171.03 160.02 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 -179.627 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -94.63 25.01 4.22 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.787 0.327 . . . . 0.0 111.289 -178.574 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 787' ' ' ALA . . . . . 0.868 ' H ' HG13 ' A' ' 785' ' ' VAL . . . 52.43 64.47 7.41 Favored Pre-proline 0 CA--C 1.535 0.378 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.972 -179.491 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 788' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -65.43 -50.68 1.78 Allowed 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.55 2.166 . . . . 0.0 111.947 -178.113 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -161.98 -30.84 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.06 -179.685 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 790' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.57 -45.17 95.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.914 -0.584 . . . . 0.0 112.14 -178.183 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 791' ' ' LEU . . . . . 0.633 ' HG ' ' HZ ' ' A' ' 765' ' ' PHE . 0.3 OUTLIER -66.41 -53.66 29.2 Favored Pre-proline 0 CA--C 1.534 0.363 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -177.469 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 792' ' ' PRO . . . . . 0.415 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 9.7 Cg_endo -56.97 -34.58 97.76 Favored 'Trans proline' 0 C--N 1.357 0.98 0 C-N-CA 121.441 1.427 . . . . 0.0 112.17 176.187 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -64.05 -44.79 91.39 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.76 0.314 . . . . 0.0 110.624 176.408 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 794' ' ' LEU . . . . . 0.635 ' HA ' ' HD3' ' A' ' 797' ' ' ARG . 1.3 tm? -58.97 -49.13 79.05 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.16 178.678 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 795' ' ' LEU . . . . . 0.511 HD11 HG11 ' A' ' 746' ' ' VAL . 2.5 mm? -65.42 -41.24 93.76 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.336 -176.655 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -60.12 -50.36 74.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.286 -179.521 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 797' ' ' ARG . . . . . 0.635 ' HD3' ' HA ' ' A' ' 794' ' ' LEU . 0.0 OUTLIER -71.82 -25.4 61.97 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.583 -177.423 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 798' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -73.93 -23.73 19.1 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 CA-C-O 120.942 0.401 . . . . 0.0 111.29 178.436 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -80.26 -19.3 47.1 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.787 177.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 5.3 mt 67.8 92.45 0.08 Allowed 'General case' 0 C--O 1.234 0.265 0 O-C-N 124.291 0.995 . . . . 0.0 112.011 177.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 801' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -105.8 106.17 20.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 175.607 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -108.32 63.32 0.61 Allowed 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.762 -175.41 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 803' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -58.8 130.12 45.38 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.418 177.715 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 804' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -109.32 145.59 35.75 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.404 -179.375 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -94.74 155.72 16.71 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.244 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -115.95 112.05 21.29 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 177.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -118.24 96.48 49.8 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.866 -174.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 808' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -90.22 136.78 2.46 Favored 'Trans proline' 0 N--CA 1.451 -0.982 0 C-N-CA 123.471 2.781 . . . . 0.0 112.544 -179.048 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -169.15 154.99 6.27 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.769 177.642 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -166.34 60.74 0.1 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-O 121.018 0.437 . . . . 0.0 111.139 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -84.6 112.22 20.24 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.852 178.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 812' ' ' LEU . . . . . 0.421 HD13 ' HA ' ' A' ' 812' ' ' LEU . 0.0 OUTLIER -128.63 107.65 18.82 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.006 -177.564 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 813' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 812' ' ' LEU . 2.0 Cg_endo -82.32 122.4 3.67 Favored 'Trans proline' 0 N--CA 1.46 -0.441 0 C-N-CA 123.138 2.558 . . . . 0.0 111.786 177.673 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 2.5 m -144.8 115.48 7.72 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.796 0.332 . . . . 0.0 110.951 178.595 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 1.4 m -143.61 125.46 15.18 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.635 177.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -118.64 142.11 47.96 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.79 179.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 7.6 ptmm? -172.43 122.68 0.45 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.079 177.563 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -147.19 123.81 11.13 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.742 0.306 . . . . 0.0 111.527 -179.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 9.8 p -159.64 142.65 5.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.893 175.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 72.7 m -156.92 142.92 17.91 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 110.494 -0.187 . . . . 0.0 110.494 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -166.62 136.4 3.11 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.246 -0.433 . . . . 0.0 109.977 179.537 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 13.4 t30 -153.92 45.45 0.6 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.362 0.601 . . . . 0.0 110.577 178.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 823' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -130.96 159.62 36.93 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.554 178.484 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 824' ' ' ASP . . . . . 0.467 ' HB3' ' H ' ' A' ' 825' ' ' MET . 13.9 t0 -162.63 -102.42 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -177.057 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 825' ' ' MET . . . . . 0.467 ' H ' ' HB3' ' A' ' 824' ' ' ASP . 35.9 ttm -96.32 137.62 35.13 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.715 -175.863 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 826' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.66 120.23 37.38 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.886 -177.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 827' ' ' ILE . . . . . 0.71 HD12 ' HB ' ' A' ' 871' ' ' ILE . 13.0 mm -107.59 125.21 63.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.5 176.213 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 828' ' ' LEU . . . . . 0.407 ' HB3' HG21 ' A' ' 869' ' ' ILE . 6.7 tp -98.66 130.11 45.16 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.883 0.373 . . . . 0.0 110.613 -177.529 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 829' ' ' VAL . . . . . 0.549 HG21 HD12 ' A' ' 840' ' ' LEU . 0.2 OUTLIER -118.92 117.08 53.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.852 179.117 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 830' ' ' VAL . . . . . 0.434 HG13 ' HB3' ' A' ' 854' ' ' ALA . 0.0 OUTLIER -112.54 99.36 8.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 115.617 -0.719 . . . . 0.0 109.521 178.021 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 831' ' ' ASP . . . . . 0.665 ' HA ' ' O ' ' A' ' 875' ' ' ASP . 0.2 OUTLIER -117.29 146.98 42.97 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.834 0.349 . . . . 0.0 110.385 -178.609 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -91.75 -14.29 30.18 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.272 -172.449 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 2.5 m80 -124.98 98.42 36.35 Favored Pre-proline 0 C--N 1.327 -0.408 0 C-N-CA 120.881 -0.328 . . . . 0.0 111.346 -176.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 834' ' ' PRO . . . . . 0.632 ' HA ' ' HD3' ' A' ' 837' ' ' ARG . 15.1 Cg_exo -31.37 -41.98 0.11 Allowed 'Trans proline' 0 C--N 1.352 0.744 1 C-N-CA 125.899 4.399 . . . . 0.0 117.0 -169.29 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -58.94 -35.38 56.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.824 0.345 . . . . 0.0 111.569 -177.469 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 836' ' ' ASN . . . . . 0.595 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 62.1 m-80 -72.32 -38.84 68.57 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 -179.002 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 837' ' ' ARG . . . . . 0.651 ' HG3' ' HB3' ' A' ' 831' ' ' ASP . 0.0 OUTLIER -51.72 -45.33 63.56 Favored 'General case' 0 C--O 1.224 -0.263 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.112 177.002 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 838' ' ' ARG . . . . . 0.489 ' HD3' ' N ' ' A' ' 839' ' ' LEU . 0.0 OUTLIER -59.09 -50.39 74.26 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.248 176.843 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 839' ' ' LEU . . . . . 0.489 ' N ' ' HD3' ' A' ' 838' ' ' ARG . 0.1 OUTLIER -62.99 -52.87 61.32 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.706 -0.679 . . . . 0.0 112.551 -170.045 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 840' ' ' LEU . . . . . 0.595 ' HG ' ' O ' ' A' ' 836' ' ' ASN . 0.0 OUTLIER -72.24 -33.11 67.28 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 120.293 -0.563 . . . . 0.0 110.964 -176.703 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -67.54 -39.3 85.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.933 0.397 . . . . 0.0 110.37 179.412 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.97 -41.18 97.63 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.089 177.396 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 843' ' ' GLN . . . . . 0.819 ' HG2' HD23 ' A' ' 929' ' ' LEU . 11.4 mt-30 -58.62 -48.05 82.3 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.214 175.672 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 844' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.81 -34.69 73.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.751 -0.658 . . . . 0.0 111.038 177.495 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -65.2 -40.2 96.6 Favored Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.89 -0.596 . . . . 0.0 112.411 178.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.81 -25.02 64.46 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.884 0.373 . . . . 0.0 110.574 178.416 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.18 -27.51 61.68 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.145 0.498 . . . . 0.0 110.196 176.06 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 94.39 25.46 16.1 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.755 -0.736 . . . . 0.0 113.16 175.206 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 849' ' ' TYR . . . . . 0.405 ' CE1' ' HB3' ' A' ' 825' ' ' MET . 0.4 OUTLIER -115.91 161.98 18.01 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.986 0.393 . . . . 0.0 110.654 179.86 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.55 131.0 37.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.321 -177.545 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -116.63 142.99 46.18 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.665 -178.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.11 109.84 13.4 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 175.603 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 853' ' ' THR . . . . . 0.441 HG22 ' HG2' ' A' ' 837' ' ' ARG . 0.0 OUTLIER -94.21 133.99 37.15 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.945 0.402 . . . . 0.0 111.395 -175.988 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 854' ' ' ALA . . . . . 0.434 ' HB3' HG13 ' A' ' 830' ' ' VAL . . . -146.79 177.15 9.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.783 178.753 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 855' ' ' ASN . . . . . 0.574 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 42.5 t30 -154.58 80.72 1.1 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.349 177.754 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 856' ' ' ASP . . . . . 0.574 ' HB2' ' O ' ' A' ' 855' ' ' ASN . 2.1 t0 164.85 145.27 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.538 0 O-C-N 123.979 0.799 . . . . 0.0 110.151 177.285 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -73.59 -42.33 40.54 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.179 179.617 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 3.6 m -69.41 -31.34 49.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.778 0.323 . . . . 0.0 111.015 -178.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -73.96 -37.19 64.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.847 0.356 . . . . 0.0 110.539 179.418 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 860' ' ' ALA . . . . . 0.402 ' O ' HG12 ' A' ' 863' ' ' VAL . . . -61.1 -36.64 80.24 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.09 175.679 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 861' ' ' LEU . . . . . 0.855 HD21 ' HA ' ' A' ' 890' ' ' ILE . 6.8 mt -68.41 -43.46 77.14 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.574 176.763 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 32.5 t30 -58.69 -50.28 74.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.817 179.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 863' ' ' VAL . . . . . 0.529 HG13 HD11 ' A' ' 869' ' ' ILE . 1.6 p -64.4 -30.99 51.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.987 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 864' ' ' LEU . . . . . 0.474 ' HA ' HD12 ' A' ' 869' ' ' ILE . 0.7 OUTLIER -63.24 -38.02 89.53 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.002 0.429 . . . . 0.0 110.973 177.307 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -83.34 -18.89 37.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.909 0.385 . . . . 0.0 111.03 -177.45 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 11.6 tptp -87.54 -46.54 9.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.121 -178.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -130.9 165.49 22.96 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.874 -174.529 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 53.5 t60 -87.66 128.77 35.28 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.929 0.395 . . . . 0.0 110.695 -179.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 869' ' ' ILE . . . . . 0.529 HD11 HG13 ' A' ' 863' ' ' VAL . 4.4 mt -117.31 136.68 53.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.389 174.738 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 870' ' ' ASP . . . . . 0.412 ' OD2' ' HG3' ' A' ' 825' ' ' MET . 23.0 m-20 -88.53 -48.72 7.38 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.814 0.34 . . . . 0.0 110.856 -177.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 871' ' ' ILE . . . . . 0.71 ' HB ' HD12 ' A' ' 827' ' ' ILE . 6.6 mm -128.4 137.26 57.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.316 -179.127 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 872' ' ' VAL . . . . . 0.548 HG22 HD12 ' A' ' 897' ' ' LEU . 0.0 OUTLIER -110.4 117.9 55.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.66 0.267 . . . . 0.0 111.173 -179.36 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 873' ' ' LEU . . . . . 0.403 HD12 ' HB ' ' A' ' 829' ' ' VAL . 0.3 OUTLIER -105.09 113.0 26.33 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 175.192 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -104.71 96.85 6.85 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 177.671 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 875' ' ' ASP . . . . . 0.665 ' O ' ' HA ' ' A' ' 831' ' ' ASP . 52.8 t0 -104.83 106.95 17.66 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.395 0.617 . . . . 0.0 110.395 -174.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 876' ' ' VAL . . . . . 0.429 HG23 HG23 ' A' ' 903' ' ' THR . 0.0 OUTLIER -124.56 134.66 66.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.302 -176.273 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -72.1 -50.39 28.5 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 173.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 878' ' ' MET . . . . . 0.405 ' HA ' ' HD3' ' A' ' 879' ' ' PRO . 3.2 ptm -166.86 145.18 4.33 Favored Pre-proline 0 C--N 1.325 -0.479 0 CA-C-N 115.315 -0.857 . . . . 0.0 108.805 174.414 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 879' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 878' ' ' MET . 51.6 Cg_exo -56.07 -37.54 96.16 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.715 2.277 . . . . 0.0 112.739 -177.595 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 5.5 t30 62.73 25.29 15.03 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.131 0.491 . . . . 0.0 110.946 178.03 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 2.8 ttm -178.45 -78.21 0.01 OUTLIER 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.476 -177.387 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -154.24 150.97 28.62 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.046 -0.525 . . . . 0.0 109.923 175.727 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -121.98 42.52 1.64 Allowed Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 111.264 -0.735 . . . . 0.0 111.264 176.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 30.7 t80 -122.68 -44.34 2.22 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.082 0.468 . . . . 0.0 110.423 -177.015 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.46 -38.51 80.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.074 -177.793 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.33 -48.89 73.85 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.62 -178.48 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.53 -42.68 98.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.442 -178.704 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 888' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.16 -48.52 81.19 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.37 178.562 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 889' ' ' ARG . . . . . 0.405 ' HB3' HD11 ' A' ' 861' ' ' LEU . 0.0 OUTLIER -63.15 -41.87 99.35 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.768 -176.651 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 890' ' ' ILE . . . . . 0.855 ' HA ' HD21 ' A' ' 861' ' ' LEU . 8.1 mm -58.8 -52.81 55.74 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 121.131 0.491 . . . . 0.0 111.023 -178.888 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 891' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -71.48 -22.72 61.77 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.795 -179.1 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 892' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.31 -45.85 78.91 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.832 0.349 . . . . 0.0 110.41 177.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -67.82 -43.8 78.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.301 178.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 125.41 81.5 0.44 Allowed Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 120.219 -0.991 . . . . 0.0 112.567 178.133 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 895' ' ' LEU . . . . . 0.631 ' HG ' ' O ' ' A' ' 895' ' ' LEU . 0.3 OUTLIER -70.33 120.67 16.34 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.244 0.545 . . . . 0.0 110.211 178.452 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -113.97 8.86 17.29 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.601 0.715 . . . . 0.0 110.895 179.22 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 897' ' ' LEU . . . . . 0.548 HD12 HG22 ' A' ' 872' ' ' VAL . 0.0 OUTLIER -130.43 137.85 31.74 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.541 -176.481 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -58.97 120.38 8.21 Favored 'Trans proline' 0 C--O 1.236 0.406 0 C-N-CA 122.656 2.237 . . . . 0.0 112.104 -178.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 899' ' ' VAL . . . . . 0.714 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 7.4 t -95.36 127.71 47.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.096 0.474 . . . . 0.0 110.629 -179.118 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 900' ' ' ILE . . . . . 0.529 HG23 ' HB2' ' A' ' 921' ' ' SER . 4.5 mt -107.95 109.6 28.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.851 176.215 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 901' ' ' GLY . . . . . 0.462 ' HA3' ' SD ' ' A' ' 919' ' ' MET . . . -92.95 97.82 2.31 Favored Glycine 0 N--CA 1.444 -0.812 0 CA-C-N 115.865 -0.607 . . . . 0.0 112.319 -178.124 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 902' ' ' VAL . . . . . 0.946 ' HB ' ' HB3' ' A' ' 923' ' ' LEU . 0.2 OUTLIER -94.07 119.77 42.47 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.218 0.532 . . . . 0.0 109.797 175.981 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 903' ' ' THR . . . . . 0.506 ' O ' ' HA ' ' A' ' 924' ' ' SER . 0.3 OUTLIER -125.68 154.68 42.02 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.562 -179.098 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 904' ' ' ALA . . . . . . . . . . . . . . . -88.22 102.56 14.93 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.636 -0.426 . . . . 0.0 110.685 178.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 14.2 t30 40.65 67.55 0.5 Allowed 'General case' 0 N--CA 1.47 0.574 0 O-C-N 124.135 0.897 . . . . 0.0 112.168 176.64 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -72.83 -53.36 11.68 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.035 -177.088 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 167.52 -53.68 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 -176.937 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -163.87 86.6 0.49 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.379 -1.282 . . . . 0.0 109.164 178.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 909' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -55.15 -36.46 65.84 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.576 -176.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 910' ' ' GLU . . . . . 0.573 ' HG2' ' N ' ' A' ' 911' ' ' LYS . 8.0 pm0 -68.43 -40.48 81.16 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.661 -179.684 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 911' ' ' LYS . . . . . 0.573 ' N ' ' HG2' ' A' ' 910' ' ' GLU . 7.2 tttt -71.07 -35.11 71.76 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.127 -178.884 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 912' ' ' GLN . . . . . 0.585 ' O ' ' HG3' ' A' ' 916' ' ' GLU . 5.0 tp60 -60.03 -48.05 83.32 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.765 175.191 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 913' ' ' ARG . . . . . 0.576 ' HA ' ' OE2' ' A' ' 916' ' ' GLU . 0.0 OUTLIER -59.75 -34.78 73.4 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.123 179.017 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 66.3 m -70.71 -33.91 71.36 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.906 0.384 . . . . 0.0 110.607 177.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.71 -52.87 15.57 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.559 -178.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 916' ' ' GLU . . . . . 0.585 ' HG3' ' O ' ' A' ' 912' ' ' GLN . 1.2 pp20? -78.17 -46.73 19.77 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.215 -176.135 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 1.4 m 51.16 43.94 28.94 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.727 -175.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 918' ' ' GLY . . . . . 0.409 ' H ' ' CD ' ' A' ' 916' ' ' GLU . . . -122.86 -32.55 0.92 Allowed Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.024 179.238 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 919' ' ' MET . . . . . 0.714 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 75.0 mtm -72.58 -91.01 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 176.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 920' ' ' ASP . . . . . 0.712 ' HB2' ' O ' ' A' ' 919' ' ' MET . 14.8 t0 149.31 -49.09 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.923 1.289 . . . . 0.0 110.43 172.682 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . 0.529 ' HB2' HG23 ' A' ' 900' ' ' ILE . 0.8 OUTLIER -113.62 148.8 35.59 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.832 0.349 . . . . 0.0 110.69 179.878 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 922' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -117.26 141.96 47.65 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.056 178.842 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 923' ' ' LEU . . . . . 0.946 ' HB3' ' HB ' ' A' ' 902' ' ' VAL . 0.3 OUTLIER -148.4 167.68 24.62 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.843 0.354 . . . . 0.0 110.553 -179.401 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 924' ' ' SER . . . . . 0.506 ' HA ' ' O ' ' A' ' 903' ' ' THR . 3.9 m -115.88 150.0 37.76 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.997 175.498 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 925' ' ' LYS . . . . . 0.515 ' N ' ' HD2' ' A' ' 926' ' ' PRO . 1.4 tttp -51.62 -43.72 88.23 Favored Pre-proline 0 CA--C 1.54 0.595 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 926' ' ' PRO . . . . . 0.515 ' HD2' ' N ' ' A' ' 925' ' ' LYS . 42.7 Cg_endo -69.01 63.24 1.36 Allowed 'Trans proline' 0 C--N 1.357 1.003 0 C-N-CA 121.987 1.792 . . . . 0.0 113.073 174.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 3.4 p -92.97 147.19 5.56 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.807 175.482 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -103.56 167.54 9.73 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.011 -177.593 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 929' ' ' LEU . . . . . 0.819 HD23 ' HG2' ' A' ' 843' ' ' GLN . 1.6 tm? -63.84 -35.8 81.81 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.152 179.04 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.28 -47.44 79.53 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.256 0.551 . . . . 0.0 110.359 -179.198 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 82.3 t -67.49 -44.94 86.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.924 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 932' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -62.43 -36.18 73.49 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-O 120.569 0.223 . . . . 0.0 110.426 -179.702 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 933' ' ' LYS . . . . . . . . . . . . . 1.6 ttmt -68.28 -47.87 66.51 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.409 179.227 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 934' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.91 -43.02 95.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.907 179.425 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 935' ' ' THR . . . . . . . . . . . . . 17.8 m -65.45 -50.08 66.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.214 -178.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 936' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.33 -44.38 95.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.943 -178.45 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 36.2 m -62.94 -43.33 99.09 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.814 0.34 . . . . 0.0 111.48 -179.198 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 938' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.29 -49.36 64.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.954 -179.662 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -66.21 -34.65 78.5 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.213 -177.192 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -63.13 -45.57 91.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.794 0.33 . . . . 0.0 111.063 178.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 941' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.81 -34.11 76.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.121 179.266 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 942' ' ' ARG . . . . . 0.576 ' HG3' ' N ' ' A' ' 943' ' ' VAL . 0.0 OUTLIER -63.96 -47.56 79.94 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.967 -178.668 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 943' ' ' VAL . . . . . 0.576 ' N ' ' HG3' ' A' ' 942' ' ' ARG . 15.9 m -73.08 -29.9 30.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.551 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.49 -40.48 95.75 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.011 178.821 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 945' ' ' LYS . . . . . 0.441 ' HG2' ' O ' ' A' ' 942' ' ' ARG . 0.4 OUTLIER -79.63 -20.76 46.0 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 121.098 -0.241 . . . . 0.0 111.473 -179.161 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 16.1 m -72.93 -30.4 63.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.561 0.696 . . . . 0.0 109.797 171.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -82.55 -17.6 44.36 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.08 174.265 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 10.1 t70 71.29 77.26 0.17 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-N 114.858 -1.065 . . . . 0.0 110.771 -178.609 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.248 1.024 0 CA-C-N 115.415 -0.812 . . . . 0.0 109.959 179.367 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.96 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 145.86 167.03 12.3 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.752 -0.737 . . . . 0.0 111.657 -178.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . -149.69 91.42 0.14 Allowed Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.781 -0.724 . . . . 0.0 112.139 -178.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -76.58 105.61 7.74 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 177.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . -113.46 105.7 1.68 Allowed Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.355 -177.08 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -124.17 48.76 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 121.228 0.537 . . . . 0.0 110.091 178.229 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.24 113.73 26.63 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.523 179.299 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . -79.24 72.2 2.53 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 121.195 -0.526 . . . . 0.0 112.691 -179.015 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 43.1 mt -116.71 4.25 13.07 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.293 0.568 . . . . 0.0 110.101 177.222 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 705' ' ' SER . . . . . 0.503 ' HA ' ' O ' ' A' ' 730' ' ' GLY . 0.0 OUTLIER -75.1 163.65 27.35 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.033 -179.388 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . 93.42 -19.79 50.42 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.527 179.411 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 707' ' ' LYS . . . . . 0.681 ' NZ ' ' HA ' ' A' ' 745' ' ' ASP . 7.8 tmtm? -84.61 147.98 26.7 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 -179.89 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 708' ' ' ARG . . . . . 0.459 ' HD2' ' CZ2' ' A' ' 710' ' ' TRP . 6.4 mtm-85 -113.22 162.68 15.72 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.612 0.72 . . . . 0.0 111.678 -177.171 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 709' ' ' CYS . . . . . 0.63 ' SG ' HD22 ' A' ' 726' ' ' LEU . 1.2 m -132.88 117.89 18.26 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 114.6 -1.182 . . . . 0.0 108.847 168.11 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 710' ' ' TRP . . . . . 0.459 ' CZ2' ' HD2' ' A' ' 708' ' ' ARG . 91.0 m95 -94.04 107.16 19.1 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 711' ' ' LEU . . . . . 0.964 HD21 HG13 ' A' ' 733' ' ' VAL . 0.1 OUTLIER -110.12 128.46 55.46 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.127 0.489 . . . . 0.0 111.124 -176.845 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 712' ' ' ALA . . . . . . . . . . . . . . . -119.45 44.19 2.43 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.21 175.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 713' ' ' VAL . . . . . 0.933 ' HA ' ' HB2' ' A' ' 750' ' ' ASP . 43.6 t -99.42 123.52 52.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.431 -178.387 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 714' ' ' ARG . . . . . 0.728 HH12 ' HG3' ' A' ' 751' ' ' GLU . 0.0 OUTLIER -78.46 -35.98 45.94 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 177.836 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 13.7 m-80 -59.92 109.95 1.06 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.382 -0.827 . . . . 0.0 110.715 -176.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -58.91 -43.67 91.09 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.491 -176.343 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.28 -42.81 96.21 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.229 0.538 . . . . 0.0 110.73 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 718' ' ' LEU . . . . . 0.606 ' HB3' HG11 ' A' ' 713' ' ' VAL . 0.2 OUTLIER -72.05 -49.71 34.42 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.121 -177.858 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 719' ' ' CYS . . . . . 0.812 ' SG ' ' HB ' ' A' ' 713' ' ' VAL . 0.1 OUTLIER -62.67 -50.35 71.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.089 -178.251 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -59.09 -44.15 91.89 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.668 -177.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 721' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -61.39 -52.13 65.88 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.799 0.333 . . . . 0.0 110.993 -178.158 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 14.7 mt -62.73 -45.1 94.27 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.653 -178.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 723' ' ' GLU . . . . . 0.538 ' HA ' HG21 ' A' ' 733' ' ' VAL . 0.8 OUTLIER -59.08 -46.47 88.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.865 -179.045 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 724' ' ' THR . . . . . . . . . . . . . 57.6 m -61.63 -41.73 97.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.892 0.377 . . . . 0.0 111.043 -178.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 14.1 m -67.22 -39.49 86.25 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.067 -0.515 . . . . 0.0 112.167 -175.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 726' ' ' LEU . . . . . 0.89 HD23 HD12 ' A' ' 731' ' ' ILE . 0.2 OUTLIER -82.31 -33.68 28.91 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.916 -0.313 . . . . 0.0 111.326 -178.881 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 727' ' ' GLN . . . . . 0.461 HE21 ' HB3' ' A' ' 727' ' ' GLN . 0.8 OUTLIER -72.95 -13.24 61.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.02 0.438 . . . . 0.0 110.413 177.28 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.84 -19.3 63.97 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.618 176.487 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 729' ' ' SER . . . . . 0.432 ' HB2' ' H ' ' A' ' 730' ' ' GLY . 0.0 OUTLIER -98.11 -96.26 0.22 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.339 177.748 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 730' ' ' GLY . . . . . 0.503 ' O ' ' HA ' ' A' ' 705' ' ' SER . . . -159.1 21.64 0.29 Allowed Glycine 0 N--CA 1.45 -0.416 0 N-CA-C 111.016 -0.834 . . . . 0.0 111.016 178.264 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 731' ' ' ILE . . . . . 0.89 HD12 HD23 ' A' ' 726' ' ' LEU . 2.5 mt -89.76 132.25 34.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 -177.283 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 732' ' ' VAL . . . . . 0.422 HG13 ' HG3' ' A' ' 708' ' ' ARG . 1.5 p -87.13 108.59 18.27 Favored 'Isoleucine or valine' 0 C--O 1.238 0.488 0 CA-C-O 121.826 0.822 . . . . 0.0 111.335 -176.784 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 733' ' ' VAL . . . . . 0.964 HG13 HD21 ' A' ' 711' ' ' LEU . 2.2 t -75.41 117.33 19.59 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.0 -1.0 . . . . 0.0 109.85 176.661 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.01 126.28 41.03 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.637 -179.085 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -56.89 130.63 46.69 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.802 177.551 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 736' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -72.42 77.86 1.03 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.394 0.616 . . . . 0.0 110.443 178.192 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.41 -13.1 61.74 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.639 177.375 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 109.1 39.5 1.67 Allowed Glycine 0 N--CA 1.447 -0.574 0 N-CA-C 111.06 -0.816 . . . . 0.0 111.06 -174.531 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -85.81 -167.15 1.75 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.47 -0.365 . . . . 0.0 110.784 -177.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 740' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -67.78 122.0 81.78 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.341 -177.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 741' ' ' PRO . . . . . 0.442 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 29.4 Cg_endo -65.22 122.9 10.77 Favored 'Trans proline' 0 N--CA 1.463 -0.315 0 C-N-CA 122.371 2.047 . . . . 0.0 111.183 176.765 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 742' ' ' THR . . . . . 0.719 ' HB ' ' HB2' ' A' ' 745' ' ' ASP . 0.1 OUTLIER -104.99 124.88 35.21 Favored Pre-proline 0 C--N 1.322 -0.606 0 CA-C-O 120.948 0.404 . . . . 0.0 111.363 -174.391 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 743' ' ' PRO . . . . . 0.822 ' HA ' ' HA2' ' A' ' 759' ' ' GLY . 34.7 Cg_endo -65.47 -12.93 37.25 Favored 'Trans proline' 0 N--CA 1.473 0.267 0 C-N-CA 123.497 2.798 . . . . 0.0 113.693 -175.681 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 744' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -108.18 -0.66 20.85 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.553 0.692 . . . . 0.0 110.583 177.564 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 745' ' ' ASP . . . . . 0.719 ' HB2' ' HB ' ' A' ' 742' ' ' THR . 28.0 m-20 -111.89 165.87 11.7 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.758 -173.927 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 746' ' ' VAL . . . . . 0.654 HG21 HD11 ' A' ' 795' ' ' LEU . 16.6 m -123.46 147.42 27.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.432 -171.517 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 747' ' ' LEU . . . . . 0.424 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 0.2 OUTLIER -107.45 99.9 9.38 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.18 178.231 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 5.7 mt -90.62 106.61 17.59 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 174.403 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 8.9 t -117.89 148.13 42.43 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.361 0.6 . . . . 0.0 111.989 -171.522 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 750' ' ' ASP . . . . . 0.933 ' HB2' ' HA ' ' A' ' 713' ' ' VAL . 54.0 t0 -95.86 109.24 21.61 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.089 -0.959 . . . . 0.0 109.033 177.287 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 751' ' ' GLU . . . . . 0.728 ' HG3' HH12 ' A' ' 714' ' ' ARG . 9.2 mt-10 67.66 -150.76 0.17 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.423 -177.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 752' ' ' VAL . . . . . 0.481 ' H ' ' HB3' ' A' ' 751' ' ' GLU . 59.0 t -88.03 116.96 30.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.17 0.509 . . . . 0.0 111.815 -172.691 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 753' ' ' VAL . . . . . . . . . . . . . 6.1 p -95.97 156.4 3.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.016 171.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.7 41.5 0.57 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.952 0.406 . . . . 0.0 111.887 -176.537 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 755' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.77 -170.44 2.9 Favored 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 179.044 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 756' ' ' LYS . . . . . 0.617 ' O ' ' HB2' ' A' ' 757' ' ' TRP . 0.0 OUTLIER -117.22 -77.28 0.57 Allowed 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 170.138 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 757' ' ' TRP . . . . . 0.617 ' HB2' ' O ' ' A' ' 756' ' ' LYS . 10.7 t-105 152.93 109.21 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.41 0 O-C-N 124.76 1.288 . . . . 0.0 110.359 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 758' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.81 75.89 4.24 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 171.017 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 759' ' ' GLY . . . . . 0.822 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -158.1 -143.52 3.68 Favored Glycine 0 N--CA 1.444 -0.798 0 CA-C-N 115.681 -0.69 . . . . 0.0 112.381 -175.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.63 -55.72 5.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.767 0.283 . . . . 0.0 111.105 -178.051 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -166.51 149.12 6.78 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.746 -179.08 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 762' ' ' VAL . . . . . . . . . . . . . 2.5 p -116.64 131.03 70.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 121.006 0.431 . . . . 0.0 110.572 178.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 763' ' ' VAL . . . . . 0.605 HG11 HD21 ' A' ' 791' ' ' LEU . 38.9 t -110.54 111.34 35.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.956 -0.565 . . . . 0.0 109.938 179.315 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 764' ' ' THR . . . . . 0.447 ' HB ' HG12 ' A' ' 782' ' ' VAL . 1.5 m -103.47 122.18 44.37 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.21 -176.518 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 765' ' ' PHE . . . . . . . . . . . . . 36.5 m-85 -92.16 123.98 35.91 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 175.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 766' ' ' CYS . . . . . 0.49 ' SG ' ' HB ' ' A' ' 782' ' ' VAL . 1.3 m -96.4 132.89 41.47 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.762 0.315 . . . . 0.0 110.814 -176.158 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.83 -57.01 1.35 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.614 179.481 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 2.7 tpm_? -136.15 -43.36 0.64 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.17 0.509 . . . . 0.0 110.288 177.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 10.5 m170 -89.6 110.51 21.37 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.759 179.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 5.1 mt -116.87 83.26 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-O 121.109 0.48 . . . . 0.0 110.003 178.593 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -125.71 13.18 7.3 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.302 179.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 772' ' ' ILE . . . . . 0.441 ' HA ' ' HD3' ' A' ' 773' ' ' PRO . 42.6 mm -105.36 132.78 20.58 Favored Pre-proline 0 C--N 1.322 -0.6 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 177.868 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 773' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 772' ' ' ILE . 36.0 Cg_exo -61.7 150.41 85.83 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.771 2.314 . . . . 0.0 112.381 178.016 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . 0.626 ' HG ' ' H ' ' A' ' 776' ' ' LYS . 0.5 OUTLIER -97.45 -162.34 0.95 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.602 179.874 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 775' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -62.4 8.31 0.05 Allowed 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 113.307 0.855 . . . . 0.0 113.307 179.552 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . 0.626 ' H ' ' HG ' ' A' ' 774' ' ' LEU . 7.6 ptmt -65.07 -18.26 65.15 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 165.692 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 777' ' ' ALA . . . . . 0.725 ' HB3' ' HB2' ' A' ' 780' ' ' GLU . . . -105.83 161.17 23.63 Favored Pre-proline 0 N--CA 1.451 -0.415 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.79 176.099 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 778' ' ' PRO . . . . . 0.566 ' HD2' ' HB1' ' A' ' 777' ' ' ALA . 57.2 Cg_endo -69.77 -9.6 26.5 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.781 2.321 . . . . 0.0 114.47 -172.305 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . -156.35 23.54 0.51 Allowed Glycine 0 CA--C 1.505 -0.551 0 C-N-CA 119.838 -1.173 . . . . 0.0 112.603 -175.393 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 780' ' ' GLU . . . . . 0.725 ' HB2' ' HB3' ' A' ' 777' ' ' ALA . 0.4 OUTLIER -114.88 129.2 56.66 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 -178.601 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 781' ' ' TRP . . . . . . . . . . . . . 18.6 m95 -129.62 139.13 51.51 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 179.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . 0.49 ' HB ' ' SG ' ' A' ' 766' ' ' CYS . 14.7 m -133.45 143.89 37.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 110.17 -0.308 . . . . 0.0 110.17 173.732 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 783' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -166.62 148.03 6.29 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.536 176.319 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -102.57 102.35 12.58 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.38 178.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 785' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -154.7 162.8 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.587 -0.279 . . . . 0.0 110.252 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -100.4 32.23 3.12 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.115 -179.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . 56.5 79.15 0.34 Allowed Pre-proline 0 N--CA 1.465 0.291 0 CA-C-N 116.064 -0.516 . . . . 0.0 112.006 178.081 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 788' ' ' PRO . . . . . 0.642 ' HB2' ' OE2' ' A' ' 790' ' ' GLU . 10.2 Cg_endo -88.35 -128.4 0.01 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 122.948 2.432 . . . . 0.0 111.278 175.544 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 789' ' ' HIS . . . . . 0.465 ' H ' ' HB2' ' A' ' 788' ' ' PRO . 14.2 p-80 -114.06 1.09 14.52 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.875 0.369 . . . . 0.0 111.038 -179.18 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 790' ' ' GLU . . . . . 0.642 ' OE2' ' HB2' ' A' ' 788' ' ' PRO . 1.7 pm0 -92.36 -44.51 8.67 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.334 -176.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 791' ' ' LEU . . . . . 0.605 HD21 HG11 ' A' ' 763' ' ' VAL . 0.2 OUTLIER -71.18 -42.48 11.91 Favored Pre-proline 0 CA--C 1.535 0.387 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -177.769 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 792' ' ' PRO . . . . . 0.549 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 10.3 Cg_endo -57.83 -29.37 85.82 Favored 'Trans proline' 0 C--N 1.353 0.8 0 C-N-CA 121.261 1.307 . . . . 0.0 111.607 172.048 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -74.34 -34.29 63.37 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.258 175.824 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 794' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -60.31 -43.24 96.5 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.671 174.512 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 795' ' ' LEU . . . . . 0.654 HD11 HG21 ' A' ' 746' ' ' VAL . 0.2 OUTLIER -62.29 -39.77 94.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.566 177.971 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -63.54 -46.31 86.58 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.788 178.653 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 797' ' ' ARG . . . . . 0.945 ' HA ' ' HB ' ' A' ' 801' ' ' ILE . 0.0 OUTLIER -65.51 -34.8 79.12 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.477 -0.328 . . . . 0.0 110.37 179.037 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 798' ' ' ILE . . . . . 0.443 ' N ' ' HG3' ' A' ' 797' ' ' ARG . 0.1 OUTLIER -65.49 -25.92 38.03 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.527 179.878 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.03 -65.36 0.69 Allowed 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.309 -0.405 . . . . 0.0 109.936 175.352 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 800' ' ' LEU . . . . . 0.478 ' HA ' HD23 ' A' ' 800' ' ' LEU . 0.4 OUTLIER -177.27 50.88 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.062 177.444 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 801' ' ' ILE . . . . . 0.945 ' HB ' ' HA ' ' A' ' 797' ' ' ARG . 55.0 mt -112.67 92.45 2.08 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.752 0 CA-C-O 122.105 0.955 . . . . 0.0 108.88 176.404 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 802' ' ' GLU . . . . . 0.461 ' H ' ' HG3' ' A' ' 802' ' ' GLU . 0.0 OUTLIER -114.5 46.5 1.37 Allowed 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 113.963 -1.471 . . . . 0.0 108.651 -175.83 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 803' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -79.84 76.08 6.53 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.905 -172.697 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 804' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -136.59 144.5 44.17 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 171.084 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -61.8 106.06 0.64 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.99 0.424 . . . . 0.0 110.929 -178.159 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -75.62 140.08 42.41 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.922 -177.368 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -148.39 110.52 3.68 Favored Pre-proline 0 C--N 1.326 -0.427 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.337 177.563 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 808' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -83.99 168.79 11.99 Favored 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 122.81 2.34 . . . . 0.0 112.333 179.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -90.21 133.94 34.6 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.663 -179.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -85.87 145.98 26.94 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.225 177.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -140.84 160.22 40.51 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.547 179.548 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -84.23 140.81 39.5 Favored Pre-proline 0 C--N 1.321 -0.661 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.584 179.583 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -63.73 129.7 25.65 Favored 'Trans proline' 0 C--O 1.235 0.329 0 C-N-CA 122.453 2.102 . . . . 0.0 112.148 178.092 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 2.3 m -56.43 117.21 3.62 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.907 -179.378 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -120.13 136.33 54.65 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.172 -176.674 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -123.36 97.82 5.58 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.757 177.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 5.4 mmtm -102.0 86.65 2.92 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.756 -178.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -160.05 138.99 10.71 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.166 178.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 3.0 p -76.04 92.3 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-O 121.882 0.848 . . . . 0.0 109.944 -179.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -89.29 45.53 1.3 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.052 -175.28 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -120.75 93.11 3.93 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.353 0.597 . . . . 0.0 110.781 -178.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 822' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -144.02 77.28 1.54 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.329 -0.851 . . . . 0.0 108.965 173.104 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 823' ' ' ASP . . . . . 0.458 ' HB3' ' SD ' ' A' ' 826' ' ' MET . 1.0 OUTLIER -123.41 103.04 8.24 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.884 -175.221 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -87.28 -98.2 0.08 Allowed 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 174.448 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 1.4 tpp -79.49 90.77 5.09 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 171.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 826' ' ' MET . . . . . 0.519 ' H ' ' HG2' ' A' ' 826' ' ' MET . 0.0 OUTLIER -93.3 105.74 17.78 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.142 -173.938 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 827' ' ' ILE . . . . . . . . . . . . . 6.4 mm -115.12 129.25 71.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.342 178.244 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 828' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -94.81 131.9 40.18 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 178.739 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 829' ' ' VAL . . . . . 0.567 HG13 HD12 ' A' ' 873' ' ' LEU . 0.0 OUTLIER -113.84 95.89 4.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 176.959 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 830' ' ' VAL . . . . . . . . . . . . . 10.7 t -97.18 88.18 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.147 -179.601 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 831' ' ' ASP . . . . . 0.675 ' HA ' ' HB2' ' A' ' 875' ' ' ASP . 0.0 OUTLIER -104.65 154.61 19.74 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.087 -176.077 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -87.63 -22.82 24.5 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -175.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -130.74 114.17 16.61 Favored Pre-proline 0 N--CA 1.465 0.32 0 O-C-N 121.394 -0.817 . . . . 0.0 111.951 -174.433 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -42.44 -52.93 4.02 Favored 'Trans proline' 0 N--CA 1.479 0.632 0 C-N-CA 124.731 3.621 . . . . 0.0 115.315 -172.134 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 835' ' ' ILE . . . . . 0.419 ' O ' ' HB3' ' A' ' 838' ' ' ARG . 3.6 tp -58.67 -40.02 78.06 Favored 'Isoleucine or valine' 0 C--O 1.24 0.572 0 CA-C-O 121.437 0.637 . . . . 0.0 111.063 -178.149 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 836' ' ' ASN . . . . . 0.547 ' HB3' ' HZ2' ' A' ' 925' ' ' LYS . 3.7 m-20 -70.23 -40.5 74.45 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.608 -179.703 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 837' ' ' ARG . . . . . 0.668 ' HB2' ' OD1' ' A' ' 831' ' ' ASP . 0.0 OUTLIER -54.72 -44.53 73.57 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.55 174.755 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 838' ' ' ARG . . . . . 0.419 ' HB3' ' O ' ' A' ' 835' ' ' ILE . 0.0 OUTLIER -51.54 -46.54 63.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.557 178.766 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.5 -48.06 79.14 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.881 -0.6 . . . . 0.0 112.042 -176.251 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 840' ' ' LEU . . . . . 0.495 ' H ' ' HG ' ' A' ' 840' ' ' LEU . 0.0 OUTLIER -70.87 -37.84 73.08 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 122.037 -0.414 . . . . 0.0 110.928 -178.13 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -66.35 -31.69 72.63 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.241 0.543 . . . . 0.0 110.366 178.343 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 842' ' ' ASP . . . . . 0.41 ' HB2' ' O ' ' A' ' 838' ' ' ARG . 10.9 t0 -65.39 -42.47 92.6 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.83 175.35 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 843' ' ' GLN . . . . . 0.579 ' HG3' HD23 ' A' ' 929' ' ' LEU . 0.0 OUTLIER -64.96 -44.92 87.8 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.33 178.581 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 844' ' ' LEU . . . . . 0.628 ' HA ' HD23 ' A' ' 847' ' ' LEU . 0.0 OUTLIER -60.95 -43.55 98.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.086 178.752 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -64.71 -42.4 97.22 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.913 -0.66 . . . . 0.0 112.282 179.682 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 51.0 m -77.02 -9.58 58.8 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.904 0.383 . . . . 0.0 111.185 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 847' ' ' LEU . . . . . 0.628 HD23 ' HA ' ' A' ' 844' ' ' LEU . 0.0 OUTLIER -87.69 -28.31 21.88 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 175.333 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 106.97 18.32 10.71 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.488 174.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 5.5 m-30 -106.38 165.69 11.08 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.94 -0.392 . . . . 0.0 109.94 179.326 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 850' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -95.17 117.49 30.32 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.931 0.396 . . . . 0.0 110.343 -178.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 851' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -100.59 127.17 47.05 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.276 -176.189 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.64 116.66 32.32 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 172.153 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 853' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.71 132.93 35.51 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 -171.883 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 854' ' ' ALA . . . . . . . . . . . . . . . -151.02 147.2 26.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.769 176.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 855' ' ' ASN . . . . . 0.653 ' O ' ' HB2' ' A' ' 856' ' ' ASP . 9.1 t-20 -128.13 73.19 1.45 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.982 176.144 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 856' ' ' ASP . . . . . 0.653 ' HB2' ' O ' ' A' ' 855' ' ' ASN . 2.1 t70 162.18 159.74 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.213 175.865 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -81.66 -30.98 34.32 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.137 178.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 858' ' ' VAL . . . . . 0.455 HG22 ' OD1' ' A' ' 856' ' ' ASP . 3.3 m -73.23 -31.76 35.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.688 0.28 . . . . 0.0 111.074 -178.222 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 859' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -67.79 -42.75 81.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.236 0.541 . . . . 0.0 109.973 178.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 860' ' ' ALA . . . . . 0.439 ' O ' ' HB2' ' A' ' 864' ' ' LEU . . . -64.77 -44.69 89.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.641 177.43 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 861' ' ' LEU . . . . . 0.484 HD21 ' HA3' ' A' ' 894' ' ' GLY . 0.1 OUTLIER -61.06 -34.25 74.59 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.717 178.348 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -61.17 -54.57 42.66 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.915 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 863' ' ' VAL . . . . . . . . . . . . . 14.4 p -71.78 -32.45 44.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.731 0.301 . . . . 0.0 110.824 -177.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 864' ' ' LEU . . . . . 0.439 ' HB2' ' O ' ' A' ' 860' ' ' ALA . 0.2 OUTLIER -63.5 -45.12 92.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.771 178.311 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 15.2 m -71.71 -21.76 61.73 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.801 -179.192 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.28 -69.18 0.37 Allowed 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 173.811 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 867' ' ' ASN . . . . . 0.599 ' O ' ' HB2' ' A' ' 868' ' ' HIS . 2.3 t-20 159.17 127.4 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.609 0 O-C-N 124.274 0.984 . . . . 0.0 110.021 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 868' ' ' HIS . . . . . 0.599 ' HB2' ' O ' ' A' ' 867' ' ' ASN . 14.3 m-70 134.92 171.7 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.005 0 O-C-N 125.202 1.564 . . . . 0.0 110.528 165.667 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 869' ' ' ILE . . . . . 0.591 ' HB ' ' O ' ' A' ' 868' ' ' HIS . 1.5 mp 86.0 129.57 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 O-C-N 124.461 1.1 . . . . 0.0 111.109 174.748 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -112.76 -16.58 12.74 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.435 -178.311 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 871' ' ' ILE . . . . . . . . . . . . . 2.1 mt -145.95 137.69 19.69 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 178.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 872' ' ' VAL . . . . . 0.587 ' HB ' HG22 ' A' ' 899' ' ' VAL . 7.2 t -122.39 135.75 61.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.676 0.274 . . . . 0.0 110.962 -177.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 873' ' ' LEU . . . . . 0.567 HD12 HG13 ' A' ' 829' ' ' VAL . 10.0 mt -110.88 136.11 50.4 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 173.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -120.66 104.96 10.33 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.26 178.8 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 875' ' ' ASP . . . . . 0.675 ' HB2' ' HA ' ' A' ' 831' ' ' ASP . 0.8 OUTLIER -89.17 105.68 17.94 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.543 -176.825 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 876' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -95.95 100.02 10.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.548 -177.145 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 877' ' ' ASN . . . . . 0.424 ' HA ' ' HB3' ' A' ' 904' ' ' ALA . 0.8 OUTLIER -73.11 -43.0 62.33 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.758 176.368 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.98 111.93 60.33 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.256 174.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 879' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -44.09 -56.57 2.4 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 123.884 3.056 . . . . 0.0 114.178 -171.523 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 880' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -158.89 140.92 13.75 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.498 0.189 . . . . 0.0 110.575 179.785 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 881' ' ' MET . . . . . . . . . . . . . 5.2 tpt -178.85 -74.65 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.385 178.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 882' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -117.86 -28.23 5.99 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.941 -177.677 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -83.63 35.62 2.85 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.854 -0.689 . . . . 0.0 112.66 -177.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 23.3 p90 -89.28 -22.4 22.71 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 -178.292 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 885' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -61.5 -31.35 71.34 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.752 174.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.92 -53.89 53.14 Favored 'General case' 0 CA--C 1.528 0.127 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.609 179.613 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.49 -36.19 80.62 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.839 -178.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 888' ' ' GLN . . . . . 0.474 ' HA ' ' HD3' ' A' ' 891' ' ' ARG . 60.9 mm-40 -61.08 -50.48 73.11 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.004 179.613 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.59 -44.72 95.93 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.485 -177.534 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 890' ' ' ILE . . . . . . . . . . . . . 18.0 mt -69.15 -46.45 77.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.059 -177.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 891' ' ' ARG . . . . . 0.474 ' HD3' ' HA ' ' A' ' 888' ' ' GLN . 2.3 ptm180 -66.96 -23.97 66.01 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.893 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 892' ' ' GLN . . . . . 0.457 ' HB2' ' O ' ' A' ' 888' ' ' GLN . 1.5 tp60 -71.88 -60.34 2.28 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.71 177.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -157.2 48.24 0.43 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.594 -176.349 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 894' ' ' GLY . . . . . 0.484 ' HA3' HD21 ' A' ' 861' ' ' LEU . . . -141.86 0.06 1.57 Allowed Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.35 176.508 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 895' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -108.4 110.74 22.36 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.973 0.416 . . . . 0.0 110.763 -178.312 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -134.54 22.57 3.67 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.563 0.697 . . . . 0.0 109.717 175.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 897' ' ' LEU . . . . . 0.406 ' HB2' ' HD2' ' A' ' 898' ' ' PRO . 0.4 OUTLIER -159.51 164.46 20.44 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.748 -173.666 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 898' ' ' PRO . . . . . 0.406 ' HD2' ' HB2' ' A' ' 897' ' ' LEU . 38.0 Cg_endo -67.07 128.76 19.2 Favored 'Trans proline' 0 C--O 1.241 0.629 0 C-N-CA 122.316 2.011 . . . . 0.0 111.941 176.129 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 899' ' ' VAL . . . . . 0.79 ' HB ' ' HA ' ' A' ' 919' ' ' MET . 69.0 t -115.61 128.31 72.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.143 178.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 900' ' ' ILE . . . . . 0.455 ' HA ' ' O ' ' A' ' 921' ' ' SER . 3.0 mt -108.52 121.91 62.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.008 179.263 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 901' ' ' GLY . . . . . . . . . . . . . . . -96.32 126.95 9.0 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 120.686 -0.768 . . . . 0.0 111.907 -178.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 902' ' ' VAL . . . . . 0.765 HG12 ' HA ' ' A' ' 925' ' ' LYS . 1.1 t -104.59 97.56 5.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 177.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 903' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.27 135.95 33.35 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.959 -172.895 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 904' ' ' ALA . . . . . 0.46 ' HA ' ' HB2' ' A' ' 925' ' ' LYS . . . -96.31 115.06 26.83 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.705 178.565 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 60.8 45.62 9.72 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 121.207 0.527 . . . . 0.0 111.238 177.267 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 906' ' ' ALA . . . . . . . . . . . . . . . -98.27 98.86 10.07 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.046 177.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 11.1 tp -45.26 -45.15 11.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.521 176.476 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 908' ' ' ALA . . . . . 0.411 ' HB1' ' HB2' ' A' ' 911' ' ' LYS . . . -126.39 78.96 1.82 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.019 0.438 . . . . 0.0 110.582 177.605 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 909' ' ' GLU . . . . . 0.435 ' H ' ' HG2' ' A' ' 909' ' ' GLU . 0.0 OUTLIER -62.31 -41.37 98.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.527 -178.868 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 910' ' ' GLU . . . . . 0.526 ' H ' ' HG2' ' A' ' 910' ' ' GLU . 0.1 OUTLIER -64.02 -31.02 72.05 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.091 -179.753 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 911' ' ' LYS . . . . . 0.411 ' HB2' ' HB1' ' A' ' 908' ' ' ALA . 12.6 tttt -68.87 -41.64 78.08 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.259 179.781 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 912' ' ' GLN . . . . . . . . . . . . . 69.9 tp60 -63.13 -36.24 82.96 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.134 177.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 913' ' ' ARG . . . . . 0.578 ' HB2' ' SG ' ' A' ' 922' ' ' CYS . 3.7 ttp180 -58.66 -46.96 86.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.944 177.814 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 7.4 m -74.94 -26.1 59.36 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.549 -176.171 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 1.2 tp -70.02 -51.74 29.81 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.954 0.407 . . . . 0.0 111.099 179.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 916' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -78.52 -42.53 29.24 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.506 -178.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 2.3 m 51.15 47.8 24.2 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.088 0.47 . . . . 0.0 111.573 -176.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -133.06 24.43 3.79 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.013 179.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 919' ' ' MET . . . . . 0.79 ' HA ' ' HB ' ' A' ' 899' ' ' VAL . 0.0 OUTLIER -130.14 -101.45 0.31 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.576 0.226 . . . . 0.0 110.755 -177.198 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 920' ' ' ASP . . . . . 0.422 ' HB2' ' O ' ' A' ' 919' ' ' MET . 10.4 t70 168.2 -64.83 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.993 0.917 . . . . 0.0 108.801 179.83 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . 0.455 ' O ' ' HA ' ' A' ' 900' ' ' ILE . 70.9 m -139.23 163.11 33.32 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.653 179.018 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 922' ' ' CYS . . . . . 0.578 ' SG ' ' HB2' ' A' ' 913' ' ' ARG . 0.0 OUTLIER -137.6 158.24 44.8 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.03 0.443 . . . . 0.0 111.496 -177.506 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 923' ' ' LEU . . . . . 0.465 HD21 HG21 ' A' ' 935' ' ' THR . 0.0 OUTLIER -146.8 168.35 21.62 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.232 175.218 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 1.4 m -78.37 142.71 37.46 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.064 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 925' ' ' LYS . . . . . 0.765 ' HA ' HG12 ' A' ' 902' ' ' VAL . 0.0 OUTLIER -54.35 -39.95 78.8 Favored Pre-proline 0 CA--C 1.538 0.502 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 179.433 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 926' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -62.11 74.03 0.1 OUTLIER 'Trans proline' 0 C--N 1.36 1.162 0 C-N-CA 122.077 1.852 . . . . 0.0 112.194 171.184 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -98.47 140.17 18.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.968 -176.638 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.07 163.41 12.44 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.554 177.357 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 929' ' ' LEU . . . . . 0.579 HD23 ' HG3' ' A' ' 843' ' ' GLN . 0.0 OUTLIER -56.43 -46.41 80.29 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.355 -177.271 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -67.57 -34.38 76.93 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.028 0.442 . . . . 0.0 110.799 -177.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 62.4 t -69.61 -48.77 63.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.448 -178.728 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 932' ' ' ILE . . . . . 0.414 HG21 ' HB3' ' A' ' 843' ' ' GLN . 2.0 tp -67.28 -37.36 78.93 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 CA-C-O 120.64 0.257 . . . . 0.0 110.589 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 933' ' ' LYS . . . . . 0.492 ' HA ' HD13 ' A' ' 847' ' ' LEU . 0.8 OUTLIER -61.77 -47.64 84.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.169 176.87 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 934' ' ' GLN . . . . . 0.588 ' O ' ' HB2' ' A' ' 938' ' ' LEU . 1.9 tp60 -60.52 -51.08 70.95 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.743 -179.175 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 935' ' ' THR . . . . . 0.465 HG21 HD21 ' A' ' 923' ' ' LEU . 8.6 m -61.87 -47.63 84.16 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.529 -177.874 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 936' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.73 -47.84 68.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.385 -176.014 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 67.9 m -67.87 -39.46 83.71 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 111.708 0.262 . . . . 0.0 111.708 -178.181 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 938' ' ' LEU . . . . . 0.588 ' HB2' ' O ' ' A' ' 934' ' ' GLN . 0.2 OUTLIER -62.35 -44.31 96.78 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.987 0.422 . . . . 0.0 110.45 179.101 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 939' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -72.79 -30.65 64.26 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.929 -179.761 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -64.2 -35.82 82.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.857 0.361 . . . . 0.0 110.612 176.2 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 941' ' ' GLU . . . . . 0.419 ' HG3' ' N ' ' A' ' 942' ' ' ARG . 0.0 OUTLIER -78.9 -31.85 45.5 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.474 178.256 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 942' ' ' ARG . . . . . 0.625 ' HG3' ' N ' ' A' ' 943' ' ' VAL . 0.0 OUTLIER -65.59 -46.88 77.69 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 178.133 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 943' ' ' VAL . . . . . 0.625 ' N ' ' HG3' ' A' ' 942' ' ' ARG . 30.7 m -69.65 -28.25 36.76 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.265 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.08 179.503 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.7 -44.23 85.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.252 174.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 5.1 mttt -64.44 -45.06 89.12 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.315 -179.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.75 -35.64 77.35 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.832 0.349 . . . . 0.0 111.456 -178.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 27.4 mtt-85 -71.76 -50.38 30.52 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.861 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -150.39 121.61 7.8 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.404 -176.035 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 24.4 m . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.202 -0.904 . . . . 0.0 109.333 173.941 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 696' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.028 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . 86.06 -96.79 2.14 Favored Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.014 -178.106 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 698' ' ' GLY . . . . . . . . . . . . . . . 151.13 100.85 0.21 Allowed Glycine 0 N--CA 1.443 -0.844 0 C-N-CA 120.734 -0.746 . . . . 0.0 111.972 179.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 699' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -61.94 141.85 57.78 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 176.357 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 700' ' ' GLY . . . . . . . . . . . . . . . -122.55 -117.02 2.38 Favored Glycine 0 N--CA 1.446 -0.683 0 C-N-CA 120.497 -0.858 . . . . 0.0 112.59 -173.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -112.49 163.11 9.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 120.834 0.35 . . . . 0.0 110.779 -175.392 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -95.96 58.02 1.86 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.764 -175.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 703' ' ' GLY . . . . . . . . . . . . . . . -72.28 -70.81 1.15 Allowed Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 110.929 -0.868 . . . . 0.0 110.929 175.188 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.643 ' HA ' HD13 ' A' ' 801' ' ' ILE . 2.1 mp 71.98 -25.29 0.18 Allowed 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 172.606 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 705' ' ' SER . . . . . 0.455 ' HA ' ' O ' ' A' ' 730' ' ' GLY . 0.7 OUTLIER -73.67 68.59 1.23 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.148 0.499 . . . . 0.0 111.825 -178.829 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 706' ' ' GLY . . . . . . . . . . . . . . . -170.66 25.63 0.1 OUTLIER Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 121.042 -0.599 . . . . 0.0 112.038 176.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 707' ' ' LYS . . . . . 0.539 ' HE3' ' HB3' ' A' ' 744' ' ' GLU . 26.1 mmtm -133.7 137.56 45.35 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 178.014 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 708' ' ' ARG . . . . . 0.755 ' HA ' HG23 ' A' ' 732' ' ' VAL . 6.5 mtp85 -92.11 136.24 33.34 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 121.369 0.604 . . . . 0.0 111.218 -173.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 709' ' ' CYS . . . . . . . . . . . . . 1.7 t -104.31 109.97 22.02 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 171.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 710' ' ' TRP . . . . . 0.417 ' CZ2' ' HD3' ' A' ' 708' ' ' ARG . 89.2 m95 -90.13 96.23 10.57 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.815 0.817 . . . . 0.0 109.156 -178.526 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 711' ' ' LEU . . . . . 0.458 HD21 ' HB2' ' A' ' 719' ' ' CYS . 1.3 tp -95.64 104.65 16.58 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 114.611 -1.177 . . . . 0.0 111.305 -169.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 712' ' ' ALA . . . . . 0.404 ' HB2' ' HB3' ' A' ' 736' ' ' TYR . . . -103.51 30.92 4.66 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.786 0.803 . . . . 0.0 109.345 174.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 713' ' ' VAL . . . . . 0.722 HG13 ' HB3' ' A' ' 750' ' ' ASP . 49.1 t -92.98 115.43 31.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 114.954 -1.021 . . . . 0.0 109.833 178.244 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 714' ' ' ARG . . . . . . . . . . . . . 32.2 mtp85 -110.1 17.92 20.53 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.678 0.752 . . . . 0.0 110.069 -179.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 715' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -92.05 109.78 21.14 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.026 -0.988 . . . . 0.0 108.845 173.054 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 716' ' ' ALA . . . . . . . . . . . . . . . -45.41 -53.49 8.63 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 -172.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 717' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.42 -48.59 81.1 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.1 0.476 . . . . 0.0 110.747 -178.56 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 718' ' ' LEU . . . . . 0.579 HD21 ' CD2' ' A' ' 765' ' ' PHE . 0.2 OUTLIER -68.76 -48.35 63.94 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.684 -176.292 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 719' ' ' CYS . . . . . 0.458 ' HB2' HD21 ' A' ' 711' ' ' LEU . 16.3 p -67.29 -46.66 72.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.06 -174.825 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -62.48 -34.56 77.09 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.647 -0.252 . . . . 0.0 110.967 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 721' ' ' PHE . . . . . 0.429 ' HE2' ' HG3' ' A' ' 792' ' ' PRO . 93.7 t80 -65.64 -56.34 12.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.871 0.367 . . . . 0.0 110.366 178.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 91.9 mt -61.53 -45.73 92.92 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.237 -177.35 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 723' ' ' GLU . . . . . 0.582 ' HG3' ' N ' ' A' ' 724' ' ' THR . 0.0 OUTLIER -59.78 -42.2 92.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.115 -175.891 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 724' ' ' THR . . . . . 0.582 ' N ' ' HG3' ' A' ' 723' ' ' GLU . 8.6 m -77.43 -41.41 39.95 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.657 0.265 . . . . 0.0 111.499 -177.877 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 725' ' ' SER . . . . . . . . . . . . . 25.9 m -65.0 -36.62 85.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.835 0.35 . . . . 0.0 111.297 -178.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 726' ' ' LEU . . . . . 0.513 ' HB3' ' HB ' ' A' ' 731' ' ' ILE . 50.9 mt -79.31 -42.72 25.1 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.562 -176.654 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 727' ' ' GLN . . . . . 0.438 ' HG3' ' O ' ' A' ' 724' ' ' THR . 3.5 pp0? -62.69 -19.61 64.05 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 120.676 0.274 . . . . 0.0 111.318 -177.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 728' ' ' ARG . . . . . . . . . . . . . 8.5 mtp-105 -57.42 -39.87 77.11 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.082 178.401 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 729' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -96.31 6.26 49.17 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.056 -177.268 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 730' ' ' GLY . . . . . 0.455 ' O ' ' HA ' ' A' ' 705' ' ' SER . . . 94.26 7.65 60.6 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.556 -0.83 . . . . 0.0 113.09 176.422 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 731' ' ' ILE . . . . . 0.513 ' HB ' ' HB3' ' A' ' 726' ' ' LEU . 36.4 mm -67.23 116.4 6.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 176.096 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 732' ' ' VAL . . . . . 0.755 HG23 ' HA ' ' A' ' 708' ' ' ARG . 3.0 m -79.56 90.97 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 121.587 0.708 . . . . 0.0 111.097 -173.488 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 733' ' ' VAL . . . . . 0.511 HG21 ' HA ' ' A' ' 723' ' ' GLU . 21.8 t -72.4 135.71 27.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.097 178.393 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 734' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -143.89 127.4 16.94 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.15 -177.42 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 735' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.3 114.07 2.25 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.127 178.576 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 736' ' ' TYR . . . . . 0.404 ' HB3' ' HB2' ' A' ' 712' ' ' ALA . 43.0 t80 -87.25 100.63 12.83 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.107 0.479 . . . . 0.0 110.601 -178.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 737' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -104.62 -11.42 16.94 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.205 177.168 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 738' ' ' GLY . . . . . . . . . . . . . . . 139.92 68.56 0.04 OUTLIER Glycine 0 N--CA 1.448 -0.519 0 N-CA-C 111.211 -0.756 . . . . 0.0 111.211 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 739' ' ' GLN . . . . . 0.458 ' HB3' ' H ' ' A' ' 740' ' ' GLU . 14.7 mp0 -110.0 -138.46 0.37 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.885 0.374 . . . . 0.0 111.376 -174.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 740' ' ' GLU . . . . . 0.458 ' H ' ' HB3' ' A' ' 739' ' ' GLN . 2.2 tp10 -108.21 133.84 20.39 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.969 -175.032 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 741' ' ' PRO . . . . . 0.623 ' HA ' ' CH2' ' A' ' 757' ' ' TRP . 1.1 Cg_endo -83.39 123.54 3.44 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 123.241 2.627 . . . . 0.0 112.324 177.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 742' ' ' THR . . . . . 0.434 HG22 ' HD2' ' A' ' 743' ' ' PRO . 0.2 OUTLIER -108.28 132.47 21.07 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.437 176.272 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 743' ' ' PRO . . . . . 0.434 ' HD2' HG22 ' A' ' 742' ' ' THR . 37.5 Cg_endo -66.2 -5.33 12.21 Favored 'Trans proline' 0 N--CA 1.475 0.411 0 C-N-CA 123.151 2.567 . . . . 0.0 113.53 -175.286 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 744' ' ' GLU . . . . . 0.539 ' HB3' ' HE3' ' A' ' 707' ' ' LYS . 5.4 mm-40 -116.38 0.52 12.81 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.837 0.351 . . . . 0.0 110.894 177.622 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 745' ' ' ASP . . . . . 0.447 ' CG ' ' HB2' ' A' ' 708' ' ' ARG . 30.8 m-20 -103.93 165.61 10.93 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.44 -176.328 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 746' ' ' VAL . . . . . 0.672 HG21 HD11 ' A' ' 795' ' ' LEU . 2.6 p -128.35 136.04 61.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.252 0.548 . . . . 0.0 111.603 -174.54 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 747' ' ' LEU . . . . . 0.416 ' HB2' ' CD2' ' A' ' 757' ' ' TRP . 0.6 OUTLIER -99.72 104.91 16.67 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.866 176.895 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 748' ' ' ILE . . . . . . . . . . . . . 24.9 mt -98.96 109.54 24.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 109.157 -0.682 . . . . 0.0 109.157 174.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 14.7 t -117.43 158.51 24.36 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.205 -174.683 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 750' ' ' ASP . . . . . 0.722 ' HB3' HG13 ' A' ' 713' ' ' VAL . 0.0 OUTLIER -105.33 136.54 44.69 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.69 174.786 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 751' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 60.87 -167.45 0.19 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.882 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 752' ' ' VAL . . . . . . . . . . . . . 3.6 t -82.2 91.0 2.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.301 -175.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 753' ' ' VAL . . . . . 0.426 HG13 ' HB2' ' A' ' 755' ' ' LYS . 4.8 p -78.7 -18.06 13.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.405 175.712 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 754' ' ' SER . . . . . . . . . . . . . 1.4 m 56.25 56.8 5.47 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.358 -179.102 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 755' ' ' LYS . . . . . 0.426 ' HB2' HG13 ' A' ' 753' ' ' VAL . 0.0 OUTLIER -131.6 152.43 50.82 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 176.031 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 756' ' ' LYS . . . . . 0.428 ' HD3' ' HA ' ' A' ' 756' ' ' LYS . 42.4 mmtt -93.93 -43.36 8.59 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.262 -177.912 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 757' ' ' TRP . . . . . 0.623 ' CH2' ' HA ' ' A' ' 741' ' ' PRO . 71.3 t-105 68.75 96.66 0.06 Allowed 'General case' 0 N--CA 1.464 0.265 0 O-C-N 124.019 0.825 . . . . 0.0 111.709 178.506 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 758' ' ' GLN . . . . . 0.413 ' HB2' HE21 ' A' ' 758' ' ' GLN . 0.7 OUTLIER -81.04 63.87 5.57 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.293 0.568 . . . . 0.0 110.501 175.622 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 759' ' ' GLY . . . . . 0.422 ' HA2' ' HA ' ' A' ' 743' ' ' PRO . . . -128.89 -149.77 6.99 Favored Glycine 0 N--CA 1.446 -0.698 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.966 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 760' ' ' ARG . . . . . . . . . . . . . 2.0 ttt-85 -70.43 -49.36 49.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.782 0.325 . . . . 0.0 110.157 177.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 761' ' ' ALA . . . . . . . . . . . . . . . -166.2 153.07 9.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.526 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 762' ' ' VAL . . . . . 0.441 ' HB ' ' HB3' ' A' ' 757' ' ' TRP . 7.7 p -119.03 132.1 69.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 176.626 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 763' ' ' VAL . . . . . 0.565 HG21 HD21 ' A' ' 795' ' ' LEU . 1.4 t -123.02 125.15 71.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 120.832 0.349 . . . . 0.0 110.649 -177.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 764' ' ' THR . . . . . 0.947 ' HB ' HG12 ' A' ' 782' ' ' VAL . 86.3 m -111.68 124.33 52.1 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.346 -179.282 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 765' ' ' PHE . . . . . 0.89 ' HE1' HG23 ' A' ' 785' ' ' VAL . 0.7 OUTLIER -95.41 110.32 22.37 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 172.672 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 766' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.25 133.1 38.13 Favored 'General case' 0 C--N 1.317 -0.837 0 C-N-CA 120.527 -0.469 . . . . 0.0 109.946 -178.266 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 767' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.7 -38.5 3.7 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.296 -179.407 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.67 -35.94 1.44 Allowed 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.288 -179.324 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 58.3 m80 -120.88 140.74 51.38 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.153 0.501 . . . . 0.0 111.212 -175.11 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 770' ' ' ILE . . . . . . . . . . . . . 3.3 mt -123.97 103.25 12.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.484 179.12 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 771' ' ' GLY . . . . . . . . . . . . . . . -121.41 -19.65 3.44 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.18 178.099 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 772' ' ' ILE . . . . . 0.422 ' HA ' ' HD3' ' A' ' 773' ' ' PRO . 18.8 mm -94.56 132.69 28.24 Favored Pre-proline 0 C--N 1.326 -0.416 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 773' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 772' ' ' ILE . 3.9 Cg_exo -80.31 164.86 21.5 Favored 'Trans proline' 0 N--CA 1.459 -0.552 0 C-N-CA 122.967 2.445 . . . . 0.0 112.45 179.848 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 774' ' ' LEU . . . . . 0.487 ' H ' HD23 ' A' ' 774' ' ' LEU . 0.7 OUTLIER -91.95 -157.47 0.52 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.337 179.074 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 775' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -64.76 61.13 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 178.609 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.71 -12.4 17.69 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 169.026 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 777' ' ' ALA . . . . . . . . . . . . . . . -136.32 150.1 69.77 Favored Pre-proline 0 N--CA 1.447 -0.585 0 CA-C-N 114.139 -1.391 . . . . 0.0 108.617 176.507 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 778' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -61.94 102.65 0.26 Allowed 'Trans proline' 0 C--O 1.233 0.254 0 C-N-CA 122.706 2.271 . . . . 0.0 113.174 -177.034 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 779' ' ' GLY . . . . . . . . . . . . . . . 115.34 -4.58 21.74 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.481 -0.866 . . . . 0.0 113.548 174.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 780' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.33 122.74 39.53 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 117.217 0.508 . . . . 0.0 109.999 -179.197 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 781' ' ' TRP . . . . . 0.706 ' HZ3' HD13 ' A' ' 794' ' ' LEU . 13.0 m95 -133.78 134.9 43.47 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 -179.178 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . 0.947 HG12 ' HB ' ' A' ' 764' ' ' THR . 26.6 m -140.77 152.11 20.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 121.129 0.49 . . . . 0.0 110.735 174.557 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 783' ' ' HIS . . . . . . . . . . . . . 3.1 t-160 -155.67 119.84 4.57 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.276 174.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 784' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -89.49 100.14 13.0 Favored 'General case' 0 C--N 1.317 -0.833 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.689 -179.701 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 785' ' ' VAL . . . . . 0.89 HG23 ' HE1' ' A' ' 765' ' ' PHE . 0.0 OUTLIER -167.58 -172.46 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.527 179.365 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . -114.53 55.24 0.75 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.484 0.183 . . . . 0.0 111.468 -178.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 787' ' ' ALA . . . . . 0.542 ' HB2' ' HG ' ' A' ' 718' ' ' LEU . . . 51.52 61.99 11.81 Favored Pre-proline 0 N--CA 1.469 0.491 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.442 177.384 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 788' ' ' PRO . . . . . 0.417 ' HD3' ' N ' ' A' ' 787' ' ' ALA . 1.1 Cg_endo -84.0 46.24 1.96 Allowed 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 123.088 2.525 . . . . 0.0 112.837 -176.745 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 789' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 70.07 -15.73 0.32 Allowed 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 113.305 0.854 . . . . 0.0 113.305 174.167 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 790' ' ' GLU . . . . . 0.434 ' H ' ' HG3' ' A' ' 790' ' ' GLU . 0.0 OUTLIER -73.72 -51.76 15.49 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -175.39 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 791' ' ' LEU . . . . . 0.514 ' N ' ' HD2' ' A' ' 792' ' ' PRO . 0.3 OUTLIER -58.91 -50.54 87.46 Favored Pre-proline 0 CA--C 1.534 0.354 0 N-CA-C 112.427 0.528 . . . . 0.0 112.427 -176.959 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 792' ' ' PRO . . . . . 0.514 ' HD2' ' N ' ' A' ' 791' ' ' LEU . 10.8 Cg_endo -55.8 -33.45 88.19 Favored 'Trans proline' 0 C--N 1.357 0.987 0 C-N-CA 121.971 1.781 . . . . 0.0 112.258 177.283 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 793' ' ' ALA . . . . . . . . . . . . . . . -66.4 -50.39 63.6 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 120.938 0.399 . . . . 0.0 110.723 178.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 794' ' ' LEU . . . . . 0.706 HD13 ' HZ3' ' A' ' 781' ' ' TRP . 1.0 OUTLIER -64.41 -33.8 76.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.926 179.683 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 795' ' ' LEU . . . . . 0.672 HD11 HG21 ' A' ' 746' ' ' VAL . 0.7 OUTLIER -67.25 -43.8 81.01 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.995 -179.092 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -60.25 -37.14 79.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.074 0.464 . . . . 0.0 110.621 178.25 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 797' ' ' ARG . . . . . 0.462 ' HD2' HD23 ' A' ' 794' ' ' LEU . 0.0 OUTLIER -71.91 -48.78 43.12 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.225 179.124 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 798' ' ' ILE . . . . . 0.421 HG22 ' O ' ' A' ' 795' ' ' LEU . 0.6 OUTLIER -62.86 -18.02 20.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -176.979 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 799' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -63.22 -39.37 94.43 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 175.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 800' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 797' ' ' ARG . 6.1 mt 43.75 63.83 1.46 Allowed 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.232 177.739 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 801' ' ' ILE . . . . . 0.643 HD13 ' HA ' ' A' ' 704' ' ' LEU . 2.4 mt -96.11 -63.37 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.697 -179.784 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 802' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 64.51 11.91 6.99 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.884 178.464 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 803' ' ' MET . . . . . 0.465 ' HB2' HG22 ' A' ' 801' ' ' ILE . 12.5 mtt -98.24 160.18 14.46 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.134 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 804' ' ' GLU . . . . . 0.42 ' HG3' ' H ' ' A' ' 804' ' ' GLU . 0.0 OUTLIER -84.2 164.36 19.16 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.884 0.373 . . . . 0.0 110.025 177.362 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 805' ' ' SER . . . . . . . . . . . . . 4.0 m -144.23 129.58 18.85 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.309 178.493 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 806' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -130.18 161.61 30.73 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.782 179.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 807' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -156.86 103.7 1.94 Allowed Pre-proline 0 C--N 1.325 -0.489 0 CA-C-O 120.818 0.342 . . . . 0.0 110.723 -179.252 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 808' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -75.98 149.04 32.32 Favored 'Trans proline' 0 N--CA 1.462 -0.336 0 C-N-CA 123.017 2.478 . . . . 0.0 112.092 178.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 809' ' ' ALA . . . . . . . . . . . . . . . -160.68 122.13 3.03 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.339 179.102 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 810' ' ' ASN . . . . . . . . . . . . . 46.9 t30 -150.43 144.35 25.37 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.843 0.354 . . . . 0.0 111.076 179.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 811' ' ' ALA . . . . . . . . . . . . . . . -137.4 146.96 45.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.38 178.344 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 812' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -148.27 93.58 4.37 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-O 120.913 0.387 . . . . 0.0 110.96 -179.323 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 813' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_endo -87.75 145.93 6.8 Favored 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 123.58 2.853 . . . . 0.0 112.237 178.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 814' ' ' SER . . . . . . . . . . . . . 14.9 m -153.63 134.61 13.91 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.731 178.434 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 815' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -152.17 125.01 8.48 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.203 176.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 816' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -137.78 150.19 47.02 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.755 0.312 . . . . 0.0 111.242 -177.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 817' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.77 144.14 0.62 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.758 176.127 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 818' ' ' ALA . . . . . . . . . . . . . . . -160.66 120.29 2.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.608 0.242 . . . . 0.0 110.803 179.271 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 819' ' ' VAL . . . . . . . . . . . . . 4.1 t -126.79 122.22 60.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.448 -179.475 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 820' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -144.18 82.43 1.7 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.0 0.429 . . . . 0.0 110.801 -178.298 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 821' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -130.22 149.41 51.93 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.491 -177.549 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 822' ' ' ASN . . . . . 0.472 ' HB3' ' H ' ' A' ' 823' ' ' ASP . 37.0 t30 -156.66 -110.5 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.686 176.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 823' ' ' ASP . . . . . 0.472 ' H ' ' HB3' ' A' ' 822' ' ' ASN . 25.9 t0 55.36 98.7 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.415 0.686 . . . . 0.0 112.232 -177.598 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 824' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -78.74 -91.88 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.491 -177.608 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 825' ' ' MET . . . . . . . . . . . . . 4.0 ttm -137.7 135.4 36.41 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 -178.176 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 826' ' ' MET . . . . . 0.559 ' HA ' ' HB2' ' A' ' 850' ' ' GLN . 21.2 ptp -108.43 129.09 55.27 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.663 0.744 . . . . 0.0 111.613 -177.122 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 827' ' ' ILE . . . . . . . . . . . . . 10.0 mm -109.82 144.17 18.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-N 114.864 -1.062 . . . . 0.0 108.836 175.405 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 828' ' ' LEU . . . . . 0.614 ' HB2' HG12 ' A' ' 869' ' ' ILE . 16.1 tp -103.23 122.24 44.35 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.664 0.268 . . . . 0.0 110.282 -177.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 829' ' ' VAL . . . . . 0.503 ' HA ' ' HG ' ' A' ' 873' ' ' LEU . 1.2 p -114.73 104.33 16.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.372 0.606 . . . . 0.0 110.1 -179.222 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 830' ' ' VAL . . . . . 0.796 HG22 ' HB3' ' A' ' 854' ' ' ALA . 60.6 t -119.09 119.87 62.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.172 -179.703 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 831' ' ' ASP . . . . . 1.014 ' HB3' ' HB2' ' A' ' 837' ' ' ARG . 0.9 OUTLIER -130.06 153.8 48.09 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 176.86 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 832' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.75 -13.96 59.07 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -172.365 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 833' ' ' HIS . . . . . . . . . . . . . 7.8 m80 -131.68 95.83 22.24 Favored Pre-proline 0 C--N 1.327 -0.371 0 O-C-N 121.798 -0.564 . . . . 0.0 111.451 -178.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 834' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_exo -27.03 -46.52 0.08 OUTLIER 'Trans proline' 0 C--N 1.353 0.811 1 C-N-CA 125.835 4.357 . . . . 0.0 116.618 -171.756 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 835' ' ' ILE . . . . . . . . . . . . . 1.2 pp -57.18 -44.0 82.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -176.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 836' ' ' ASN . . . . . 0.504 ' O ' ' HG ' ' A' ' 840' ' ' LEU . 1.5 t30 -73.09 -46.75 49.57 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -178.322 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 837' ' ' ARG . . . . . 1.014 ' HB2' ' HB3' ' A' ' 831' ' ' ASP . 0.4 OUTLIER -51.9 -39.85 59.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.862 178.451 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 838' ' ' ARG . . . . . 0.403 ' HD3' ' O ' ' A' ' 838' ' ' ARG . 0.0 OUTLIER -64.51 -47.08 80.22 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.489 177.751 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 839' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.62 -42.48 95.47 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.106 -0.497 . . . . 0.0 112.011 -173.831 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 840' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 836' ' ' ASN . 0.0 OUTLIER -70.88 -26.79 63.39 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.211 177.14 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 841' ' ' ALA . . . . . . . . . . . . . . . -66.81 -33.57 75.91 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.156 0.503 . . . . 0.0 109.818 175.257 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 842' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -64.49 -41.72 96.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.974 174.415 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 843' ' ' GLN . . . . . 0.645 ' HG2' HG21 ' A' ' 932' ' ' ILE . 0.3 OUTLIER -62.01 -41.61 98.26 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.491 176.069 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 844' ' ' LEU . . . . . 0.74 HD13 ' HB3' ' A' ' 851' ' ' CYS . 0.5 OUTLIER -61.66 -33.19 73.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.595 176.067 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . -65.39 -34.19 88.64 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.94 -0.648 . . . . 0.0 111.707 175.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 846' ' ' SER . . . . . . . . . . . . . 9.3 m -68.91 -28.23 66.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.91 0.386 . . . . 0.0 110.606 176.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 847' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.65 -22.45 63.45 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.27 176.013 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 848' ' ' GLY . . . . . . . . . . . . . . . 84.84 24.06 47.03 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 121.088 -0.577 . . . . 0.0 113.446 173.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 849' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -114.77 -177.93 3.25 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.718 0.294 . . . . 0.0 110.454 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 850' ' ' GLN . . . . . 0.559 ' HB2' ' HA ' ' A' ' 826' ' ' MET . 4.2 mm100 -85.76 141.38 29.74 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 177.011 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 851' ' ' CYS . . . . . 0.74 ' HB3' HD13 ' A' ' 844' ' ' LEU . 0.0 OUTLIER -132.09 116.59 17.23 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 120.797 0.332 . . . . 0.0 110.892 -177.682 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 852' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -93.74 109.6 21.26 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 176.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 853' ' ' THR . . . . . 0.443 ' HA ' HG13 ' A' ' 829' ' ' VAL . 0.0 OUTLIER -91.8 116.6 29.03 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.689 -174.065 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 854' ' ' ALA . . . . . 0.796 ' HB3' HG22 ' A' ' 830' ' ' VAL . . . -136.18 161.09 36.71 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.752 178.691 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 855' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -142.04 73.95 1.43 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.975 177.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 856' ' ' ASP . . . . . 0.769 ' HB3' ' HB2' ' A' ' 859' ' ' ASP . 31.7 t70 176.55 150.17 0.14 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.784 -178.474 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 857' ' ' GLY . . . . . . . . . . . . . . . -77.4 -42.69 17.72 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.514 -178.103 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 858' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -71.71 -34.67 52.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.739 0.304 . . . . 0.0 110.348 -178.698 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 859' ' ' ASP . . . . . 0.769 ' HB2' ' HB3' ' A' ' 856' ' ' ASP . 0.1 OUTLIER -57.03 -38.85 73.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.642 177.306 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 860' ' ' ALA . . . . . 0.474 ' O ' HG12 ' A' ' 863' ' ' VAL . . . -66.57 -40.79 89.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.833 179.228 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 861' ' ' LEU . . . . . 0.467 HD22 ' HA ' ' A' ' 861' ' ' LEU . 0.2 OUTLIER -66.33 -33.25 75.3 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.095 0.474 . . . . 0.0 110.439 178.358 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 862' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -67.42 -42.55 83.03 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.884 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 863' ' ' VAL . . . . . 0.479 HG11 HD13 ' A' ' 828' ' ' LEU . 1.6 p -70.72 -32.02 47.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.715 0.293 . . . . 0.0 110.462 178.334 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 864' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -61.53 -39.68 91.93 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 121.15 0.5 . . . . 0.0 109.954 174.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 865' ' ' SER . . . . . . . . . . . . . 6.0 m -78.0 -16.97 57.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.935 178.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 866' ' ' LYS . . . . . . . . . . . . . 2.8 tttp -76.26 -60.63 2.25 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.423 178.178 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 867' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -121.69 -90.17 0.58 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.147 177.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 868' ' ' HIS . . . . . . . . . . . . . 23.7 p80 -179.1 -39.56 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 122.168 0.187 . . . . 0.0 110.869 176.291 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 869' ' ' ILE . . . . . 0.614 HG12 ' HB2' ' A' ' 828' ' ' LEU . 0.3 OUTLIER 69.38 149.58 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 O-C-N 123.392 0.432 . . . . 0.0 110.273 -175.6 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 870' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -92.41 -39.89 11.18 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.518 -0.473 . . . . 0.0 111.414 -177.073 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 871' ' ' ILE . . . . . . . . . . . . . 1.4 mt -138.64 133.9 42.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 177.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 872' ' ' VAL . . . . . 0.575 HG13 HD23 ' A' ' 828' ' ' LEU . 72.4 t -107.89 112.29 39.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.661 -179.363 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 873' ' ' LEU . . . . . 0.503 ' HG ' ' HA ' ' A' ' 829' ' ' VAL . 1.4 pp -108.72 127.92 54.41 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.115 0.484 . . . . 0.0 110.028 176.315 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 874' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -123.26 114.69 20.58 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.668 -177.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 875' ' ' ASP . . . . . 0.812 ' HB3' ' HB2' ' A' ' 831' ' ' ASP . 34.0 t0 -102.5 136.32 42.54 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 178.468 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 876' ' ' VAL . . . . . 0.452 HG23 HG23 ' A' ' 903' ' ' THR . 0.0 OUTLIER -141.09 129.19 22.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-O 121.296 0.569 . . . . 0.0 111.402 -177.053 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 877' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -80.21 -39.06 29.88 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 171.09 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 878' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -157.77 140.98 11.0 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 114.519 -1.219 . . . . 0.0 109.001 175.21 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 879' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_exo -68.59 78.4 0.68 Allowed 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 122.644 2.229 . . . . 0.0 111.52 177.655 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 880' ' ' ASN . . . . . 0.413 ' O ' ' HB3' ' A' ' 881' ' ' MET . 0.9 OUTLIER -80.48 120.46 24.51 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.364 -175.321 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 881' ' ' MET . . . . . 0.413 ' HB3' ' O ' ' A' ' 880' ' ' ASN . 31.7 ttp 74.59 -58.02 0.59 Allowed 'General case' 0 N--CA 1.468 0.464 0 O-C-N 124.005 0.816 . . . . 0.0 111.802 175.879 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 882' ' ' ASP . . . . . 0.409 ' OD1' ' HB3' ' A' ' 885' ' ' ARG . 0.2 OUTLIER -133.95 149.5 51.26 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.553 -176.046 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 883' ' ' GLY . . . . . . . . . . . . . . . -172.63 -1.13 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.598 -0.811 . . . . 0.0 113.094 178.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 884' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -123.25 -43.25 2.21 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.101 0.477 . . . . 0.0 110.346 -178.03 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 885' ' ' ARG . . . . . 0.409 ' HB3' ' OD1' ' A' ' 882' ' ' ASP . 0.6 OUTLIER -60.92 -36.4 79.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.809 -177.788 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 886' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.26 -42.96 99.23 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.462 -179.552 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 887' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.2 -44.34 76.03 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.047 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 888' ' ' GLN . . . . . 0.445 ' OE1' ' HD3' ' A' ' 891' ' ' ARG . 3.3 tp-100 -60.49 -43.04 97.41 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.6 178.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 889' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -70.62 -33.08 70.63 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.148 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 890' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -60.81 -48.35 89.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.707 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 891' ' ' ARG . . . . . 0.468 HH21 ' HG3' ' A' ' 892' ' ' GLN . 0.0 OUTLIER -74.49 -23.17 58.82 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.814 0.34 . . . . 0.0 110.6 179.606 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 892' ' ' GLN . . . . . 0.468 ' HG3' HH21 ' A' ' 891' ' ' ARG . 5.3 mt-30 -70.92 -43.36 68.41 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.896 178.454 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 893' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.06 -55.04 18.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.87 -178.421 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 894' ' ' GLY . . . . . . . . . . . . . . . 163.06 60.96 0.02 OUTLIER Glycine 0 N--CA 1.453 -0.208 0 C-N-CA 120.34 -0.933 . . . . 0.0 112.432 -179.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 895' ' ' LEU . . . . . 0.439 ' HB3' ' HA ' ' A' ' 891' ' ' ARG . 0.4 OUTLIER -68.15 111.15 4.33 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.971 0.415 . . . . 0.0 110.894 -179.509 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 896' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -128.42 7.84 5.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.442 174.143 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 897' ' ' LEU . . . . . 0.553 HD12 HG23 ' A' ' 872' ' ' VAL . 0.1 OUTLIER -125.31 138.98 32.74 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.032 -177.163 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 898' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.32 144.88 46.98 Favored 'Trans proline' 0 C--O 1.238 0.486 0 C-N-CA 122.571 2.181 . . . . 0.0 112.572 -178.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 899' ' ' VAL . . . . . 0.792 HG13 ' HA ' ' A' ' 919' ' ' MET . 0.2 OUTLIER -121.07 137.75 53.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 121.534 0.683 . . . . 0.0 110.331 179.443 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 900' ' ' ILE . . . . . 0.743 HG23 ' HB2' ' A' ' 921' ' ' SER . 6.3 mt -108.47 112.11 38.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.03 -179.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 901' ' ' GLY . . . . . 0.459 ' O ' ' HA ' ' A' ' 922' ' ' CYS . . . -97.93 110.04 3.94 Favored Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 121.053 -0.594 . . . . 0.0 112.009 -179.027 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 902' ' ' VAL . . . . . 0.579 ' HB ' ' HB2' ' A' ' 923' ' ' LEU . 0.2 OUTLIER -105.06 126.19 60.04 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 178.83 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 903' ' ' THR . . . . . 0.452 HG23 HG23 ' A' ' 876' ' ' VAL . 0.2 OUTLIER -135.2 153.77 51.83 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.056 0.455 . . . . 0.0 111.611 -174.665 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 904' ' ' ALA . . . . . 0.42 ' HB2' ' HD3' ' A' ' 925' ' ' LYS . . . -90.78 104.02 16.65 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.722 174.89 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 905' ' ' ASN . . . . . . . . . . . . . 16.4 t30 43.73 61.46 2.27 Favored 'General case' 0 N--CA 1.468 0.427 0 O-C-N 124.034 0.834 . . . . 0.0 111.553 -178.326 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 906' ' ' ALA . . . . . 0.579 ' HB1' ' HB2' ' A' ' 909' ' ' GLU . . . -55.29 -64.82 0.72 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.843 -178.279 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 907' ' ' LEU . . . . . . . . . . . . . 3.6 mp 56.24 35.19 25.34 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.848 178.475 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 908' ' ' ALA . . . . . . . . . . . . . . . -175.7 -45.36 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.096 -175.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 909' ' ' GLU . . . . . 0.579 ' HB2' ' HB1' ' A' ' 906' ' ' ALA . 0.0 OUTLIER -69.99 -20.23 63.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.327 -175.618 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 910' ' ' GLU . . . . . 0.428 ' HG2' ' H ' ' A' ' 911' ' ' LYS . 3.5 pm0 -62.29 -40.82 97.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.245 0.545 . . . . 0.0 109.682 172.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 911' ' ' LYS . . . . . 0.428 ' H ' ' HG2' ' A' ' 910' ' ' GLU . 0.7 OUTLIER -67.84 -35.94 79.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.99 178.286 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 912' ' ' GLN . . . . . 0.463 ' O ' ' HG3' ' A' ' 916' ' ' GLU . 0.0 OUTLIER -63.32 -44.19 95.64 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.225 176.125 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 913' ' ' ARG . . . . . 0.58 ' HD3' ' HB3' ' A' ' 919' ' ' MET . 0.0 OUTLIER -63.7 -28.07 69.64 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.912 179.562 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 914' ' ' CYS . . . . . . . . . . . . . 63.8 m -74.42 -28.11 60.92 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.96 0.41 . . . . 0.0 110.064 176.451 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 915' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.43 -49.98 50.02 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.049 179.217 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 916' ' ' GLU . . . . . 0.514 ' HG3' ' H ' ' A' ' 916' ' ' GLU . 0.0 OUTLIER -77.26 -38.42 51.02 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.984 -178.574 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 917' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 51.74 36.72 18.45 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 121.286 0.565 . . . . 0.0 111.18 -175.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -125.09 -14.06 3.44 Favored Glycine 0 N--CA 1.446 -0.646 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.691 179.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 919' ' ' MET . . . . . 0.792 ' HA ' HG13 ' A' ' 899' ' ' VAL . 2.7 ttm -63.79 -108.24 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.542 0.337 . . . . 0.0 110.575 175.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 920' ' ' ASP . . . . . 0.718 ' HB2' ' O ' ' A' ' 919' ' ' MET . 0.6 OUTLIER 153.0 -81.12 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.563 1.145 . . . . 0.0 110.097 174.355 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . 0.743 ' HB2' HG23 ' A' ' 900' ' ' ILE . 0.0 OUTLIER -98.61 149.38 22.83 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.133 -174.188 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 922' ' ' CYS . . . . . 0.459 ' HA ' ' O ' ' A' ' 901' ' ' GLY . 10.2 m -130.82 119.46 22.28 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.045 0.45 . . . . 0.0 109.838 176.67 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 923' ' ' LEU . . . . . 0.579 ' HB2' ' HB ' ' A' ' 902' ' ' VAL . 68.3 mt -120.17 167.11 12.57 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.939 -174.759 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 924' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -89.29 147.06 24.32 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.143 175.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 925' ' ' LYS . . . . . 0.528 ' HB3' ' HD3' ' A' ' 926' ' ' PRO . 10.0 tttp -57.56 -49.05 95.99 Favored Pre-proline 0 CA--C 1.539 0.55 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 179.73 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 926' ' ' PRO . . . . . 0.528 ' HD3' ' HB3' ' A' ' 925' ' ' LYS . 11.5 Cg_exo -72.24 66.16 3.51 Favored 'Trans proline' 0 C--N 1.357 0.985 0 C-N-CA 122.245 1.963 . . . . 0.0 112.708 177.756 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 927' ' ' VAL . . . . . . . . . . . . . 1.1 t -99.28 136.47 30.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.262 178.314 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 928' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -94.57 171.84 8.55 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.307 -178.179 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 929' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.43 -45.93 73.12 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 -177.105 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 930' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.8 -48.48 81.61 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.914 0.387 . . . . 0.0 110.287 -175.652 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 931' ' ' VAL . . . . . . . . . . . . . 43.7 t -62.08 -52.39 60.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.42 179.009 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 932' ' ' ILE . . . . . 0.645 HG21 ' HG2' ' A' ' 843' ' ' GLN . 0.0 OUTLIER -63.13 -39.09 83.89 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 CA-C-O 120.647 0.261 . . . . 0.0 111.284 -175.412 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 933' ' ' LYS . . . . . 0.447 ' HE2' ' HB3' ' A' ' 933' ' ' LYS . 0.0 OUTLIER -67.26 -47.68 70.0 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-O 120.875 0.369 . . . . 0.0 110.305 -179.327 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 934' ' ' GLN . . . . . 0.604 ' O ' ' HB2' ' A' ' 938' ' ' LEU . 0.0 OUTLIER -65.62 -35.82 81.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.107 -178.455 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 935' ' ' THR . . . . . 0.502 ' N ' ' HG2' ' A' ' 934' ' ' GLN . 19.2 m -72.97 -43.86 61.75 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.621 0.248 . . . . 0.0 111.187 -179.486 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 936' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.19 -45.02 90.2 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.572 -0.285 . . . . 0.0 110.343 178.862 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 937' ' ' THR . . . . . . . . . . . . . 26.6 m -64.37 -40.75 96.45 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.829 178.049 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 938' ' ' LEU . . . . . 0.645 ' O ' ' HG2' ' A' ' 941' ' ' GLU . 1.4 tp -62.68 -42.38 99.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.063 179.155 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 939' ' ' TYR . . . . . 0.448 ' O ' HG13 ' A' ' 943' ' ' VAL . 2.3 m-85 -75.86 -27.09 57.66 Favored 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.974 -179.321 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 940' ' ' ALA . . . . . . . . . . . . . . . -65.53 -32.65 74.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.172 0.511 . . . . 0.0 109.953 172.605 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 941' ' ' GLU . . . . . 0.645 ' HG2' ' O ' ' A' ' 938' ' ' LEU . 2.1 pt-20 -74.6 -31.46 62.03 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.161 175.621 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 942' ' ' ARG . . . . . 0.608 ' HG2' ' O ' ' A' ' 938' ' ' LEU . 4.6 mmt85 -65.34 -47.42 76.54 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-O 120.94 0.4 . . . . 0.0 110.278 177.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 943' ' ' VAL . . . . . 0.448 HG13 ' O ' ' A' ' 939' ' ' TYR . 5.1 m -69.01 -30.58 47.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.649 179.186 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 944' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.63 -41.76 83.38 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.422 177.042 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 945' ' ' LYS . . . . . . . . . . . . . 2.0 pttt -74.36 -25.85 59.77 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.575 0.226 . . . . 0.0 110.906 -179.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 946' ' ' SER . . . . . . . . . . . . . 15.2 m -76.21 -34.93 59.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.225 0.536 . . . . 0.0 109.741 175.178 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 947' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -72.9 -22.92 60.67 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.315 176.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 948' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.98 -5.53 49.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.267 177.751 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 949' ' ' SER . . . . . . . . . . . . . 5.9 m . . . . . 0 C--O 1.25 1.116 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.225 178.835 . . . . . . . . 0 0 . 1 stop_ save_