data_2lrr_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 2lrr _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 ' 728' ' ' HIS . . . . . 0.455 ' O ' ' HG2' ' A' ' 732' ' ' MET . 51.1 t60 . . . . . 0 CA--C 1.52 -0.199 0 CA-C-O 120.739 0.304 . . . . 0.0 110.885 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 729' ' ' PHE . . . . . 0.416 ' CZ ' ' HB3' ' A' ' 754' ' ' ASP . 66.1 m-85 -71.96 -32.48 67.33 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.314 -173.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 17.2 ttt180 -67.99 -35.13 77.81 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.152 177.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -67.17 -39.84 86.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.324 176.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 732' ' ' MET . . . . . 0.455 ' HG2' ' O ' ' A' ' 728' ' ' HIS . 38.7 mmm -61.86 -40.46 95.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.681 177.729 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 733' ' ' ILE . . . . . 0.417 ' O ' ' HG3' ' A' ' 737' ' ' MET . 64.5 mt -71.53 -42.99 72.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.898 -178.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 8.0 p -64.7 -35.37 74.71 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 C-N-CA 120.738 -0.385 . . . . 0.0 110.763 -177.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -66.33 -47.35 73.79 Favored 'General case' 0 CA--C 1.522 -0.124 0 CA-C-O 121.25 0.547 . . . . 0.0 109.577 173.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 736' ' ' PHE . . . . . 0.589 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 45.2 t80 -52.96 -42.73 65.78 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.015 -0.993 . . . . 0.0 111.676 179.014 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 737' ' ' MET . . . . . 0.417 ' HG3' ' O ' ' A' ' 733' ' ' ILE . 83.6 mtp -61.08 -32.68 72.33 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.673 -177.594 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -101.02 2.38 40.49 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.488 -177.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 60.7 m -98.44 174.45 6.46 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.18 0.514 . . . . 0.0 112.049 -175.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 16.5 ptmt -74.43 -18.26 60.67 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.726 177.023 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 29.9 mttm -57.93 111.18 1.08 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.101 -178.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 26.6 ptt? -78.1 -22.21 49.27 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.219 0.533 . . . . 0.0 109.717 175.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -143.19 135.99 27.7 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.329 -0.851 . . . . 0.0 109.698 178.152 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 744' ' ' LEU . . . . . 0.589 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 36.4 tp -105.69 105.77 15.96 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 179.095 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -86.47 115.41 23.95 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.146 -0.933 . . . . 0.0 110.208 178.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -90.34 149.73 41.68 Favored Pre-proline 0 C--N 1.319 -0.737 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.756 177.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_exo -69.32 156.04 65.62 Favored 'Trans proline' 0 N--CA 1.462 -0.358 0 C-N-CA 122.758 2.305 . . . . 0.0 111.953 177.057 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -66.15 -4.13 9.82 Favored 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 122.73 2.286 . . . . 0.0 112.771 176.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 32.9 t -67.04 -16.52 64.41 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.516 179.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.8 mp -71.97 128.63 36.33 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.699 0.285 . . . . 0.0 110.391 177.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 751' ' ' ASN . . . . . 0.487 ' O ' ' HG3' ' A' ' 755' ' ' ARG . 4.7 p30 -93.97 -176.89 4.15 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 175.469 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 20.7 t -54.13 -41.81 68.8 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 122.971 0.169 . . . . 0.0 111.303 -177.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 49.1 t-80 -65.06 -45.47 85.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.68 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 754' ' ' ASP . . . . . 0.416 ' HB3' ' CZ ' ' A' ' 729' ' ' PHE . 45.2 m-20 -62.03 -43.17 99.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.222 0.534 . . . . 0.0 110.057 -177.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 755' ' ' ARG . . . . . 0.487 ' HG3' ' O ' ' A' ' 751' ' ' ASN . 70.9 mtt-85 -65.21 -46.56 80.21 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.964 177.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 56.1 tp -52.78 -40.87 63.57 Favored 'General case' 0 N--CA 1.463 0.223 0 O-C-N 123.443 0.465 . . . . 0.0 110.533 177.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 757' ' ' ARG . . . . . 0.517 ' HA ' ' HE ' ' A' ' 757' ' ' ARG . 1.6 tpm_? -57.65 -50.81 71.94 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.248 176.545 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 61.2 t -63.15 -48.08 89.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.297 -179.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -55.74 -46.72 77.75 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.425 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 64.4 mt-30 -56.89 -52.96 63.11 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.949 0.404 . . . . 0.0 111.607 178.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 76.1 mt -65.55 -47.12 87.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.356 -175.201 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -63.74 -36.55 84.23 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.744 0.307 . . . . 0.0 110.876 -178.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -65.98 -39.16 90.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.719 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -73.99 -39.66 63.5 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.124 178.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 10.5 m170 -70.43 -34.97 73.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.086 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 107.4 31.41 3.77 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.414 -0.898 . . . . 0.0 112.925 176.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 29.3 mt -111.14 164.75 12.52 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 179.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 70.8 ttt-85 -88.5 132.99 34.27 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 -179.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.0 p80 -134.34 130.85 37.57 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.566 -177.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -155.43 146.22 22.29 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.831 -177.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 4.3 m . . . . . 0 N--CA 1.443 -0.793 0 CA-C-O 121.227 0.537 . . . . 0.0 109.823 176.824 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 37.0 p90 . . . . . 0 N--CA 1.451 -0.403 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 8.0 tt -116.22 133.54 62.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-O 121.12 0.486 . . . . 0.0 110.904 -177.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 4.0 m -115.17 124.73 52.2 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.365 -178.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 60.0 t -104.89 129.71 57.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 174.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 41.5 t -118.93 143.74 46.84 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.136 0.493 . . . . 0.0 110.979 -177.294 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 784' ' ' LYS . . . . . 0.544 ' HG3' ' CZ ' ' A' ' 736' ' ' PHE . 62.6 mtpt . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.973 -179.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 13.5 t60 . . . . . 0 N--CA 1.455 -0.201 0 CA-C-O 121.065 0.459 . . . . 0.0 110.638 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -77.53 -36.93 51.92 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.398 -172.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 53.2 ttp180 -59.92 -41.02 90.85 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 175.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -65.76 -45.59 81.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.714 178.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 19.3 mmm -58.24 -45.02 88.49 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.93 178.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 74.9 mt -70.71 -43.39 77.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.827 -177.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 8.5 p -66.28 -35.5 75.12 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.14 -177.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -77.15 -27.6 53.9 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-O 120.789 0.328 . . . . 0.0 110.449 176.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 736' ' ' PHE . . . . . 0.495 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 25.7 t80 -65.34 -41.1 94.28 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.299 178.015 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 65.6 mtm -63.58 -29.71 70.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.071 0.463 . . . . 0.0 110.518 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -96.45 8.45 44.03 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.026 -0.533 . . . . 0.0 111.097 179.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 44.2 t -93.68 165.88 12.5 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.363 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -84.91 -1.65 56.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.292 -179.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -73.79 160.47 31.44 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.719 179.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 4.4 mpp? -108.89 -28.56 9.09 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.217 175.102 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -142.92 127.68 18.18 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.211 0.529 . . . . 0.0 111.145 178.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 744' ' ' LEU . . . . . 0.495 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 52.7 tp -96.73 106.13 18.37 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.312 179.057 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -90.94 106.07 18.26 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.089 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -75.14 157.18 85.44 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.19 -177.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -68.33 161.8 43.2 Favored 'Trans proline' 0 CA--C 1.535 0.539 0 C-N-CA 122.641 2.228 . . . . 0.0 112.057 175.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -76.39 -9.75 18.89 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.505 2.137 . . . . 0.0 111.753 178.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 20.1 t -64.07 -21.44 66.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.427 -179.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 11.2 mp -61.5 121.24 12.21 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.655 -0.248 . . . . 0.0 110.74 178.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 751' ' ' ASN . . . . . 0.476 ' O ' ' HG2' ' A' ' 755' ' ' ARG . 3.4 p-10 -90.72 -176.65 4.77 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 177.661 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 15.1 m -50.11 -49.83 50.42 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -173.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 38.7 t-80 -54.04 -47.9 71.11 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.977 177.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 754' ' ' ASP . . . . . 0.486 ' O ' HG23 ' A' ' 758' ' ' VAL . 57.9 m-20 -62.75 -45.43 92.76 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.629 -176.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 755' ' ' ARG . . . . . 0.476 ' HG2' ' O ' ' A' ' 751' ' ' ASN . 23.7 mmt180 -52.99 -60.59 3.09 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.835 176.263 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -52.62 -45.04 66.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 114.654 -1.157 . . . . 0.0 111.269 -177.298 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 10.2 mmt85 -55.48 -49.04 73.56 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.991 178.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 758' ' ' VAL . . . . . 0.486 HG23 ' O ' ' A' ' 754' ' ' ASP . 63.1 t -62.71 -45.34 99.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.738 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -55.69 -54.33 45.61 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.824 179.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 99.3 mt-30 -54.69 -52.04 63.65 Favored 'General case' 0 C--O 1.232 0.183 0 O-C-N 123.25 0.344 . . . . 0.0 111.528 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 94.3 mt -62.77 -50.42 79.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.228 -176.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -64.1 -38.78 92.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.842 0.353 . . . . 0.0 111.166 -178.078 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -66.25 -35.83 81.43 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.035 -178.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -85.19 -29.55 24.63 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.757 0.313 . . . . 0.0 110.942 -178.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 6.7 m170 -70.08 -24.44 63.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.835 0.35 . . . . 0.0 110.598 174.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 96.2 28.82 8.88 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.871 -0.681 . . . . 0.0 112.366 177.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 56.0 mt -105.08 170.89 7.61 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 768' ' ' ARG . . . . . 0.556 ' HB3' ' OG ' ' A' ' 783' ' ' SER . 30.4 ttt180 -98.89 140.12 33.53 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 -178.06 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -150.92 134.05 16.04 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.28 0.562 . . . . 0.0 111.782 -176.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -155.47 168.23 27.79 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.493 175.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 7.2 m . . . . . 0 C--N 1.318 -0.799 0 CA-C-O 121.12 0.486 . . . . 0.0 110.694 -176.76 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 49.0 p90 . . . . . 0 N--CA 1.448 -0.551 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 6.2 tt -121.13 135.64 60.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.85 0.357 . . . . 0.0 110.68 -178.152 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 29.5 m -116.97 124.86 50.39 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.697 -177.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 47.5 t -108.53 124.06 64.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.095 176.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 783' ' ' SER . . . . . 0.556 ' OG ' ' HB3' ' A' ' 768' ' ' ARG . 4.6 p -113.37 140.78 47.75 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 121.311 0.577 . . . . 0.0 111.099 -179.59 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 784' ' ' LYS . . . . . 0.467 ' HG3' ' CZ ' ' A' ' 736' ' ' PHE . 62.7 mtpt . . . . . 0 C--N 1.326 -0.439 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.084 179.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 10.6 t60 . . . . . 0 N--CA 1.461 0.082 0 CA-C-O 120.801 0.334 . . . . 0.0 111.202 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -69.38 -32.96 72.33 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.832 -174.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 57.8 ttm-85 -64.2 -45.78 86.82 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.227 177.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -62.24 -42.68 99.53 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.727 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 26.8 mmm -59.3 -44.71 92.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.687 177.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 66.7 mt -74.01 -43.04 52.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.146 -0.479 . . . . 0.0 112.174 -176.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 734' ' ' VAL . . . . . 0.44 ' HA ' ' HE2' ' A' ' 737' ' ' MET . 12.1 p -64.62 -40.3 88.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.19 -176.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -77.45 -26.38 51.45 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.367 178.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 736' ' ' PHE . . . . . 0.453 ' CZ ' ' HG3' ' A' ' 784' ' ' LYS . 23.8 t80 -60.52 -39.97 89.75 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.756 174.432 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 737' ' ' MET . . . . . 0.44 ' HE2' ' HA ' ' A' ' 734' ' ' VAL . 67.7 mtm -63.54 -25.38 68.22 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.02 0.438 . . . . 0.0 110.698 177.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -96.96 3.07 52.22 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.26 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 67.0 m -101.52 170.99 7.84 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.801 0.334 . . . . 0.0 110.992 -178.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -85.43 -11.27 54.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.389 -176.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -63.98 128.53 36.24 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.473 176.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 742' ' ' MET . . . . . 0.4 ' HG3' ' HG3' ' A' ' 743' ' ' GLN . 14.5 ptp -83.57 -24.71 31.44 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.838 0.351 . . . . 0.0 110.407 175.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 743' ' ' GLN . . . . . 0.4 ' HG3' ' HG3' ' A' ' 742' ' ' MET . 52.0 mt-30 -134.63 131.83 38.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.286 -178.266 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 744' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -94.71 98.63 10.91 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 175.211 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -83.29 101.3 11.19 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.386 -178.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 746' ' ' PHE . . . . . 0.405 ' O ' ' HB2' ' A' ' 779' ' ' PHE . 68.1 m-85 -85.56 148.29 48.82 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.734 179.586 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 747' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 746' ' ' PHE . 14.8 Cg_exo -68.29 155.0 70.87 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 122.68 2.253 . . . . 0.0 112.028 176.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -68.02 -8.71 23.48 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.729 2.286 . . . . 0.0 112.46 178.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 32.1 t -63.14 -22.67 67.02 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.284 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 11.2 mp -59.29 118.54 6.06 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 175.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -81.02 -178.2 6.78 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 179.494 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 14.0 p -54.63 -42.6 71.4 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.688 0.28 . . . . 0.0 111.201 -178.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 75.6 m80 -68.99 -40.0 79.03 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.886 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 41.5 m-20 -59.8 -51.0 71.62 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 121.07 0.462 . . . . 0.0 110.261 178.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 43.8 mtt180 -64.96 -43.72 91.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.519 -178.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 55.7 tp -54.26 -41.47 68.84 Favored 'General case' 0 C--N 1.33 -0.242 0 O-C-N 123.367 0.417 . . . . 0.0 110.292 177.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 757' ' ' ARG . . . . . 0.555 ' HA ' ' HE ' ' A' ' 757' ' ' ARG . 0.7 OUTLIER -60.39 -48.22 82.68 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.065 176.886 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 58.7 t -59.75 -50.18 81.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.022 178.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -55.26 -50.18 70.15 Favored 'General case' 0 C--O 1.226 -0.156 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.557 179.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -63.93 -37.72 88.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.829 -177.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 96.3 mt -69.54 -44.11 80.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 120.8 0.333 . . . . 0.0 110.65 178.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -66.01 -34.98 79.34 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.201 0.525 . . . . 0.0 110.182 177.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -66.53 -38.32 86.92 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.41 175.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -69.77 -42.81 73.33 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.906 177.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 11.7 m170 -75.24 -29.33 60.19 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.88 -178.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 92.99 43.49 4.1 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.117 178.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 82.8 mt -110.35 -170.16 1.59 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.923 0.392 . . . . 0.0 110.544 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 768' ' ' ARG . . . . . 0.417 ' HD3' ' HB2' ' A' ' 783' ' ' SER . 60.3 ttt-85 -106.67 126.63 52.52 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.822 -179.226 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -139.77 132.44 28.92 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.066 0.46 . . . . 0.0 111.243 -177.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -156.36 138.87 14.94 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.668 -176.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 771' ' ' SER . . . . . 0.402 ' HA ' ' HA ' ' A' ' 780' ' ' ILE . 19.2 m . . . . . 0 C--N 1.321 -0.65 0 CA-C-O 121.047 0.451 . . . . 0.0 110.191 178.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 779' ' ' PHE . . . . . 0.405 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 28.4 p90 . . . . . 0 N--CA 1.454 -0.234 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 780' ' ' ILE . . . . . 0.402 ' HA ' ' HA ' ' A' ' 771' ' ' SER . 9.8 tt -127.96 131.82 69.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 121.198 0.523 . . . . 0.0 111.238 -177.779 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 13.4 m -113.71 119.22 36.66 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.345 -178.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 43.3 t -102.09 121.15 52.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.007 177.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 783' ' ' SER . . . . . 0.417 ' HB2' ' HD3' ' A' ' 768' ' ' ARG . 4.2 m -109.3 138.96 44.85 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-O 120.738 0.304 . . . . 0.0 110.322 -179.128 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 784' ' ' LYS . . . . . 0.453 ' HG3' ' CZ ' ' A' ' 736' ' ' PHE . 61.4 mtpt . . . . . 0 C--N 1.324 -0.533 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.663 178.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 15.6 t60 . . . . . 0 N--CA 1.462 0.17 0 CA-C-O 120.66 0.267 . . . . 0.0 110.63 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -71.21 -33.01 69.52 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.466 -0.333 . . . . 0.0 110.755 -175.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 10.4 tpt180 -55.31 -47.74 75.16 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.938 0.399 . . . . 0.0 110.355 173.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -64.89 -42.34 94.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.43 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 35.6 mmm -60.62 -39.6 88.81 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.011 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 733' ' ' ILE . . . . . 0.421 ' O ' ' HB3' ' A' ' 736' ' ' PHE . 74.3 mt -74.93 -45.45 43.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.781 -178.412 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 11.3 p -66.33 -37.42 79.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 C-N-CA 120.648 -0.421 . . . . 0.0 110.911 -177.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -80.59 -21.6 41.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.752 0.311 . . . . 0.0 110.374 178.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 736' ' ' PHE . . . . . 0.587 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 15.8 t80 -61.16 -46.08 91.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.532 174.015 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 64.7 mtm -60.66 -34.53 74.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.546 178.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -78.86 -29.63 44.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.182 -179.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 68.6 m -73.55 -17.64 61.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.064 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 58.5 mttp 69.99 17.25 7.46 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 173.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 741' ' ' LYS . . . . . 0.46 ' HE2' ' O ' ' A' ' 743' ' ' GLN . 46.1 mtpt -69.7 139.01 53.38 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 172.13 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -73.31 -31.14 63.84 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.854 0.359 . . . . 0.0 110.675 -178.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 743' ' ' GLN . . . . . 0.46 ' O ' ' HE2' ' A' ' 741' ' ' LYS . 54.9 mt-30 -143.73 136.94 27.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.943 -0.572 . . . . 0.0 109.726 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 744' ' ' LEU . . . . . 0.587 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 52.9 tp -112.24 110.74 21.16 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 176.235 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -86.07 108.02 18.08 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.741 178.616 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . 60.6 m-85 -78.97 154.33 77.73 Favored Pre-proline 0 C--N 1.322 -0.623 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.401 177.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 747' ' ' PRO . . . . . 0.442 ' O ' HD12 ' A' ' 750' ' ' LEU . 31.5 Cg_exo -60.4 147.78 92.83 Favored 'Trans proline' 0 CA--C 1.529 0.269 0 C-N-CA 122.689 2.259 . . . . 0.0 112.233 178.029 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -70.73 -7.45 21.37 Favored 'Trans proline' 0 CA--C 1.528 0.187 0 C-N-CA 122.704 2.269 . . . . 0.0 112.689 179.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 24.6 m -71.11 -16.88 62.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.377 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 750' ' ' LEU . . . . . 0.442 HD12 ' O ' ' A' ' 747' ' ' PRO . 10.9 mp -59.97 118.91 6.82 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.096 174.429 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 751' ' ' ASN . . . . . 0.494 ' ND2' ' H ' ' A' ' 753' ' ' HIS . 1.5 p-10 -88.11 -178.69 6.02 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 177.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 19.7 m -53.19 -31.41 42.69 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -176.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 753' ' ' HIS . . . . . 0.494 ' H ' ' ND2' ' A' ' 751' ' ' ASN . 61.8 m170 -79.42 -37.72 36.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.457 0.17 . . . . 0.0 111.124 -179.194 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 754' ' ' ASP . . . . . 0.405 ' HB3' ' HG ' ' A' ' 750' ' ' LEU . 67.6 m-20 -66.43 -44.39 83.02 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.222 0.534 . . . . 0.0 109.758 177.77 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 74.8 mtt180 -60.6 -50.28 74.16 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.179 177.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 55.8 tp -54.54 -39.69 67.93 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.702 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 757' ' ' ARG . . . . . 0.401 ' HB3' ' O ' ' A' ' 754' ' ' ASP . 3.8 tpt180 -55.98 -51.78 66.52 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.202 175.305 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 85.5 t -61.33 -49.22 85.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.974 179.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 89.6 m-70 -53.59 -56.28 18.5 Favored 'General case' 0 N--CA 1.463 0.217 0 O-C-N 123.419 0.449 . . . . 0.0 110.838 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -55.97 -45.24 78.98 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.057 0.392 . . . . 0.0 112.057 -179.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 98.5 mt -66.69 -48.55 79.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.574 0.226 . . . . 0.0 111.069 -178.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -65.44 -32.13 73.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.916 0.389 . . . . 0.0 110.68 -179.029 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -69.74 -33.45 72.47 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.347 178.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -73.46 -35.85 65.77 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.018 176.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 -67.19 -35.98 80.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.682 175.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 102.01 19.02 15.81 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.18 -179.251 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 71.2 mt -92.35 178.48 5.82 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 18.4 ttt180 -96.43 140.04 31.67 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 174.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.1 p80 -145.63 123.31 11.85 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.22 -179.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -151.07 167.52 27.43 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.07 -179.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 15.1 m . . . . . 0 C--N 1.318 -0.761 0 CA-C-O 121.029 0.443 . . . . 0.0 110.745 -177.671 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 45.7 p90 . . . . . 0 N--CA 1.449 -0.518 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 12.2 tt -102.49 132.59 48.24 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-O 121.155 0.503 . . . . 0.0 110.489 -179.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 6.1 m -113.6 118.75 35.27 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.047 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 50.4 t -98.57 130.23 47.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 177.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 8.5 t -122.26 142.26 50.64 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.063 0.459 . . . . 0.0 110.249 -177.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 9.6 mtpm? . . . . . 0 C--N 1.324 -0.542 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.751 -178.638 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 14.3 t60 . . . . . 0 N--CA 1.463 0.222 0 CA-C-O 120.767 0.317 . . . . 0.0 111.621 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -72.35 -22.6 61.13 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.903 -175.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 730' ' ' ARG . . . . . 0.425 ' HE ' ' HB2' ' A' ' 730' ' ' ARG . 0.4 OUTLIER -60.7 -49.59 76.9 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 172.658 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 731' ' ' ALA . . . . . 0.416 ' HA ' HG13 ' A' ' 734' ' ' VAL . . . -59.81 -46.15 90.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.548 178.517 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 35.5 mmm -55.48 -44.55 76.58 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.011 178.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 59.1 mt -77.38 -38.22 26.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.188 -0.46 . . . . 0.0 112.003 -176.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 734' ' ' VAL . . . . . 0.416 HG13 ' HA ' ' A' ' 731' ' ' ALA . 8.8 p -68.01 -36.69 76.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 O-C-N 122.036 -0.415 . . . . 0.0 110.666 -178.724 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -73.47 -31.77 63.96 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 121.153 0.501 . . . . 0.0 109.804 175.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 736' ' ' PHE . . . . . 0.521 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 22.1 t80 -63.46 -40.82 98.15 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.824 175.293 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 737' ' ' MET . . . . . 0.433 ' HE2' ' ND1' ' A' ' 765' ' ' HIS . 73.2 mtm -72.99 -6.86 48.26 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.998 0.428 . . . . 0.0 110.833 177.237 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -103.24 0.46 31.63 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.857 174.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 32.8 t -102.67 169.77 8.43 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.28 -178.168 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 2.6 ptmt -90.9 -6.54 54.01 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.063 -177.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 741' ' ' LYS . . . . . 0.536 ' O ' ' HE2' ' A' ' 784' ' ' LYS . 27.6 mtpp -64.47 126.25 27.23 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.586 177.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 3.2 mpp? -67.73 -30.32 69.77 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.439 176.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -149.17 155.0 39.99 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 120.904 0.383 . . . . 0.0 111.372 176.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 744' ' ' LEU . . . . . 0.521 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 69.0 tp -115.17 111.31 20.8 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.277 -176.841 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -82.72 105.74 13.99 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.417 178.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 746' ' ' PHE . . . . . 0.453 ' O ' ' HB2' ' A' ' 779' ' ' PHE . 71.8 m-85 -79.01 154.81 77.71 Favored Pre-proline 0 C--N 1.325 -0.489 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 176.254 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 747' ' ' PRO . . . . . 0.446 ' O ' HD13 ' A' ' 750' ' ' LEU . 59.6 Cg_endo -76.4 156.39 36.84 Favored 'Trans proline' 0 CA--C 1.533 0.452 0 C-N-CA 122.453 2.102 . . . . 0.0 112.24 178.295 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -68.75 -5.12 14.68 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.959 2.44 . . . . 0.0 113.203 -179.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 4.4 p -69.23 -16.93 63.71 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.86 -178.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 750' ' ' LEU . . . . . 0.446 HD13 ' O ' ' A' ' 747' ' ' PRO . 11.2 mp -63.55 117.98 7.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.337 176.057 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -78.8 -176.95 5.22 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 20.0 t -54.47 -39.51 67.53 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 120.768 0.318 . . . . 0.0 110.871 -177.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 40.1 m80 -73.25 -38.83 65.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.304 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -63.37 -48.1 79.31 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.928 0.394 . . . . 0.0 110.259 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 74.0 mtt180 -60.62 -46.77 89.02 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.985 177.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 60.9 tp -55.2 -44.38 75.28 Favored 'General case' 0 CA--C 1.523 -0.066 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.727 179.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 757' ' ' ARG . . . . . 0.419 ' HA ' ' HE ' ' A' ' 757' ' ' ARG . 2.6 mmp_? -51.5 -54.82 23.19 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.474 174.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 90.6 t -60.21 -46.79 94.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.495 -178.136 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -56.93 -52.22 66.04 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 110.314 -0.254 . . . . 0.0 110.314 178.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 99.3 mt-30 -56.71 -43.68 80.82 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.462 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 761' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 757' ' ' ARG . 95.4 mt -67.08 -50.06 67.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.257 -178.269 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -62.14 -38.66 89.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.045 0.45 . . . . 0.0 110.523 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -68.03 -30.68 69.97 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.554 178.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -76.49 -42.42 43.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.502 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 765' ' ' HIS . . . . . 0.433 ' ND1' ' HE2' ' A' ' 737' ' ' MET . 38.0 m-70 -75.41 -28.34 59.37 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.956 -179.523 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 103.67 24.42 7.79 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.657 177.411 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 767' ' ' LEU . . . . . 0.424 HD13 ' SD ' ' A' ' 737' ' ' MET . 79.2 mt -96.16 164.34 12.72 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.878 -0.415 . . . . 0.0 109.878 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 37.9 ttp180 -93.63 112.92 24.9 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.953 0.406 . . . . 0.0 110.151 -178.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 2.9 p80 -108.54 124.25 50.17 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.625 -178.229 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -137.7 130.27 29.7 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.298 -179.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 771' ' ' SER . . . . . 0.422 ' HA ' ' HA ' ' A' ' 780' ' ' ILE . 12.5 p . . . . . 0 C--N 1.314 -0.963 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.794 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 779' ' ' PHE . . . . . 0.453 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 48.1 p90 . . . . . 0 N--CA 1.448 -0.563 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 780' ' ' ILE . . . . . 0.422 ' HA ' ' HA ' ' A' ' 771' ' ' SER . 12.3 tt -120.68 138.39 51.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 121.063 0.459 . . . . 0.0 110.79 -178.696 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 8.8 m -121.86 120.91 35.92 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.374 -179.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 50.1 t -99.8 115.6 41.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 177.363 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 29.2 t -110.92 136.18 50.34 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 121.266 0.555 . . . . 0.0 110.553 -178.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 784' ' ' LYS . . . . . 0.536 ' HE2' ' O ' ' A' ' 741' ' ' LYS . 52.8 mtmt . . . . . 0 C--N 1.324 -0.506 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.136 178.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 13.4 t60 . . . . . 0 N--CA 1.455 -0.186 0 CA-C-O 120.538 0.209 . . . . 0.0 110.793 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -71.97 -38.27 69.76 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.994 -176.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 42.1 ttt85 -62.54 -38.84 91.58 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.184 176.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -64.65 -45.56 86.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.241 176.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 32.9 mmm -58.01 -42.74 85.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.886 177.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 72.8 mt -72.25 -42.92 66.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 N-CA-C 111.908 0.336 . . . . 0.0 111.908 -177.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 8.2 p -65.97 -36.99 78.82 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.576 -178.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -78.21 -24.44 47.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.073 0.463 . . . . 0.0 110.405 177.132 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 736' ' ' PHE . . . . . 0.54 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 34.9 t80 -64.43 -41.59 96.49 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.537 175.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 59.7 mtm -64.02 -28.81 70.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.844 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -85.81 -15.29 42.45 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.229 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 61.6 m -81.33 166.87 20.09 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.45 -179.271 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.98 7.22 44.94 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.924 0.392 . . . . 0.0 111.466 -179.579 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 73.5 mttt -85.22 126.92 34.06 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.024 173.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 95.5 mmm -81.6 -17.88 46.71 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.886 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -138.76 136.21 35.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.684 -178.178 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 744' ' ' LEU . . . . . 0.54 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 44.3 tp -120.17 109.97 16.06 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.096 178.62 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -90.09 113.08 24.75 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.457 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 746' ' ' PHE . . . . . 0.473 ' O ' ' HB2' ' A' ' 779' ' ' PHE . 84.1 m-85 -83.08 153.47 66.59 Favored Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.964 176.338 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 747' ' ' PRO . . . . . 0.441 ' O ' HD13 ' A' ' 750' ' ' LEU . 16.8 Cg_exo -67.18 155.79 69.1 Favored 'Trans proline' 0 CA--C 1.532 0.394 0 C-N-CA 122.508 2.139 . . . . 0.0 112.44 178.445 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -68.19 -7.71 20.73 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.838 2.359 . . . . 0.0 112.394 177.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 7.3 m -63.89 -20.25 65.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.552 179.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 750' ' ' LEU . . . . . 0.441 HD13 ' O ' ' A' ' 747' ' ' PRO . 11.2 mp -63.34 122.74 16.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.352 176.445 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 1.6 p30 -84.42 -178.61 6.96 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 15.2 m -48.55 -46.57 39.11 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 123.166 0.291 . . . . 0.0 111.381 179.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 50.9 m80 -72.03 -36.9 69.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.636 -178.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 -60.36 -50.67 72.69 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.133 0.492 . . . . 0.0 109.801 178.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 62.8 mtt85 -61.0 -45.15 95.98 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.181 178.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 53.4 tp -52.98 -42.81 65.89 Favored 'General case' 0 C--O 1.235 0.334 0 O-C-N 123.535 0.522 . . . . 0.0 111.03 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 11.0 mmm180 -58.83 -53.69 55.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.017 176.168 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 60.9 t -56.79 -48.68 80.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.401 -179.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -55.28 -55.3 33.01 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.596 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 70.3 mt-30 -64.47 -33.37 75.73 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 -176.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 96.9 mt -70.14 -48.64 60.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 C-N-CA 120.894 -0.323 . . . . 0.0 110.464 178.057 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -63.49 -34.6 78.13 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.167 0.508 . . . . 0.0 110.28 177.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -64.28 -36.7 84.94 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.652 176.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -70.02 -46.54 64.85 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.189 176.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 11.2 m-70 -65.15 -30.12 71.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.108 -178.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 95.01 25.18 15.03 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.767 -0.73 . . . . 0.0 111.825 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 68.1 mt -99.3 176.93 5.36 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 22.6 ttp180 -99.66 135.29 41.29 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -132.69 127.69 35.33 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.189 0.518 . . . . 0.0 110.691 -178.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -133.85 143.12 48.12 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.98 -177.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 12.7 p . . . . . 0 C--N 1.317 -0.848 0 CA-C-O 121.275 0.56 . . . . 0.0 110.296 175.962 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 779' ' ' PHE . . . . . 0.473 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 44.4 p90 . . . . . 0 N--CA 1.448 -0.57 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 12.6 tt -127.5 133.82 66.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-O 120.984 0.421 . . . . 0.0 110.773 -178.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 24.7 m -119.71 116.01 25.08 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.415 -179.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 38.0 t -94.36 133.88 33.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.872 179.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -117.02 135.03 54.01 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.764 0.316 . . . . 0.0 111.16 -179.421 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 23.2 mtpp . . . . . 0 C--O 1.234 0.237 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.171 175.267 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 30.6 t60 . . . . . 0 C--O 1.233 0.202 0 CA-C-O 120.843 0.354 . . . . 0.0 111.359 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 729' ' ' PHE . . . . . 0.467 ' CZ ' ' HB3' ' A' ' 754' ' ' ASP . 55.6 m-85 -80.98 -36.47 30.69 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.679 -175.769 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 15.2 tpp85 -56.95 -43.72 81.86 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 174.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -64.63 -47.46 78.45 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.239 -179.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 4.5 mtm -65.78 -35.52 80.95 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.164 -178.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 733' ' ' ILE . . . . . 0.417 HD12 HG12 ' A' ' 758' ' ' VAL . 81.2 mt -73.27 -42.78 57.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.581 -0.282 . . . . 0.0 111.535 179.392 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 9.1 p -66.06 -37.53 79.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 120.594 -0.442 . . . . 0.0 110.975 -176.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -75.14 -29.3 60.45 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.881 0.372 . . . . 0.0 110.251 176.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 736' ' ' PHE . . . . . 0.524 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 36.1 t80 -61.8 -40.11 94.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.1 176.535 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 49.1 mtm -62.46 -33.19 74.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.788 178.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -92.08 3.58 54.98 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.069 -178.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 22.8 t -97.44 166.99 11.27 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -88.72 -1.17 57.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.79 0.329 . . . . 0.0 111.132 -178.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 741' ' ' LYS . . . . . 0.511 ' O ' ' HE2' ' A' ' 784' ' ' LYS . 97.0 mttt -66.64 133.13 49.62 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 173.69 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 27.2 ptt? -88.26 -23.2 23.57 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 178.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -141.73 140.46 33.13 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.19 -179.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 744' ' ' LEU . . . . . 0.524 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 57.0 tp -118.76 103.65 9.85 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.353 177.437 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -87.69 109.22 19.53 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.855 179.295 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -77.01 148.3 78.41 Favored Pre-proline 0 C--N 1.321 -0.669 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.36 178.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -62.66 151.14 85.24 Favored 'Trans proline' 0 CA--C 1.529 0.263 0 C-N-CA 122.711 2.274 . . . . 0.0 112.237 179.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -65.76 -7.4 16.46 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.781 2.321 . . . . 0.0 112.619 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 41.6 t -68.63 -17.64 64.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.953 178.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.1 mp -66.07 110.69 3.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.919 173.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -82.08 -176.93 6.4 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 175.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 14.6 m -49.59 -48.56 48.75 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -174.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 753' ' ' HIS . . . . . 0.447 ' O ' ' HG2' ' A' ' 757' ' ' ARG . 37.4 t-80 -56.73 -46.84 81.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.508 178.099 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 754' ' ' ASP . . . . . 0.467 ' HB3' ' CZ ' ' A' ' 729' ' ' PHE . 58.9 m-20 -65.34 -46.63 79.48 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.803 -176.021 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 80.8 mtt180 -59.66 -45.64 91.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.672 177.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 756' ' ' LEU . . . . . 0.406 HD11 ' C ' ' A' ' 756' ' ' LEU . 3.2 tm? -54.75 -45.82 74.21 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.768 179.173 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 757' ' ' ARG . . . . . 0.447 ' HG2' ' O ' ' A' ' 753' ' ' HIS . 31.1 mmm180 -54.69 -50.34 68.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.213 -0.448 . . . . 0.0 109.868 177.332 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 758' ' ' VAL . . . . . 0.417 HG12 HD12 ' A' ' 733' ' ' ILE . 73.6 t -59.24 -48.0 88.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.01 178.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 88.4 m-70 -54.74 -58.83 5.97 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.444 -0.343 . . . . 0.0 110.87 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -60.05 -36.23 76.85 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -177.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 91.5 mt -70.78 -48.43 57.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 C-N-CA 121.123 -0.231 . . . . 0.0 111.133 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -65.45 -34.32 78.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.208 0.528 . . . . 0.0 110.273 179.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -63.5 -37.27 86.66 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.241 176.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -74.0 -39.44 63.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.557 178.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 10.4 m170 -69.7 -22.18 63.43 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.36 179.369 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 89.37 23.39 34.35 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.112 179.047 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 72.2 mt -93.26 -179.38 5.05 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 -179.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 61.2 ttp180 -104.68 127.97 52.6 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 177.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 5.5 p80 -135.27 130.0 34.46 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.024 0.44 . . . . 0.0 110.681 -176.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -149.08 155.67 41.08 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.276 -178.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 15.8 m . . . . . 0 C--N 1.32 -0.706 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.724 -177.315 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 40.7 p90 . . . . . 0 N--CA 1.45 -0.461 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 11.5 tt -125.41 135.02 65.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-O 121.076 0.465 . . . . 0.0 110.678 -178.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 25.0 m -119.3 120.64 37.56 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.406 -179.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 46.9 t -101.13 133.73 43.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.967 178.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 48.4 t -121.26 140.48 51.99 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 784' ' ' LYS . . . . . 0.511 ' HE2' ' O ' ' A' ' 741' ' ' LYS . 51.3 mtmt . . . . . 0 C--N 1.321 -0.636 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.614 -178.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 48.1 t60 . . . . . 0 CA--C 1.529 0.147 0 CA-C-O 120.89 0.376 . . . . 0.0 111.062 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 29.9 m-85 -72.9 -30.74 64.16 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.46 -175.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 16.6 tpp85 -61.63 -45.91 92.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.088 173.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -62.24 -46.72 87.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.95 179.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 22.7 mmm -62.11 -39.44 92.54 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.313 -179.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 733' ' ' ILE . . . . . 0.422 ' O ' ' HG3' ' A' ' 737' ' ' MET . 57.9 mt -75.84 -41.33 39.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -178.371 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 8.4 p -66.82 -34.08 67.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 C-N-CA 120.936 -0.305 . . . . 0.0 111.066 -177.605 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 61.7 mt-10 -76.97 -31.54 56.62 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.011 0.434 . . . . 0.0 110.087 175.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 736' ' ' PHE . . . . . 0.451 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 37.6 t80 -63.03 -37.29 86.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.522 178.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 737' ' ' MET . . . . . 0.422 ' HG3' ' O ' ' A' ' 733' ' ' ILE . 52.3 mtm -61.84 -26.51 68.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.944 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -101.65 4.08 40.44 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.122 0.486 . . . . 0.0 111.088 -178.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 40.2 t -88.99 166.63 13.78 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.974 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 30.2 mtpp -87.33 -10.37 52.4 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.861 0.362 . . . . 0.0 110.398 178.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 29.3 mtpp -67.6 124.46 23.32 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.269 177.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 22.9 ptp -75.37 -27.23 59.06 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.492 178.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -137.69 136.53 37.49 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.402 -178.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 744' ' ' LEU . . . . . 0.451 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 34.5 tp -106.89 104.99 14.8 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.19 -0.671 . . . . 0.0 109.19 176.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -87.76 104.6 16.71 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.979 -178.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -78.41 155.01 79.28 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.351 179.055 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_exo -70.04 152.69 67.96 Favored 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 122.358 2.039 . . . . 0.0 111.892 176.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -65.83 -4.53 10.13 Favored 'Trans proline' 0 CA--C 1.529 0.244 0 C-N-CA 122.897 2.398 . . . . 0.0 112.394 178.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 11.6 m -67.57 -18.35 64.98 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.065 177.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 11.0 mp -70.4 109.29 4.68 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.983 -0.376 . . . . 0.0 109.983 175.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -78.2 -178.03 5.43 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 -179.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 20.0 m -52.85 -41.05 63.91 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 111.64 0.237 . . . . 0.0 111.64 -178.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 65.5 m170 -68.93 -44.35 73.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.499 0.19 . . . . 0.0 110.97 179.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -58.28 -49.01 78.64 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.156 0.503 . . . . 0.0 110.143 177.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 755' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 755' ' ' ARG . 24.0 mtm180 -63.72 -43.3 96.96 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.833 -179.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 54.4 tp -54.91 -42.35 72.08 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.872 0.367 . . . . 0.0 111.024 179.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 757' ' ' ARG . . . . . 0.419 ' NE ' ' HA ' ' A' ' 757' ' ' ARG . 1.9 mmp_? -62.9 -47.07 84.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.519 176.233 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 758' ' ' VAL . . . . . 0.449 ' CG1' HD11 ' A' ' 780' ' ' ILE . 99.7 t -59.5 -48.05 88.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.895 179.341 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 88.6 m-70 -55.27 -55.41 31.68 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 120.843 0.354 . . . . 0.0 110.438 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -62.43 -38.61 90.4 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.962 -178.223 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 85.2 mt -67.43 -44.97 86.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 C-N-CA 121.144 -0.222 . . . . 0.0 111.081 178.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -65.9 -36.91 84.7 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.18 0.514 . . . . 0.0 110.353 178.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -67.07 -33.38 75.37 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.825 175.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -71.5 -40.18 70.34 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.593 178.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -71.86 -30.66 65.67 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.136 176.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 96.15 31.97 6.98 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.717 -0.754 . . . . 0.0 111.945 -179.12 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 61.5 mt -104.75 -178.96 3.81 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 50.6 ttt180 -100.6 142.85 31.5 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 177.276 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.7 p80 -149.17 141.64 24.29 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.861 0.362 . . . . 0.0 110.785 -178.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -160.14 152.42 20.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.696 179.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 6.4 m . . . . . 0 C--N 1.32 -0.686 0 CA-C-O 121.25 0.547 . . . . 0.0 110.904 -177.803 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 49.9 p90 . . . . . 0 N--CA 1.447 -0.578 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 780' ' ' ILE . . . . . 0.449 HD11 ' CG1' ' A' ' 758' ' ' VAL . 17.1 tt -118.04 140.12 42.58 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 C-N-CA 120.405 -0.518 . . . . 0.0 110.905 -179.02 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 25.1 m -121.64 117.98 28.05 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.883 -0.598 . . . . 0.0 109.944 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 22.1 t -100.95 133.95 42.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 179.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 20.0 p -124.09 143.09 50.66 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.391 0.615 . . . . 0.0 110.964 178.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 56.2 mtpt . . . . . 0 C--N 1.326 -0.455 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.421 -177.056 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 728' ' ' HIS . . . . . 0.517 ' O ' ' HG3' ' A' ' 732' ' ' MET . 14.0 t60 . . . . . 0 C--O 1.233 0.231 0 CA-C-O 121.094 0.473 . . . . 0.0 110.155 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -77.88 -29.9 50.53 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.857 -176.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 44.6 ttm-85 -66.06 -37.88 86.93 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 176.416 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -65.84 -41.34 91.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.397 176.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 732' ' ' MET . . . . . 0.517 ' HG3' ' O ' ' A' ' 728' ' ' HIS . 93.5 mtp -63.81 -42.47 97.68 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.428 178.356 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 59.5 mt -71.51 -42.25 72.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.172 -0.467 . . . . 0.0 112.023 -178.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 11.4 p -65.3 -41.31 91.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 C-N-CA 120.784 -0.366 . . . . 0.0 111.162 -176.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -70.85 -33.09 70.29 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.963 0.411 . . . . 0.0 110.291 176.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 736' ' ' PHE . . . . . 0.486 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 11.7 t80 -59.97 -36.99 78.32 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.013 176.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 737' ' ' MET . . . . . 0.581 ' HA ' ' HD3' ' A' ' 784' ' ' LYS . 69.9 mtm -64.16 -32.28 73.8 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.62 177.689 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -92.4 9.12 35.55 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.791 0.329 . . . . 0.0 111.1 178.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 55.7 m -101.02 167.37 10.29 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.762 0.315 . . . . 0.0 110.87 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 740' ' ' LYS . . . . . 0.468 ' HZ1' ' HB2' ' A' ' 740' ' ' LYS . 0.1 OUTLIER -73.9 -30.02 62.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.179 -179.241 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -58.38 127.9 34.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.768 178.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 69.9 mtm -95.93 -10.62 28.26 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.84 0.353 . . . . 0.0 110.626 178.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -139.67 126.85 21.17 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.063 174.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 744' ' ' LEU . . . . . 0.486 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 48.0 tp -102.1 105.69 16.45 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -87.25 105.68 17.39 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.744 178.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 746' ' ' PHE . . . . . 0.421 ' HA ' ' HD3' ' A' ' 747' ' ' PRO . 70.6 m-85 -76.04 146.07 78.27 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.821 -178.493 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 747' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 746' ' ' PHE . 33.1 Cg_exo -62.38 152.36 77.33 Favored 'Trans proline' 0 C--O 1.234 0.285 0 C-N-CA 122.971 2.448 . . . . 0.0 112.51 177.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -65.84 -3.93 9.08 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 123.143 2.562 . . . . 0.0 112.62 177.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 13.8 m -66.56 -25.16 66.51 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.721 176.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.1 mp -71.35 112.27 7.35 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.221 176.336 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 751' ' ' ASN . . . . . 0.432 ' O ' ' HG3' ' A' ' 755' ' ' ARG . 1.6 p-10 -86.31 -177.59 6.26 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 178.237 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 10.8 m -52.18 -45.46 65.13 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 112.592 0.589 . . . . 0.0 112.592 -170.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 33.2 m170 -66.7 -40.35 88.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.653 0.263 . . . . 0.0 111.62 -179.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -67.23 -41.56 85.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.926 0.393 . . . . 0.0 110.55 178.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 755' ' ' ARG . . . . . 0.432 ' HG3' ' O ' ' A' ' 751' ' ' ASN . 43.7 mtm-85 -64.35 -39.28 93.58 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.945 177.789 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 62.9 tp -54.34 -45.23 72.65 Favored 'General case' 0 C--N 1.332 -0.191 0 O-C-N 123.474 0.484 . . . . 0.0 110.855 176.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 7.7 mmt85 -55.41 -50.06 70.76 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.484 175.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 84.8 t -58.58 -48.32 85.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.02 179.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -56.28 -52.32 64.95 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.707 179.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -60.36 -41.7 94.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.753 -177.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 95.0 mt -68.82 -46.79 78.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.192 -179.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -63.54 -35.63 81.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.319 0.581 . . . . 0.0 110.021 178.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -63.5 -39.86 95.56 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.361 176.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -68.3 -44.75 74.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.839 178.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 27.1 m-70 -73.98 -21.44 60.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.61 -176.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 90.3 39.41 6.03 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.251 177.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 64.6 mt -111.12 169.62 8.65 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 178.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 37.3 ttm180 -90.05 132.08 35.58 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 177.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.8 p80 -138.82 136.63 35.83 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 120.726 0.298 . . . . 0.0 110.482 -177.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -162.4 147.67 12.53 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.523 177.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 771' ' ' SER . . . . . 0.444 ' HA ' ' HA ' ' A' ' 780' ' ' ILE . 9.7 m . . . . . 0 N--CA 1.445 -0.681 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.263 178.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 50.8 p90 . . . . . 0 N--CA 1.452 -0.357 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 780' ' ' ILE . . . . . 0.444 ' HA ' ' HA ' ' A' ' 771' ' ' SER . 11.9 tt -114.77 133.65 60.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-O 121.184 0.516 . . . . 0.0 111.039 -176.595 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 34.5 m -115.6 124.03 49.92 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.328 178.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 59.1 t -103.61 119.7 52.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.692 176.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 13.9 m -113.41 133.64 55.07 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 121.049 0.452 . . . . 0.0 111.011 -176.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 784' ' ' LYS . . . . . 0.581 ' HD3' ' HA ' ' A' ' 737' ' ' MET . 56.8 mtmt . . . . . 0 C--N 1.325 -0.484 0 CA-C-O 121.83 0.824 . . . . 0.0 110.354 177.173 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 46.0 t60 . . . . . 0 N--CA 1.461 0.113 0 CA-C-O 121.294 0.569 . . . . 0.0 109.532 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -72.06 -26.09 62.04 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.261 -177.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -65.77 -42.66 90.58 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 176.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -68.17 -46.05 71.77 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.629 177.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 35.5 mmm -56.96 -45.12 83.07 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.285 178.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 38.7 mt -67.28 -44.69 87.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.891 -177.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 12.4 p -66.75 -36.12 76.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 C-N-CA 120.298 -0.561 . . . . 0.0 111.015 -177.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -71.88 -28.22 63.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.148 0.499 . . . . 0.0 110.402 176.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 736' ' ' PHE . . . . . 0.416 ' CE2' ' HG3' ' A' ' 784' ' ' LYS . 23.4 t80 -71.18 -40.55 71.19 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.287 174.398 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 87.2 mtp -62.37 -41.68 98.81 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.099 179.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -80.88 -6.05 58.15 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.278 -179.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 14.7 t -92.91 167.33 11.9 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.593 -177.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -75.47 -9.68 58.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.817 178.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 741' ' ' LYS . . . . . 0.449 ' O ' ' HD3' ' A' ' 784' ' ' LYS . 61.9 mttp -61.35 133.6 56.01 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.538 -178.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 62.7 mtt -99.94 -17.36 17.6 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.076 177.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -144.71 140.53 28.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.155 175.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 744' ' ' LEU . . . . . 0.496 HD13 ' CZ ' ' A' ' 746' ' ' PHE . 0.8 OUTLIER -113.65 108.43 17.12 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 -179.935 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -85.63 96.35 9.64 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.439 176.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 746' ' ' PHE . . . . . 0.496 ' CZ ' HD13 ' A' ' 744' ' ' LEU . 61.1 m-85 -71.12 146.84 93.08 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.28 177.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -65.92 150.89 85.35 Favored 'Trans proline' 0 CA--C 1.529 0.247 0 C-N-CA 122.637 2.224 . . . . 0.0 112.509 -179.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -63.74 -6.22 10.33 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.845 2.363 . . . . 0.0 112.362 175.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 34.4 t -61.4 -25.18 67.02 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.077 174.155 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.1 mp -65.2 109.44 2.21 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.816 176.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -80.06 -177.37 6.0 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 173.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 20.0 m -57.68 -43.71 85.25 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -171.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 35.0 m80 -63.92 -39.82 95.04 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 120.954 0.406 . . . . 0.0 110.774 179.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -63.03 -49.03 76.2 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.706 178.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 63.8 mtt85 -57.6 -49.29 76.89 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.549 177.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 756' ' ' LEU . . . . . 0.407 ' HG ' ' NE2' ' A' ' 760' ' ' GLN . 60.5 tp -54.72 -39.73 68.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.303 -179.009 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 23.8 tpt180 -65.04 -39.19 92.99 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.055 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 96.3 t -64.4 -50.98 73.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.752 176.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -53.8 -48.81 69.48 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 123.453 0.47 . . . . 0.0 110.243 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 760' ' ' GLN . . . . . 0.407 ' NE2' ' HG ' ' A' ' 756' ' ' LEU . 69.9 mt-30 -50.96 -51.27 54.19 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.888 176.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 88.5 mt -69.98 -42.33 79.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.439 -174.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -66.21 -38.16 87.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.075 0.464 . . . . 0.0 110.453 179.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -67.05 -36.64 82.5 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.127 177.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -65.76 -49.28 68.93 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.533 176.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 13.8 m170 -69.8 -29.42 66.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.636 -175.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 100.67 36.14 4.11 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.457 -0.877 . . . . 0.0 112.451 177.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 63.9 mt -111.85 170.64 8.01 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 32.5 ttp180 -89.89 136.52 32.99 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 178.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 5.5 p80 -137.45 121.95 18.39 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-O 121.464 0.65 . . . . 0.0 110.499 -179.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -144.1 153.76 42.49 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.239 -0.892 . . . . 0.0 109.971 -178.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 10.7 m . . . . . 0 C--N 1.319 -0.747 0 CA-C-O 121.041 0.448 . . . . 0.0 110.57 -179.1 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 44.1 p90 . . . . . 0 N--CA 1.448 -0.545 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 12.8 tt -104.09 133.82 47.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-O 121.163 0.506 . . . . 0.0 110.562 -178.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 781' ' ' THR . . . . . 0.448 ' HA ' ' O ' ' A' ' 744' ' ' LEU . 17.7 m -118.1 112.55 20.36 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.263 179.687 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 45.3 t -90.91 130.51 39.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 177.076 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 12.8 t -125.3 141.54 52.02 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.444 0.64 . . . . 0.0 111.492 -175.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 784' ' ' LYS . . . . . 0.449 ' HD3' ' O ' ' A' ' 741' ' ' LYS . 55.4 mtpt . . . . . 0 CA--C 1.511 -0.523 0 CA-C-O 122.392 1.092 . . . . 0.0 108.7 175.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 27.4 t60 . . . . . 0 N--CA 1.453 -0.289 0 CA-C-O 120.778 0.323 . . . . 0.0 110.641 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -70.04 -32.03 69.96 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.209 -173.389 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 -58.62 -49.7 76.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.141 0.496 . . . . 0.0 109.828 174.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -61.62 -48.58 80.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.805 178.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 46.8 mmm -56.38 -39.79 73.53 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.599 -179.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 43.0 mt -70.72 -49.15 53.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 12.9 p -65.52 -36.36 77.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 C-N-CA 120.732 -0.387 . . . . 0.0 111.08 -176.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -71.65 -32.29 67.75 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 121.089 0.471 . . . . 0.0 110.423 177.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 736' ' ' PHE . . . . . 0.565 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 24.4 t80 -65.59 -36.54 84.06 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.518 175.596 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 737' ' ' MET . . . . . 0.478 ' HA ' ' HD3' ' A' ' 784' ' ' LYS . 84.9 mtp -65.83 -27.1 68.0 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.331 176.633 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -91.71 -0.62 57.57 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.743 178.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 24.3 t -97.0 168.15 10.64 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.584 -178.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 740' ' ' LYS . . . . . 0.548 ' HA ' ' HE2' ' A' ' 740' ' ' LYS . 11.0 mmpt? -84.6 -11.59 55.71 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.186 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 741' ' ' LYS . . . . . 0.468 ' O ' ' HE2' ' A' ' 784' ' ' LYS . 59.9 mttp -67.31 129.57 40.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.112 177.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 70.2 mtm -91.09 -17.83 25.55 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.648 177.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -136.13 130.06 32.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.605 179.121 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 744' ' ' LEU . . . . . 0.565 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 45.8 tp -112.95 109.0 18.14 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.786 177.581 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -94.36 110.14 21.93 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.158 -178.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 746' ' ' PHE . . . . . 0.5 ' O ' ' HB2' ' A' ' 779' ' ' PHE . 72.2 m-85 -80.53 156.56 73.23 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.158 -178.444 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 747' ' ' PRO . . . . . 0.424 ' O ' HD11 ' A' ' 750' ' ' LEU . 40.2 Cg_exo -58.9 156.33 33.9 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.966 2.444 . . . . 0.0 112.565 177.353 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -74.19 -11.76 23.15 Favored 'Trans proline' 0 CA--C 1.53 0.295 0 C-N-CA 122.764 2.309 . . . . 0.0 112.77 178.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 17.6 m -71.59 -12.61 61.44 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.989 -0.55 . . . . 0.0 112.354 -176.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 750' ' ' LEU . . . . . 0.424 HD11 ' O ' ' A' ' 747' ' ' PRO . 11.2 mp -61.22 121.53 12.79 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 110.416 -0.216 . . . . 0.0 110.416 176.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 751' ' ' ASN . . . . . 0.562 ' O ' ' HG2' ' A' ' 755' ' ' ARG . 2.0 p30 -80.38 176.92 9.35 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 179.495 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 14.4 t -53.6 -37.26 62.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.913 0.387 . . . . 0.0 111.352 -177.04 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 73.8 m80 -76.07 -27.87 57.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.976 -179.227 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -72.25 -40.37 67.73 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 175.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 755' ' ' ARG . . . . . 0.562 ' HG2' ' O ' ' A' ' 751' ' ' ASN . 33.1 mmt180 -56.69 -58.58 7.45 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.51 175.181 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 62.0 tp -54.16 -38.63 65.74 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 114.871 -1.059 . . . . 0.0 111.045 -178.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 26.5 tpt180 -57.45 -48.53 78.9 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 120.996 0.427 . . . . 0.0 110.187 178.034 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 79.8 t -65.79 -46.54 88.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.838 179.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -56.05 -50.89 69.71 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.903 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -55.52 -47.98 75.39 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.407 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 96.6 mt -67.58 -49.1 73.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.523 -176.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -63.34 -30.77 71.84 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.224 0.535 . . . . 0.0 110.67 -178.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -70.71 -37.75 73.59 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.768 177.273 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -68.57 -36.99 79.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.361 0.6 . . . . 0.0 110.243 178.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 12.0 m170 -74.89 -23.12 58.33 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.438 177.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 84.68 44.4 6.46 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.936 -0.65 . . . . 0.0 112.272 178.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 82.0 mt -111.86 177.63 4.58 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 178.093 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 75.4 ttt180 -96.72 133.47 41.22 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 5.7 p80 -145.92 133.39 20.8 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.079 0.466 . . . . 0.0 111.555 -176.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -170.56 164.59 8.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.215 -0.902 . . . . 0.0 108.976 176.184 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 771' ' ' SER . . . . . 0.469 ' HA ' ' HA ' ' A' ' 780' ' ' ILE . 14.3 m . . . . . 0 C--N 1.32 -0.704 0 CA-C-O 121.357 0.599 . . . . 0.0 112.035 -173.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 779' ' ' PHE . . . . . 0.5 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 37.7 p90 . . . . . 0 N--CA 1.451 -0.409 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 780' ' ' ILE . . . . . 0.469 ' HA ' ' HA ' ' A' ' 771' ' ' SER . 10.8 tt -83.93 135.33 25.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 121.201 0.525 . . . . 0.0 110.826 -176.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 35.2 m -120.38 119.82 34.2 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.479 -179.27 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 43.1 t -95.97 125.12 48.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.322 176.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 34.3 t -119.29 130.27 55.32 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.322 0.582 . . . . 0.0 110.789 -176.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 784' ' ' LYS . . . . . 0.478 ' HD3' ' HA ' ' A' ' 737' ' ' MET . 48.0 mtmt . . . . . 0 C--N 1.32 -0.679 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 172.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 29.9 t60 . . . . . 0 N--CA 1.463 0.207 0 CA-C-O 121.485 0.66 . . . . 0.0 109.391 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 44.7 m-85 -75.15 -26.76 59.38 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.692 -176.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 23.6 ttt180 -71.22 -36.59 71.91 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 178.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -66.39 -42.66 87.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.177 175.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 12.3 mmm -62.0 -40.91 97.28 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.131 176.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 733' ' ' ILE . . . . . 0.454 ' O ' ' HG3' ' A' ' 737' ' ' MET . 49.3 mt -69.22 -44.11 80.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.684 -179.149 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 11.4 p -63.99 -37.01 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 C-N-CA 120.564 -0.454 . . . . 0.0 110.994 -177.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -74.62 -27.26 60.38 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.05 0.452 . . . . 0.0 110.472 176.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 736' ' ' PHE . . . . . 0.544 ' CE1' ' HB2' ' A' ' 744' ' ' LEU . 26.9 t80 -69.36 -35.89 76.31 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.531 175.135 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 737' ' ' MET . . . . . 0.454 ' HG3' ' O ' ' A' ' 733' ' ' ILE . 86.2 mtp -64.27 -39.72 94.5 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.58 178.018 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -78.97 -23.49 44.48 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.54 178.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 33.1 t -73.54 164.13 27.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.465 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 45.2 mtmt -78.54 -22.38 47.33 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.621 -177.023 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 56.1 mtmt -55.43 128.32 33.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.658 -175.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 27.0 ptm -86.66 -18.96 29.98 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.898 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 19.8 mm-40 -135.71 139.01 43.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.313 178.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 744' ' ' LEU . . . . . 0.544 ' HB2' ' CE1' ' A' ' 736' ' ' PHE . 37.3 tp -118.44 108.67 15.31 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 176.479 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -92.27 112.15 23.98 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.049 -178.144 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -88.34 145.15 35.14 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.568 178.044 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_exo -65.0 152.53 82.08 Favored 'Trans proline' 0 N--CA 1.463 -0.313 0 C-N-CA 122.638 2.225 . . . . 0.0 112.037 177.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -68.68 -7.32 20.15 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 123.126 2.55 . . . . 0.0 111.462 177.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 5.6 m -59.61 -21.4 60.35 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.685 173.013 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.8 mp -73.34 115.4 12.65 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.865 173.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 10.9 p30 -82.7 -178.56 7.13 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 178.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 65.1 m -58.81 -29.0 66.53 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -175.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 54.2 t-80 -71.52 -45.04 63.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.894 0.378 . . . . 0.0 110.087 177.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -61.49 -51.09 70.09 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.036 178.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 22.3 mtm180 -57.96 -43.58 86.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.806 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 51.5 tp -55.45 -41.96 73.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.466 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 19.0 mmm180 -63.77 -47.43 81.0 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.998 -0.281 . . . . 0.0 110.465 176.088 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 61.9 t -56.48 -46.31 82.21 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.97 179.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 87.3 m-70 -56.7 -53.68 54.91 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.648 178.024 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -59.44 -40.42 86.76 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.69 -178.045 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 95.6 mt -65.29 -53.78 36.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.106 -179.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -62.0 -36.82 82.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.176 0.512 . . . . 0.0 110.597 -179.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -64.84 -31.58 72.88 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.915 177.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -81.86 -36.75 27.9 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.66 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 11.3 m170 -74.57 -23.01 58.7 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.215 179.436 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 95.85 31.09 7.55 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.577 -0.82 . . . . 0.0 112.52 177.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 66.3 mt -108.65 -176.56 3.08 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 110.267 -0.272 . . . . 0.0 110.267 -178.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 768' ' ' ARG . . . . . 0.41 ' HB3' ' HB3' ' A' ' 783' ' ' SER . 17.4 ttm180 -100.95 135.62 42.11 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.439 177.797 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 7.2 p80 -144.65 135.3 24.66 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.936 -178.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -164.54 150.09 10.24 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.48 177.444 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 771' ' ' SER . . . . . 0.405 ' HA ' ' HA ' ' A' ' 780' ' ' ILE . 3.8 m . . . . . 0 N--CA 1.446 -0.644 0 CA-C-O 120.932 0.396 . . . . 0.0 110.297 179.112 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 38.8 p90 . . . . . 0 N--CA 1.452 -0.359 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 780' ' ' ILE . . . . . 0.405 ' HA ' ' HA ' ' A' ' 771' ' ' SER . 13.3 tt -107.17 134.03 50.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-O 121.057 0.456 . . . . 0.0 111.147 -175.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 5.7 m -118.36 124.25 47.28 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.023 178.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 43.3 t -107.28 127.0 63.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.767 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 783' ' ' SER . . . . . 0.41 ' HB3' ' HB3' ' A' ' 768' ' ' ARG . 22.8 t -112.47 147.16 37.1 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 120.821 0.344 . . . . 0.0 110.493 -178.716 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 17.7 mtmm . . . . . 0 C--N 1.325 -0.472 0 CA-C-O 121.421 0.629 . . . . 0.0 110.073 173.537 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 18.1 t60 . . . . . 0 C--O 1.233 0.228 0 CA-C-O 120.727 0.298 . . . . 0.0 111.289 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -75.07 -36.85 61.76 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.462 -176.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 27.7 ttm-85 -61.8 -42.36 98.91 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.765 0.316 . . . . 0.0 110.383 175.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -60.44 -45.73 92.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.815 179.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 31.8 mtm -68.52 -33.32 73.92 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.236 -179.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 733' ' ' ILE . . . . . 0.54 ' O ' ' HG3' ' A' ' 737' ' ' MET . 58.3 mt -70.34 -49.31 54.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 N-CA-C 111.339 0.126 . . . . 0.0 111.339 178.499 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 13.0 p -62.86 -34.65 67.22 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 120.801 -0.36 . . . . 0.0 110.829 -177.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -70.6 -41.61 72.06 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.021 0.439 . . . . 0.0 110.142 175.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 736' ' ' PHE . . . . . 0.505 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 44.1 t80 -57.59 -35.47 70.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.33 177.777 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 737' ' ' MET . . . . . 0.54 ' HG3' ' O ' ' A' ' 733' ' ' ILE . 87.6 mtp -61.34 -32.89 72.78 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.824 178.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -96.01 -7.18 37.04 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.278 -179.457 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 64.3 m -82.78 168.47 17.14 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.082 -177.635 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 740' ' ' LYS . . . . . 0.507 ' HB2' ' HZ3' ' A' ' 740' ' ' LYS . 4.4 ttmp? -81.29 -21.85 39.04 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.435 -178.69 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -62.83 127.9 33.41 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.668 179.294 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 25.6 ptt? -88.86 -17.22 30.11 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.617 178.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 28.2 mt-30 -139.05 119.65 14.03 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.139 -178.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 744' ' ' LEU . . . . . 0.505 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 49.1 tp -101.03 105.24 16.43 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.334 176.334 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -89.67 115.89 27.38 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.305 -179.204 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 746' ' ' PHE . . . . . 0.446 ' O ' ' HB2' ' A' ' 779' ' ' PHE . 58.5 m-85 -88.27 145.6 36.22 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.934 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -58.28 153.79 44.6 Favored 'Trans proline' 0 CA--C 1.533 0.441 0 C-N-CA 123.178 2.585 . . . . 0.0 112.771 178.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -69.61 -9.37 26.0 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.922 2.415 . . . . 0.0 112.936 -179.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 2.3 p -69.24 -24.07 63.95 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.878 -178.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.8 mp -55.7 117.49 3.68 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.256 175.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -76.68 174.73 10.08 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 13.7 t -55.35 -32.53 62.63 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.649 0.24 . . . . 0.0 111.649 -175.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 40.2 m80 -79.43 -31.86 42.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.456 0.17 . . . . 0.0 110.962 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -66.32 -45.37 80.52 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 174.447 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 63.3 mtt-85 -62.6 -47.42 83.88 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.733 177.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 62.5 tp -55.04 -40.6 70.41 Favored 'General case' 0 N--CA 1.464 0.272 0 O-C-N 123.346 0.404 . . . . 0.0 110.877 179.103 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 27.9 tpt180 -56.87 -51.0 70.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.915 176.011 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 99.1 t -60.51 -49.67 83.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.258 178.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 -53.79 -51.2 64.22 Favored 'General case' 0 N--CA 1.463 0.192 0 O-C-N 123.302 0.376 . . . . 0.0 110.635 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -60.59 -44.19 96.52 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -178.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 98.1 mt -66.3 -49.31 76.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.756 0.313 . . . . 0.0 110.963 -177.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -64.32 -32.74 74.47 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.945 0.402 . . . . 0.0 110.59 -179.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -66.01 -37.03 84.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.407 178.612 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 13.7 tp10 -75.0 -43.26 54.88 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.676 177.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 10.6 m-70 -69.22 -24.89 64.08 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.434 -176.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 99.45 29.91 6.82 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.496 -0.859 . . . . 0.0 113.14 174.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 54.3 mt -107.59 170.76 7.78 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 176.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 30.5 ttt180 -96.55 139.89 31.97 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 119.616 -0.834 . . . . 0.0 109.745 175.143 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.5 p80 -137.19 131.71 32.87 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.428 -0.806 . . . . 0.0 109.837 -176.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -159.62 144.91 15.56 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.306 -179.379 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 771' ' ' SER . . . . . 0.426 ' HA ' ' HA ' ' A' ' 780' ' ' ILE . 8.8 t . . . . . 0 N--CA 1.448 -0.569 0 CA-C-O 121.45 0.643 . . . . 0.0 110.084 178.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 779' ' ' PHE . . . . . 0.446 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 14.3 p90 . . . . . 0 N--CA 1.452 -0.352 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 780' ' ' ILE . . . . . 0.426 ' HA ' ' HA ' ' A' ' 771' ' ' SER . 6.2 tt -103.9 130.17 54.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-O 121.138 0.494 . . . . 0.0 110.107 179.079 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 27.1 m -111.13 120.36 42.04 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.449 -179.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 55.8 t -96.42 118.68 43.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 173.066 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 53.9 p -113.61 137.81 51.07 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.458 -177.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 59.0 mtpt . . . . . 0 C--N 1.321 -0.633 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 172.68 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 9.7 t60 . . . . . 0 N--CA 1.46 0.064 0 CA-C-O 121.076 0.465 . . . . 0.0 110.792 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 40.6 m-85 -75.56 -31.3 59.98 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.371 -172.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 40.0 ttt-85 -59.77 -45.7 91.45 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.18 174.236 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -61.12 -42.53 98.7 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.536 -179.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 32.8 mmm -62.54 -39.09 92.49 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.925 178.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 733' ' ' ILE . . . . . 0.498 ' O ' ' HB3' ' A' ' 736' ' ' PHE . 68.1 mt -77.76 -39.57 26.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -177.678 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 10.8 p -65.16 -37.69 80.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.817 -178.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -78.19 -29.35 48.43 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 120.811 -0.355 . . . . 0.0 110.37 176.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 736' ' ' PHE . . . . . 0.529 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 29.2 t80 -52.88 -44.79 67.11 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.873 175.281 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 71.1 mtm -67.13 -23.21 65.78 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.732 -179.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -97.09 -9.63 27.63 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.696 0.284 . . . . 0.0 111.529 -178.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 50.7 m -90.01 2.55 55.04 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.604 -177.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 740' ' ' LYS . . . . . 0.441 ' HG2' ' O ' ' A' ' 740' ' ' LYS . 61.5 tttp 65.4 9.76 6.0 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.257 0.551 . . . . 0.0 111.03 -179.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 62.4 mttm -68.27 129.78 40.95 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.625 179.118 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 742' ' ' MET . . . . . 0.411 ' SD ' ' N ' ' A' ' 742' ' ' MET . 0.0 OUTLIER -78.08 -25.47 47.65 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.064 177.49 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -155.34 148.8 25.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.314 177.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 744' ' ' LEU . . . . . 0.529 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 59.0 tp -124.81 108.27 11.78 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.777 178.642 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -80.78 114.55 19.74 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.91 179.536 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 746' ' ' PHE . . . . . 0.405 ' HB2' HG23 ' A' ' 780' ' ' ILE . 68.1 m-85 -90.93 154.78 45.38 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.354 177.853 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 747' ' ' PRO . . . . . 0.405 ' O ' HD11 ' A' ' 750' ' ' LEU . 33.8 Cg_exo -59.17 155.36 40.31 Favored 'Trans proline' 0 CA--C 1.533 0.466 0 C-N-CA 122.666 2.244 . . . . 0.0 112.294 176.304 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -75.6 -14.46 19.87 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.653 2.236 . . . . 0.0 112.169 -179.366 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 7.8 p -71.75 -11.08 60.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.594 -175.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 750' ' ' LEU . . . . . 0.405 HD11 ' O ' ' A' ' 747' ' ' PRO . 11.1 mp -58.59 113.67 2.12 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 174.091 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 751' ' ' ASN . . . . . 0.569 ' O ' ' HG2' ' A' ' 755' ' ' ARG . 3.1 p30 -75.13 178.94 5.34 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 110.345 -0.243 . . . . 0.0 110.345 -175.325 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 30.2 m -51.76 -42.44 62.37 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 120.606 0.241 . . . . 0.0 111.522 -176.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 70.1 m80 -70.24 -36.98 74.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.106 -179.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 754' ' ' ASP . . . . . 0.409 ' O ' HG21 ' A' ' 758' ' ' VAL . 73.7 m-20 -64.38 -49.47 71.48 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 177.121 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 755' ' ' ARG . . . . . 0.569 ' HG2' ' O ' ' A' ' 751' ' ' ASN . 1.4 mmm-85 -54.36 -57.49 11.08 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.648 178.615 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 66.7 tp -52.29 -41.89 63.28 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 114.978 -1.01 . . . . 0.0 111.901 -178.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -63.09 -45.41 92.21 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 121.195 -0.202 . . . . 0.0 110.73 178.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 758' ' ' VAL . . . . . 0.409 HG21 ' O ' ' A' ' 754' ' ' ASP . 93.4 t -60.69 -47.16 94.24 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.728 178.234 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -56.79 -51.48 68.79 Favored 'General case' 0 N--CA 1.462 0.139 0 O-C-N 123.339 0.399 . . . . 0.0 110.206 178.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -54.96 -47.62 74.28 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.671 179.419 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 97.3 mt -63.55 -55.4 23.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.119 -178.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -60.24 -35.13 74.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.968 0.413 . . . . 0.0 110.88 -177.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -66.69 -38.16 86.2 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.144 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -77.22 -36.46 54.68 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.586 0.232 . . . . 0.0 110.448 179.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 9.8 m-70 -65.31 -23.48 67.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.959 0.409 . . . . 0.0 110.709 176.24 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 89.25 35.75 7.91 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.108 177.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 62.9 mt -114.0 177.16 4.74 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.275 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 22.5 ttp180 -95.56 143.92 26.46 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 178.416 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 5.3 p80 -140.32 122.47 15.78 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.092 0.472 . . . . 0.0 110.276 -178.244 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -134.83 155.19 51.07 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.926 -174.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 10.0 m . . . . . 0 C--N 1.313 -0.987 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 172.123 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 11.1 p90 . . . . . 0 C--O 1.234 0.262 0 N-CA-C 109.986 -0.375 . . . . 0.0 109.986 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 780' ' ' ILE . . . . . 0.405 HG23 ' HB2' ' A' ' 746' ' ' PHE . 6.5 tt -126.32 140.26 49.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 120.906 0.384 . . . . 0.0 110.265 177.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 26.3 m -128.23 117.98 22.49 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.656 -179.008 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 49.5 t -86.72 127.86 40.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 174.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 26.2 m -127.83 139.68 52.49 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.345 0.593 . . . . 0.0 112.059 -173.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 10.0 mtpm? . . . . . 0 C--N 1.326 -0.447 0 CA-C-O 121.93 0.871 . . . . 0.0 109.092 172.205 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 23.1 t60 . . . . . 0 C--O 1.234 0.25 0 CA-C-O 121.089 0.471 . . . . 0.0 111.392 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -82.41 -37.55 25.37 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.738 -174.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 17.1 tpt180 -55.76 -44.58 77.79 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.975 0.417 . . . . 0.0 109.96 175.721 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 731' ' ' ALA . . . . . 0.438 ' O ' ' HG3' ' A' ' 735' ' ' GLU . . . -63.43 -52.08 63.02 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.872 179.72 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 31.6 mtm -63.63 -33.49 75.74 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.757 -177.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 81.2 mt -72.74 -43.13 61.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 11.9 p -67.98 -36.55 75.96 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.339 -179.204 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 735' ' ' GLU . . . . . 0.438 ' HG3' ' O ' ' A' ' 731' ' ' ALA . 52.4 mt-10 -68.83 -35.84 77.47 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.077 0.465 . . . . 0.0 109.768 175.376 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 736' ' ' PHE . . . . . 0.4 ' CE2' ' HG3' ' A' ' 784' ' ' LYS . 26.8 t80 -61.69 -38.23 87.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.39 178.591 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 737' ' ' MET . . . . . 0.517 ' HA ' ' HD3' ' A' ' 784' ' ' LYS . 42.0 mtm -62.29 -40.23 95.58 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 121.077 -0.249 . . . . 0.0 111.028 179.563 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -81.49 -17.98 46.75 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.948 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 32.7 t -74.08 160.77 30.8 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.905 -178.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 740' ' ' LYS . . . . . 0.499 ' H ' ' HD2' ' A' ' 740' ' ' LYS . 0.0 OUTLIER -77.43 -12.2 59.93 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.819 -178.944 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -67.24 133.29 49.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.154 -0.475 . . . . 0.0 109.859 177.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 59.2 mtt -95.76 -20.56 18.77 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.04 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -133.31 124.53 27.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.854 179.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 744' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -93.34 97.53 10.65 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 176.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -84.3 101.35 11.87 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.166 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -79.66 154.02 75.94 Favored Pre-proline 0 C--N 1.321 -0.645 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.58 179.29 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -75.27 160.16 39.59 Favored 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 122.759 2.306 . . . . 0.0 111.602 175.049 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -68.14 -4.35 12.46 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.796 2.331 . . . . 0.0 112.612 177.033 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 12.2 p -63.9 -27.13 68.94 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.553 179.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.2 mp -63.22 115.34 4.43 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.466 -0.333 . . . . 0.0 110.552 176.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 751' ' ' ASN . . . . . 0.415 ' O ' ' HG3' ' A' ' 755' ' ' ARG . 2.6 p-10 -91.86 -170.04 2.45 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 174.577 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 12.8 p -46.19 -61.81 1.61 Allowed 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -173.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -55.53 -43.74 76.05 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.412 -178.006 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -62.94 -47.35 83.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.991 -178.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 755' ' ' ARG . . . . . 0.415 ' HG3' ' O ' ' A' ' 751' ' ' ASN . 82.8 mtt180 -60.89 -48.22 82.8 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.798 177.345 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 65.3 tp -54.26 -40.98 68.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.059 -179.065 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 9.9 mmt180 -59.02 -48.76 80.41 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.448 175.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 59.3 t -62.27 -48.42 88.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.059 -179.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -57.0 -49.67 75.06 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 110.442 -0.207 . . . . 0.0 110.442 179.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 67.0 mt-30 -56.21 -50.37 71.44 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.599 179.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 95.5 mt -67.32 -46.23 84.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.542 -176.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -62.53 -39.59 94.09 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.838 0.351 . . . . 0.0 110.421 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -65.75 -33.87 76.87 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.58 177.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -73.89 -35.23 64.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.513 178.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 11.3 m170 -79.08 -11.77 60.0 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.389 179.416 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 81.92 21.68 60.89 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.482 179.382 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 71.8 mt -95.06 172.68 7.99 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 -179.183 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 58.0 ttt180 -96.15 132.71 41.27 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.891 0.377 . . . . 0.0 110.226 178.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -133.6 124.62 27.16 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 121.293 0.568 . . . . 0.0 110.537 178.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -145.25 145.24 31.21 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.424 -177.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 14.3 m . . . . . 0 C--N 1.316 -0.849 0 C-N-CA 120.843 -0.343 . . . . 0.0 111.005 -176.938 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 48.0 p90 . . . . . 0 N--CA 1.45 -0.462 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 9.3 tt -102.74 136.76 33.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.587 -177.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 18.6 m -120.75 116.04 24.47 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.58 -178.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 47.2 t -92.28 117.03 34.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.841 177.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 34.3 t -111.6 127.79 55.85 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.108 0.48 . . . . 0.0 110.43 -178.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 784' ' ' LYS . . . . . 0.517 ' HD3' ' HA ' ' A' ' 737' ' ' MET . 52.4 mtmt . . . . . 0 C--N 1.321 -0.669 0 CA-C-O 121.486 0.66 . . . . 0.0 109.222 174.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 728' ' ' HIS . . . . . 0.438 ' O ' ' HG2' ' A' ' 732' ' ' MET . 22.3 t60 . . . . . 0 C--O 1.227 -0.09 0 CA-C-O 120.561 0.219 . . . . 0.0 111.161 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -70.75 -39.63 73.15 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.101 -174.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 730' ' ' ARG . . . . . 0.421 HH11 ' HD3' ' A' ' 730' ' ' ARG . 26.8 ttt180 -55.71 -40.45 72.43 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.215 0.531 . . . . 0.0 110.059 176.188 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 731' ' ' ALA . . . . . 0.501 ' O ' HG12 ' A' ' 734' ' ' VAL . . . -71.82 -42.57 66.86 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.96 179.05 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 732' ' ' MET . . . . . 0.438 ' HG2' ' O ' ' A' ' 728' ' ' HIS . 44.8 mmm -60.65 -37.49 81.69 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.767 0.318 . . . . 0.0 110.895 178.638 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 70.8 mt -71.02 -41.0 76.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.528 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 734' ' ' VAL . . . . . 0.501 HG12 ' O ' ' A' ' 731' ' ' ALA . 10.0 p -67.66 -34.32 67.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.664 -179.167 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 735' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' A' ' 731' ' ' ALA . 51.9 mt-10 -63.08 -45.56 91.57 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-O 121.349 0.595 . . . . 0.0 109.543 173.436 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 736' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -57.41 -44.52 84.67 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.849 -1.069 . . . . 0.0 111.535 -179.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 45.8 mtm -69.15 -34.34 74.85 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.035 -179.345 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -78.04 -28.64 49.07 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.902 0.382 . . . . 0.0 111.224 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 25.2 t -80.69 -172.04 3.43 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.496 -179.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 740' ' ' LYS . . . . . 0.577 ' H ' ' HD2' ' A' ' 740' ' ' LYS . 0.0 OUTLIER -110.53 12.46 22.83 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.154 0.502 . . . . 0.0 110.848 -175.094 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -71.75 142.09 49.76 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.368 -0.605 . . . . 0.0 109.368 172.12 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 742' ' ' MET . . . . . 0.482 ' O ' ' HA ' ' A' ' 783' ' ' SER . 17.6 ptp -104.12 -14.91 15.71 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.468 177.454 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -140.7 116.34 10.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.662 179.122 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 744' ' ' LEU . . . . . 0.435 HD12 ' CZ ' ' A' ' 746' ' ' PHE . 1.4 tt -89.63 103.55 16.18 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 177.646 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -88.27 99.07 11.95 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.646 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 746' ' ' PHE . . . . . 0.435 ' CZ ' HD12 ' A' ' 744' ' ' LEU . 71.6 m-85 -77.03 153.35 82.64 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.352 178.674 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_exo -66.23 156.32 65.51 Favored 'Trans proline' 0 CA--C 1.532 0.422 0 C-N-CA 122.8 2.333 . . . . 0.0 112.13 176.045 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -71.41 -5.24 16.61 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.928 2.419 . . . . 0.0 112.665 177.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 23.6 p -65.01 -25.23 67.77 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.156 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.9 mp -60.17 118.12 5.97 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.577 177.441 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -90.12 -176.53 4.89 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.075 176.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 17.4 m -48.29 -53.99 15.31 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 113.237 0.828 . . . . 0.0 113.237 -171.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -68.0 -37.86 81.97 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.693 0.282 . . . . 0.0 110.956 -175.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -65.16 -45.58 84.37 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.781 0.324 . . . . 0.0 110.405 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 78.2 mtt180 -58.53 -48.62 80.24 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 174.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 56.9 tp -53.68 -43.32 68.81 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.61 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -60.53 -41.73 95.02 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.293 -0.412 . . . . 0.0 109.963 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 91.7 t -64.18 -48.27 86.38 Favored 'Isoleucine or valine' 0 C--O 1.232 0.175 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.067 176.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -55.08 -48.35 73.64 Favored 'General case' 0 N--CA 1.464 0.236 0 O-C-N 123.255 0.347 . . . . 0.0 111.056 -179.737 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -58.98 -48.58 81.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.692 -179.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 98.5 mt -65.65 -49.17 79.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.987 -177.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -60.96 -41.41 96.27 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 120.912 0.387 . . . . 0.0 110.841 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -63.28 -39.68 95.27 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.033 -179.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -74.62 -36.79 62.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.807 0.337 . . . . 0.0 110.765 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 11.8 m170 -65.79 -25.06 67.08 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.908 177.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 100.15 14.62 32.94 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.384 177.408 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 39.7 mt -94.52 169.61 10.07 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 -179.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 59.8 ttt180 -100.73 152.3 20.64 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 179.228 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 5.8 p80 -153.14 142.82 21.94 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.736 0.303 . . . . 0.0 110.803 -176.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -142.21 160.9 39.33 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.204 178.136 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 4.4 m . . . . . 0 C--N 1.317 -0.814 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.601 176.96 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 43.8 p90 . . . . . 0 N--CA 1.451 -0.385 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 8.3 tt -122.7 141.22 43.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-O 120.928 0.394 . . . . 0.0 110.594 179.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 781' ' ' THR . . . . . 0.401 ' HA ' ' O ' ' A' ' 744' ' ' LEU . 25.7 m -127.14 127.63 44.88 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.468 -179.648 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 35.4 t -106.19 124.44 61.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.653 178.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 783' ' ' SER . . . . . 0.482 ' HA ' ' O ' ' A' ' 742' ' ' MET . 55.6 p -112.36 139.55 47.83 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.072 0.463 . . . . 0.0 111.259 -177.114 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 89.6 mttt . . . . . 0 C--N 1.329 -0.301 0 CA-C-O 121.408 0.623 . . . . 0.0 110.326 175.268 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 31.8 t60 . . . . . 0 N--CA 1.461 0.12 0 CA-C-O 121.212 0.529 . . . . 0.0 109.602 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 36.2 m-85 -70.24 -24.24 63.05 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.45 -178.494 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 730' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 730' ' ' ARG . 12.0 ttm180 -70.34 -39.76 74.52 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 178.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -63.96 -41.73 97.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.133 175.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 35.0 mmm -59.83 -43.36 94.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.549 178.004 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 733' ' ' ILE . . . . . 0.454 ' O ' ' HG3' ' A' ' 737' ' ' MET . 48.7 mt -70.03 -45.15 77.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.871 -0.604 . . . . 0.0 112.101 -178.304 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 10.9 p -63.47 -37.12 78.71 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 120.968 -0.293 . . . . 0.0 111.166 -176.075 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -74.02 -36.01 64.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.06 0.457 . . . . 0.0 110.186 176.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 736' ' ' PHE . . . . . 0.456 ' CE1' ' HB2' ' A' ' 744' ' ' LEU . 19.3 t80 -60.76 -37.02 80.41 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.819 175.838 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 737' ' ' MET . . . . . 0.454 ' HG3' ' O ' ' A' ' 733' ' ' ILE . 87.6 mtp -63.23 -36.24 82.98 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.093 178.863 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -86.28 -16.14 38.5 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.383 -178.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 58.9 m -84.53 169.41 14.48 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.874 0.369 . . . . 0.0 111.316 -177.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -73.36 -16.38 61.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.936 -0.575 . . . . 0.0 112.061 -176.304 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -60.16 134.59 57.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.127 0.489 . . . . 0.0 111.051 -177.338 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 56.6 mtm -92.47 -26.96 17.74 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.935 177.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -137.35 135.68 37.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.311 -179.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 744' ' ' LEU . . . . . 0.456 ' HB2' ' CE1' ' A' ' 736' ' ' PHE . 30.4 tp -112.94 105.37 13.43 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 176.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -91.37 112.65 24.65 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.243 -178.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 746' ' ' PHE . . . . . 0.514 ' O ' ' HB2' ' A' ' 779' ' ' PHE . 87.4 m-85 -85.51 150.07 53.19 Favored Pre-proline 0 C--N 1.321 -0.661 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.154 178.023 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -67.41 158.81 55.29 Favored 'Trans proline' 0 N--CA 1.461 -0.391 0 C-N-CA 122.407 2.071 . . . . 0.0 112.008 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -66.09 -5.64 12.74 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.787 2.324 . . . . 0.0 112.532 176.683 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 3.4 m -63.4 -20.74 65.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.476 -0.783 . . . . 0.0 111.42 178.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.5 mp -69.06 113.85 6.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.372 177.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 751' ' ' ASN . . . . . 0.49 HD21 ' C ' ' A' ' 751' ' ' ASN . 0.3 OUTLIER -84.86 -167.36 1.79 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 110.247 -0.279 . . . . 0.0 110.247 179.061 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 6.2 m -52.25 -52.09 54.56 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 111.664 0.246 . . . . 0.0 111.664 -177.059 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 753' ' ' HIS . . . . . 0.437 ' O ' ' HG2' ' A' ' 757' ' ' ARG . 32.0 t-80 -59.54 -49.71 76.7 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.625 -0.261 . . . . 0.0 111.347 179.097 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -56.63 -55.73 30.34 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.168 -176.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 77.1 mtt85 -56.55 -49.69 74.06 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.35 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -53.08 -46.25 68.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.218 -178.07 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 757' ' ' ARG . . . . . 0.437 ' HG2' ' O ' ' A' ' 753' ' ' HIS . 31.9 mmm180 -60.35 -45.86 91.96 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.355 178.48 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 91.9 t -60.45 -47.39 92.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.648 -0.251 . . . . 0.0 110.943 179.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 87.8 m-70 -52.33 -56.73 12.95 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.711 178.431 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -60.79 -41.95 96.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.041 -0.527 . . . . 0.0 112.099 -178.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.59 -50.5 79.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.749 0.309 . . . . 0.0 110.845 179.257 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -64.39 -36.73 85.1 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.889 0.376 . . . . 0.0 110.58 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -65.32 -40.25 93.49 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.573 178.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.21 -43.37 78.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.053 -0.522 . . . . 0.0 109.852 177.686 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 10.5 m170 -69.09 -17.0 63.81 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.431 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 84.38 34.99 15.3 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.457 177.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 80.1 mt -110.4 172.95 6.56 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.03 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 73.3 ttt180 -92.71 143.75 25.99 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 177.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 5.5 p80 -146.06 121.49 10.32 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.222 0.534 . . . . 0.0 110.638 179.498 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -129.32 138.07 51.37 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.7 -176.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 5.1 m . . . . . 0 C--N 1.318 -0.785 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 174.637 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 779' ' ' PHE . . . . . 0.514 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 45.8 p90 . . . . . 0 N--CA 1.451 -0.408 0 CA-C-O 120.713 0.292 . . . . 0.0 110.274 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 6.7 tt -116.41 135.5 56.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-O 121.278 0.561 . . . . 0.0 110.775 -178.028 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 55.9 m -119.91 120.24 35.83 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.733 -179.496 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 46.5 t -94.14 122.53 45.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.51 176.109 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 45.5 t -114.22 134.05 55.19 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-O 121.072 0.463 . . . . 0.0 110.835 -176.018 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 50.9 mtpt . . . . . 0 C--N 1.327 -0.404 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.771 179.268 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 44.2 t60 . . . . . 0 N--CA 1.464 0.231 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -64.22 -23.03 67.16 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.187 -176.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 1.8 ttm180 -69.2 -47.69 64.17 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 178.284 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -63.5 -42.43 98.52 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.668 178.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 37.9 mmm -60.63 -38.15 83.83 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.381 179.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 48.8 mt -72.9 -45.99 53.88 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.661 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 11.1 p -64.9 -35.1 74.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 C-N-CA 120.861 -0.335 . . . . 0.0 110.94 -176.665 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -74.73 -33.34 62.34 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 121.023 0.439 . . . . 0.0 110.208 176.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 736' ' ' PHE . . . . . 0.459 ' CE2' ' HG3' ' A' ' 784' ' ' LYS . 32.2 t80 -61.79 -36.26 80.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.913 174.347 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 80.8 mtp -74.14 -26.05 60.1 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.15 177.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -87.77 -24.97 23.62 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.859 0.362 . . . . 0.0 110.609 -176.46 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 77.3 p -89.9 -173.81 4.03 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.45 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -100.92 16.47 25.13 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.436 -176.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 741' ' ' LYS . . . . . 0.44 ' O ' ' HD3' ' A' ' 784' ' ' LYS . 58.3 mttp -72.78 132.23 43.33 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 177.049 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 25.7 mmt -88.97 -28.51 20.2 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.727 0.299 . . . . 0.0 110.583 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -141.19 136.76 32.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.321 -177.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 744' ' ' LEU . . . . . 0.44 HD12 ' CZ ' ' A' ' 746' ' ' PHE . 0.7 OUTLIER -107.78 103.79 13.14 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 179.059 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -86.52 103.29 14.9 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.981 0.42 . . . . 0.0 110.554 177.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 746' ' ' PHE . . . . . 0.44 ' CZ ' HD12 ' A' ' 744' ' ' LEU . 72.2 m-85 -81.83 151.9 68.27 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.474 176.82 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -65.45 153.6 77.48 Favored 'Trans proline' 0 CA--C 1.531 0.367 0 C-N-CA 122.706 2.27 . . . . 0.0 112.47 178.431 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -67.15 -5.68 14.28 Favored 'Trans proline' 0 N--CA 1.474 0.352 0 C-N-CA 123.218 2.612 . . . . 0.0 113.051 179.235 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 23.2 t -71.5 -13.95 61.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.786 179.32 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.9 mp -71.51 112.59 7.75 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 175.281 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 31.1 p30 -85.3 -170.59 3.19 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.425 -179.326 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 19.5 m -57.63 -38.43 74.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.509 0.195 . . . . 0.0 111.366 -176.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 38.2 t-80 -69.64 -48.67 59.13 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.834 178.515 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -59.39 -50.6 73.32 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 121.217 0.532 . . . . 0.0 110.5 -179.178 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 22.9 mtm180 -60.9 -40.59 93.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.339 179.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 54.5 tp -55.54 -44.03 76.36 Favored 'General case' 0 C--N 1.332 -0.194 0 O-C-N 123.287 0.367 . . . . 0.0 110.819 178.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 19.2 tpt180 -59.74 -43.1 94.39 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 121.033 0.444 . . . . 0.0 110.07 179.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 48.6 t -64.83 -48.35 84.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.937 178.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -57.2 -47.25 81.74 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 110.324 -0.25 . . . . 0.0 110.324 178.407 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -52.03 -53.62 39.79 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.687 177.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 74.8 mt -65.82 -43.57 93.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.398 -175.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -64.8 -37.0 86.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.987 0.422 . . . . 0.0 110.679 179.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -69.65 -36.92 76.5 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.378 178.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -64.51 -49.33 71.76 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.412 175.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 13.1 m170 -69.44 -31.41 69.71 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.365 -176.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 98.77 38.41 3.9 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.203 179.031 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 78.6 mt -111.26 174.39 5.89 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 178.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 768' ' ' ARG . . . . . 0.413 HH11 ' HD2' ' A' ' 768' ' ' ARG . 21.5 ttt180 -93.52 136.6 33.63 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 178.892 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.7 p80 -142.35 134.24 27.12 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 120.648 0.261 . . . . 0.0 110.805 -177.268 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -146.56 142.91 28.48 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.345 179.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 3.3 p . . . . . 0 C--N 1.318 -0.786 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.276 176.419 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 50.7 p90 . . . . . 0 N--CA 1.447 -0.619 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 15.2 tt -107.85 133.41 52.78 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-O 121.387 0.613 . . . . 0.0 110.733 -179.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 781' ' ' THR . . . . . 0.436 ' HA ' ' O ' ' A' ' 744' ' ' LEU . 26.7 m -116.05 115.75 26.66 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.048 177.686 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 33.5 t -91.04 134.18 30.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 176.112 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 33.7 t -125.26 137.12 54.09 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.126 0.489 . . . . 0.0 110.731 -175.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 784' ' ' LYS . . . . . 0.459 ' HG3' ' CE2' ' A' ' 736' ' ' PHE . 60.1 mtpt . . . . . 0 C--N 1.323 -0.584 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.411 178.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 26.1 t60 . . . . . 0 C--O 1.233 0.236 0 CA-C-O 120.982 0.42 . . . . 0.0 111.252 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 24.7 m-85 -74.46 -35.54 63.31 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.672 -174.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 730' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 730' ' ' ARG . 17.1 ttp85 -64.34 -39.65 94.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.744 0.307 . . . . 0.0 110.351 178.947 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -64.06 -48.14 77.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.704 178.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 11.9 mtm -61.96 -35.42 78.42 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.145 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 733' ' ' ILE . . . . . 0.507 ' O ' ' HG3' ' A' ' 737' ' ' MET . 66.4 mt -71.72 -49.86 42.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.706 -0.224 . . . . 0.0 111.6 179.316 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 11.2 p -63.58 -34.6 68.63 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 120.988 -0.285 . . . . 0.0 111.39 -175.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -77.49 -31.18 53.46 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.95 0.405 . . . . 0.0 110.356 177.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 736' ' ' PHE . . . . . 0.502 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 0.7 OUTLIER -66.22 -37.01 84.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.447 174.489 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 737' ' ' MET . . . . . 0.507 ' HG3' ' O ' ' A' ' 733' ' ' ILE . 88.7 mtp -61.74 -28.65 69.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.013 179.408 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -102.85 9.55 38.85 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.005 -179.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 7.6 t -96.54 -164.54 1.16 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.028 -179.033 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -108.19 10.66 27.86 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.731 0.301 . . . . 0.0 111.628 -176.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 56.5 mttp -91.7 136.97 32.74 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.827 0.346 . . . . 0.0 110.541 177.679 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.86 -24.63 35.67 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.534 179.501 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -152.87 138.12 17.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.11 0.481 . . . . 0.0 111.092 177.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 744' ' ' LEU . . . . . 0.502 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 59.7 tp -102.67 105.75 16.27 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.607 -179.61 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -87.36 114.16 23.72 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.278 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . 80.9 m-85 -84.77 151.33 57.9 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.501 179.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 747' ' ' PRO . . . . . 0.425 ' HB2' ' OG ' ' A' ' 749' ' ' SER . 13.8 Cg_exo -68.33 155.71 68.28 Favored 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 122.606 2.204 . . . . 0.0 112.184 177.456 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -67.94 -3.01 9.73 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 122.995 2.463 . . . . 0.0 112.821 178.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 749' ' ' SER . . . . . 0.425 ' OG ' ' HB2' ' A' ' 747' ' ' PRO . 5.3 p -68.62 -23.18 64.42 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.251 178.648 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.7 mp -63.14 115.65 4.68 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.01 175.166 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -84.62 -171.38 3.59 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.186 -179.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 2.8 m -48.19 -54.25 14.07 Favored 'General case' 0 C--N 1.328 -0.349 0 O-C-N 123.59 0.556 . . . . 0.0 111.914 -178.387 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 34.9 m80 -73.31 -31.16 63.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.462 -175.258 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -64.47 -47.4 79.11 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 176.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 23.3 mtm180 -61.87 -45.98 91.39 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.041 177.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 57.8 tp -52.69 -41.82 64.23 Favored 'General case' 0 C--N 1.332 -0.168 0 O-C-N 123.432 0.457 . . . . 0.0 110.848 178.543 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 26.2 tpt180 -61.47 -45.91 92.26 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.952 179.357 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 99.6 t -64.83 -47.42 88.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.188 179.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -55.23 -48.6 73.69 Favored 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 178.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 63.8 mt-30 -52.74 -51.79 59.05 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.516 177.489 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 77.3 mt -66.36 -47.65 83.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.505 -175.341 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -64.22 -39.03 93.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.834 0.349 . . . . 0.0 110.463 -179.113 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -65.86 -40.79 92.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.216 178.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -66.95 -45.52 77.55 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.741 178.276 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 10.7 m170 -70.38 -27.76 64.56 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.445 -177.177 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 98.24 30.69 6.87 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.527 -0.844 . . . . 0.0 112.544 177.592 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 53.1 mt -107.05 162.78 13.55 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 177.677 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 26.0 ttp180 -84.43 132.39 34.57 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.654 -0.418 . . . . 0.0 109.893 178.698 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 4.4 p80 -130.71 123.68 29.83 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-O 121.111 0.482 . . . . 0.0 110.254 178.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -136.83 155.76 49.38 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.944 -179.002 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 9.4 t . . . . . 0 C--N 1.32 -0.687 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 178.307 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 45.3 p90 . . . . . 0 N--CA 1.453 -0.311 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 8.9 tt -127.07 143.49 40.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-O 121.025 0.44 . . . . 0.0 111.166 -175.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 57.3 m -124.6 125.83 44.78 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.678 179.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 47.5 t -102.94 114.29 42.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 176.125 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 11.2 t -110.78 140.0 45.59 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.087 0.47 . . . . 0.0 110.726 -175.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt . . . . . 0 C--N 1.324 -0.506 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.955 176.138 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 728' ' ' HIS . . . . . 0.465 ' O ' ' HG3' ' A' ' 732' ' ' MET . 4.8 t60 . . . . . 0 C--O 1.232 0.167 0 CA-C-O 121.052 0.453 . . . . 0.0 110.452 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -77.03 -31.38 56.28 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.007 -175.229 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 -57.75 -43.23 85.27 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 174.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -64.8 -48.22 75.22 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.665 177.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 732' ' ' MET . . . . . 0.465 ' HG3' ' O ' ' A' ' 728' ' ' HIS . 92.2 mtp -57.37 -45.76 84.08 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.933 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 733' ' ' ILE . . . . . 0.452 ' O ' ' HG3' ' A' ' 737' ' ' MET . 72.9 mt -67.17 -45.57 86.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.912 -178.236 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 11.3 p -66.98 -38.42 81.33 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 120.594 -0.442 . . . . 0.0 111.065 -176.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 735' ' ' GLU . . . . . 0.448 ' O ' ' HB2' ' A' ' 739' ' ' SER . 42.8 mt-10 -72.09 -33.35 67.82 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-O 120.842 0.353 . . . . 0.0 110.114 177.33 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 736' ' ' PHE . . . . . 0.615 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 7.0 t80 -60.12 -42.66 95.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.354 177.31 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 737' ' ' MET . . . . . 0.465 ' SD ' HD11 ' A' ' 767' ' ' LEU . 46.4 mtm -62.4 -25.8 68.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.59 -176.592 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -112.61 12.89 19.9 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.907 0.384 . . . . 0.0 111.152 -178.446 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 739' ' ' SER . . . . . 0.448 ' HB2' ' O ' ' A' ' 735' ' ' GLU . 7.7 t -94.98 7.09 47.18 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.407 -176.937 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? 65.27 16.81 10.74 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.201 -177.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -97.32 125.04 41.66 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 176.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.0 -20.11 33.36 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.147 -177.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -147.06 129.15 15.55 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.145 -174.528 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 744' ' ' LEU . . . . . 0.615 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 42.6 tp -118.61 102.29 8.76 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 110.067 -0.345 . . . . 0.0 110.067 179.805 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 11.3 mp0 -85.72 108.16 17.93 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.214 -0.448 . . . . 0.0 109.946 177.052 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -75.23 152.02 85.94 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.647 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -64.89 149.59 89.33 Favored 'Trans proline' 0 CA--C 1.53 0.316 0 C-N-CA 122.774 2.316 . . . . 0.0 112.06 177.011 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -67.31 -2.44 8.17 Favored 'Trans proline' 0 N--CA 1.474 0.346 0 C-N-CA 123.239 2.626 . . . . 0.0 113.145 -179.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 13.0 t -74.02 -18.1 60.89 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.93 179.351 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.8 mp -64.38 113.76 3.84 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.155 176.409 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 751' ' ' ASN . . . . . 0.455 ' O ' ' HG3' ' A' ' 755' ' ' ARG . 4.5 p30 -81.25 -176.69 6.11 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 -179.019 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 44.3 t -49.44 -49.11 46.59 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.515 -179.065 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 41.1 m80 -67.87 -37.54 81.94 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.524 -178.262 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -64.0 -49.68 71.53 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.142 0.496 . . . . 0.0 110.218 179.176 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 755' ' ' ARG . . . . . 0.455 ' HG3' ' O ' ' A' ' 751' ' ' ASN . 23.5 mtm180 -63.83 -38.46 91.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.208 -179.718 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 62.1 tp -54.41 -44.71 72.62 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 123.393 0.433 . . . . 0.0 110.779 177.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 31.2 mmm180 -58.9 -47.02 86.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.974 177.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 59.0 t -59.24 -48.47 86.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.976 178.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -57.38 -55.02 40.22 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.638 -0.255 . . . . 0.0 110.841 179.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -53.45 -46.3 69.84 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 121.097 0.475 . . . . 0.0 111.416 -178.532 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 96.4 mt -68.56 -47.52 76.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.294 -176.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -65.37 -34.1 77.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.937 0.399 . . . . 0.0 110.532 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -64.0 -35.15 79.76 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.39 178.179 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -74.81 -42.64 57.69 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 120.975 0.417 . . . . 0.0 110.848 176.66 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 11.4 m170 -65.28 -26.23 67.99 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.401 -179.127 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 93.29 20.68 31.9 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.928 -0.653 . . . . 0.0 111.838 -179.409 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 767' ' ' LEU . . . . . 0.465 HD11 ' SD ' ' A' ' 737' ' ' MET . 32.6 mt -97.62 166.49 11.48 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 -177.251 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 28.7 ttt180 -85.68 125.18 32.98 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.057 175.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 3.3 p80 -121.2 116.63 25.29 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.113 174.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 41.2 t0 -141.83 156.9 45.53 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.802 -172.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 6.1 p . . . . . 0 C--N 1.319 -0.745 0 CA-C-O 120.982 0.42 . . . . 0.0 111.305 -175.987 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 50.4 p90 . . . . . 0 N--CA 1.449 -0.488 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 12.7 tt -116.06 143.0 27.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-O 121.1 0.476 . . . . 0.0 110.519 -179.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 49.5 m -129.72 130.15 45.09 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.639 179.342 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 98.7 t -106.85 132.27 54.6 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.722 178.223 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 16.4 m -124.88 139.41 53.86 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.208 -179.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp . . . . . 0 C--N 1.326 -0.445 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.49 -177.287 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo . . . . . 0 N--CA 1.474 0.378 0 N-CA-C 110.335 -0.679 . . . . 0.0 110.335 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -155.49 136.77 13.95 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.03 0.443 . . . . 0.0 110.608 -175.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . 146.78 -157.23 27.34 Favored Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.99 -0.624 . . . . 0.0 111.79 -179.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 17.2 m -113.49 126.14 70.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.256 0.55 . . . . 0.0 110.25 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -106.41 -30.21 9.25 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.636 -179.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 51.0 m -77.64 72.47 4.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.488 0.661 . . . . 0.0 110.013 177.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 54.1 mt-30 -83.73 141.17 31.64 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.891 -176.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -88.29 4.18 46.91 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.5 175.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . 82.37 -83.99 1.54 Allowed Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 110.259 -1.136 . . . . 0.0 110.259 -174.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 47.0 t -138.68 112.34 7.29 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.845 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 175.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 727' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -121.42 134.44 55.1 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.893 -178.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 728' ' ' HIS . . . . . 0.455 ' O ' ' HG2' ' A' ' 732' ' ' MET . 51.1 t60 -54.13 -56.43 18.25 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 123.312 0.382 . . . . 0.0 110.885 -178.75 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 729' ' ' PHE . . . . . 0.416 ' CZ ' ' HB3' ' A' ' 754' ' ' ASP . 66.1 m-85 -71.96 -32.48 67.33 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.314 -173.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 17.2 ttt180 -67.99 -35.13 77.81 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.152 177.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -67.17 -39.84 86.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.324 176.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 732' ' ' MET . . . . . 0.455 ' HG2' ' O ' ' A' ' 728' ' ' HIS . 38.7 mmm -61.86 -40.46 95.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.681 177.729 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 733' ' ' ILE . . . . . 0.417 ' O ' ' HG3' ' A' ' 737' ' ' MET . 64.5 mt -71.53 -42.99 72.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.898 -178.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 8.0 p -64.7 -35.37 74.71 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 C-N-CA 120.738 -0.385 . . . . 0.0 110.763 -177.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -66.33 -47.35 73.79 Favored 'General case' 0 CA--C 1.522 -0.124 0 CA-C-O 121.25 0.547 . . . . 0.0 109.577 173.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 736' ' ' PHE . . . . . 0.589 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 45.2 t80 -52.96 -42.73 65.78 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.015 -0.993 . . . . 0.0 111.676 179.014 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 737' ' ' MET . . . . . 0.417 ' HG3' ' O ' ' A' ' 733' ' ' ILE . 83.6 mtp -61.08 -32.68 72.33 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.673 -177.594 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -101.02 2.38 40.49 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.488 -177.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 60.7 m -98.44 174.45 6.46 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.18 0.514 . . . . 0.0 112.049 -175.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 16.5 ptmt -74.43 -18.26 60.67 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.726 177.023 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 29.9 mttm -57.93 111.18 1.08 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.101 -178.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 26.6 ptt? -78.1 -22.21 49.27 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.219 0.533 . . . . 0.0 109.717 175.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -143.19 135.99 27.7 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.329 -0.851 . . . . 0.0 109.698 178.152 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 744' ' ' LEU . . . . . 0.589 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 36.4 tp -105.69 105.77 15.96 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 179.095 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -86.47 115.41 23.95 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.146 -0.933 . . . . 0.0 110.208 178.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -90.34 149.73 41.68 Favored Pre-proline 0 C--N 1.319 -0.737 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.756 177.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_exo -69.32 156.04 65.62 Favored 'Trans proline' 0 N--CA 1.462 -0.358 0 C-N-CA 122.758 2.305 . . . . 0.0 111.953 177.057 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -66.15 -4.13 9.82 Favored 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 122.73 2.286 . . . . 0.0 112.771 176.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 32.9 t -67.04 -16.52 64.41 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.516 179.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.8 mp -71.97 128.63 36.33 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.699 0.285 . . . . 0.0 110.391 177.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 751' ' ' ASN . . . . . 0.487 ' O ' ' HG3' ' A' ' 755' ' ' ARG . 4.7 p30 -93.97 -176.89 4.15 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 175.469 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 20.7 t -54.13 -41.81 68.8 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 122.971 0.169 . . . . 0.0 111.303 -177.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 49.1 t-80 -65.06 -45.47 85.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.68 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 754' ' ' ASP . . . . . 0.416 ' HB3' ' CZ ' ' A' ' 729' ' ' PHE . 45.2 m-20 -62.03 -43.17 99.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.222 0.534 . . . . 0.0 110.057 -177.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 755' ' ' ARG . . . . . 0.487 ' HG3' ' O ' ' A' ' 751' ' ' ASN . 70.9 mtt-85 -65.21 -46.56 80.21 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.964 177.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 756' ' ' LEU . . . . . 0.578 ' HB2' " H4'" ' A' ' 801' ' ' DGP . 56.1 tp -52.78 -40.87 63.57 Favored 'General case' 0 N--CA 1.463 0.223 0 O-C-N 123.443 0.465 . . . . 0.0 110.533 177.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 757' ' ' ARG . . . . . 0.517 ' HA ' ' HE ' ' A' ' 757' ' ' ARG . 1.6 tpm_? -57.65 -50.81 71.94 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.248 176.545 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 61.2 t -63.15 -48.08 89.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.297 -179.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -55.74 -46.72 77.75 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.425 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 64.4 mt-30 -56.89 -52.96 63.11 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.949 0.404 . . . . 0.0 111.607 178.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 76.1 mt -65.55 -47.12 87.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.356 -175.201 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -63.74 -36.55 84.23 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.744 0.307 . . . . 0.0 110.876 -178.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -65.98 -39.16 90.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.719 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -73.99 -39.66 63.5 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.124 178.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 10.5 m170 -70.43 -34.97 73.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.086 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 107.4 31.41 3.77 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.414 -0.898 . . . . 0.0 112.925 176.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 29.3 mt -111.14 164.75 12.52 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 179.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 70.8 ttt-85 -88.5 132.99 34.27 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 -179.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.0 p80 -134.34 130.85 37.57 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.566 -177.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -155.43 146.22 22.29 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.831 -177.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 4.3 m -104.85 126.72 52.21 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-O 121.227 0.537 . . . . 0.0 109.823 176.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 22.3 m -114.52 162.74 16.32 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.077 -176.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 98.79 -135.63 12.25 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.087 -179.016 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 774' ' ' GLU . . . . . 0.505 ' O ' ' HB2' ' A' ' 778' ' ' ARG . 30.0 mt-10 -134.22 -100.58 0.24 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.099 0.476 . . . . 0.0 110.313 -177.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 775' ' ' GLY . . . . . 0.409 ' H ' ' HB2' ' A' ' 774' ' ' GLU . . . -127.95 -57.57 0.12 Allowed Glycine 0 N--CA 1.445 -0.737 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 170.452 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.97 -14.39 62.68 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 121.034 0.445 . . . . 0.0 110.609 173.399 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 80.5 mtt180 -119.08 17.52 13.23 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.565 175.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 778' ' ' ARG . . . . . 0.505 ' HB2' ' O ' ' A' ' 774' ' ' GLU . 18.0 ttt85 -86.14 120.07 27.12 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.384 0.611 . . . . 0.0 111.432 -176.029 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 37.0 p90 -135.73 162.06 33.81 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 176.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 8.0 tt -116.22 133.54 62.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-O 121.12 0.486 . . . . 0.0 110.904 -177.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 4.0 m -115.17 124.73 52.2 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.365 -178.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 60.0 t -104.89 129.71 57.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 174.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 41.5 t -118.93 143.74 46.84 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.136 0.493 . . . . 0.0 110.979 -177.294 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 784' ' ' LYS . . . . . 0.544 ' HG3' ' CZ ' ' A' ' 736' ' ' PHE . 62.6 mtpt -74.32 -21.28 59.79 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.973 -179.449 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 785' ' ' ARG . . . . . 0.465 ' CZ ' ' HA ' ' A' ' 785' ' ' ARG . 0.5 OUTLIER -88.35 94.91 10.0 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.657 -178.607 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.984 0 CA-C-O 118.608 -0.71 . . . . 0.0 109.843 173.278 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 801' ' ' DGP . . . . . 0.578 " H4'" ' HB2' ' A' ' 756' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo . . . . . 0 N--CA 1.478 0.57 0 N-CA-C 111.535 -0.217 . . . . 0.0 111.535 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -104.5 125.9 51.1 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 178.082 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . 95.04 45.15 3.14 Favored Glycine 0 N--CA 1.445 -0.732 0 C-N-CA 120.627 -0.797 . . . . 0.0 111.203 -175.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 59.9 t -76.48 91.69 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.152 0.501 . . . . 0.0 110.309 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -109.86 110.31 21.24 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.387 0.613 . . . . 0.0 110.585 178.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 17.8 m -132.12 99.85 4.85 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.381 177.308 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 17.0 tt0 -82.99 -3.36 57.12 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.214 0.53 . . . . 0.0 110.25 -175.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -72.49 105.24 4.09 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 174.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . -64.43 -55.04 25.56 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.081 -176.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 3.1 p -110.08 111.11 34.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-O 121.395 0.616 . . . . 0.0 109.719 175.11 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 727' ' ' ASP . . . . . 0.425 ' HB3' ' HB3' ' A' ' 730' ' ' ARG . 19.7 t70 -108.63 128.1 54.55 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.37 -177.744 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 13.5 t60 -62.42 -50.46 71.42 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.638 -176.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -77.53 -36.93 51.92 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.398 -172.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 730' ' ' ARG . . . . . 0.425 ' HB3' ' HB3' ' A' ' 727' ' ' ASP . 53.2 ttp180 -59.92 -41.02 90.85 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 175.659 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -65.76 -45.59 81.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.714 178.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 19.3 mmm -58.24 -45.02 88.49 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.93 178.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 74.9 mt -70.71 -43.39 77.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.827 -177.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 8.5 p -66.28 -35.5 75.12 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.14 -177.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -77.15 -27.6 53.9 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-O 120.789 0.328 . . . . 0.0 110.449 176.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 736' ' ' PHE . . . . . 0.495 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 25.7 t80 -65.34 -41.1 94.28 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.299 178.015 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 65.6 mtm -63.58 -29.71 70.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.071 0.463 . . . . 0.0 110.518 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -96.45 8.45 44.03 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.026 -0.533 . . . . 0.0 111.097 179.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 44.2 t -93.68 165.88 12.5 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.363 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -84.91 -1.65 56.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.292 -179.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -73.79 160.47 31.44 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.719 179.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 4.4 mpp? -108.89 -28.56 9.09 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.217 175.102 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -142.92 127.68 18.18 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.211 0.529 . . . . 0.0 111.145 178.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 744' ' ' LEU . . . . . 0.495 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 52.7 tp -96.73 106.13 18.37 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.312 179.057 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -90.94 106.07 18.26 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.089 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -75.14 157.18 85.44 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.19 -177.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -68.33 161.8 43.2 Favored 'Trans proline' 0 CA--C 1.535 0.539 0 C-N-CA 122.641 2.228 . . . . 0.0 112.057 175.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -76.39 -9.75 18.89 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.505 2.137 . . . . 0.0 111.753 178.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 20.1 t -64.07 -21.44 66.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.427 -179.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 11.2 mp -61.5 121.24 12.21 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.655 -0.248 . . . . 0.0 110.74 178.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 751' ' ' ASN . . . . . 0.476 ' O ' ' HG2' ' A' ' 755' ' ' ARG . 3.4 p-10 -90.72 -176.65 4.77 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 177.661 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 15.1 m -50.11 -49.83 50.42 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -173.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 38.7 t-80 -54.04 -47.9 71.11 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.977 177.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 754' ' ' ASP . . . . . 0.486 ' O ' HG23 ' A' ' 758' ' ' VAL . 57.9 m-20 -62.75 -45.43 92.76 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.629 -176.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 755' ' ' ARG . . . . . 0.476 ' HG2' ' O ' ' A' ' 751' ' ' ASN . 23.7 mmt180 -52.99 -60.59 3.09 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.835 176.263 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 756' ' ' LEU . . . . . 0.475 HD21 " H1'" ' A' ' 801' ' ' DGP . 2.3 tm? -52.62 -45.04 66.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 114.654 -1.157 . . . . 0.0 111.269 -177.298 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 10.2 mmt85 -55.48 -49.04 73.56 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.991 178.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 758' ' ' VAL . . . . . 0.486 HG23 ' O ' ' A' ' 754' ' ' ASP . 63.1 t -62.71 -45.34 99.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.738 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -55.69 -54.33 45.61 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.824 179.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 99.3 mt-30 -54.69 -52.04 63.65 Favored 'General case' 0 C--O 1.232 0.183 0 O-C-N 123.25 0.344 . . . . 0.0 111.528 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 94.3 mt -62.77 -50.42 79.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.228 -176.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -64.1 -38.78 92.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.842 0.353 . . . . 0.0 111.166 -178.078 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 763' ' ' GLU . . . . . 0.445 ' CD ' HN22 ' A' ' 801' ' ' DGP . 42.0 tt0 -66.25 -35.83 81.43 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.035 -178.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -85.19 -29.55 24.63 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.757 0.313 . . . . 0.0 110.942 -178.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 6.7 m170 -70.08 -24.44 63.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.835 0.35 . . . . 0.0 110.598 174.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 96.2 28.82 8.88 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.871 -0.681 . . . . 0.0 112.366 177.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 56.0 mt -105.08 170.89 7.61 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 768' ' ' ARG . . . . . 0.556 ' HB3' ' OG ' ' A' ' 783' ' ' SER . 30.4 ttt180 -98.89 140.12 33.53 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 -178.06 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -150.92 134.05 16.04 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.28 0.562 . . . . 0.0 111.782 -176.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -155.47 168.23 27.79 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.493 175.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 7.2 m -101.22 140.12 35.95 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.12 0.486 . . . . 0.0 110.694 -176.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 9.6 m -120.66 132.74 55.26 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.859 -0.609 . . . . 0.0 109.81 -178.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 102.41 175.12 27.35 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.889 -0.672 . . . . 0.0 111.493 -175.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -115.83 -61.75 1.69 Allowed 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 -175.179 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . -108.72 -111.6 3.48 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.579 -0.819 . . . . 0.0 113.058 -175.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -67.54 -23.66 65.45 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.876 0.37 . . . . 0.0 111.055 -176.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 74.1 mtp180 -91.44 1.65 56.97 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.91 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 778' ' ' ARG . . . . . . . . . . . . . 41.1 ttt85 -72.56 131.26 42.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.422 0.63 . . . . 0.0 110.922 179.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 49.0 p90 -140.44 -175.16 4.17 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.585 177.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 6.2 tt -121.13 135.64 60.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.85 0.357 . . . . 0.0 110.68 -178.152 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 29.5 m -116.97 124.86 50.39 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.697 -177.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 47.5 t -108.53 124.06 64.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.095 176.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 783' ' ' SER . . . . . 0.556 ' OG ' ' HB3' ' A' ' 768' ' ' ARG . 4.6 p -113.37 140.78 47.75 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 121.311 0.577 . . . . 0.0 111.099 -179.59 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 784' ' ' LYS . . . . . 0.467 ' HG3' ' CZ ' ' A' ' 736' ' ' PHE . 62.7 mtpt -75.13 -21.57 58.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.084 179.231 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 11.6 mmm180 -80.53 94.22 6.21 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.102 -0.954 . . . . 0.0 111.187 178.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.168 0 CA-C-O 118.819 -0.61 . . . . 0.0 110.292 178.173 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 801' ' ' DGP . . . . . 0.475 " H1'" HD21 ' A' ' 756' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo . . . . . 0 N--CA 1.476 0.446 0 N-CA-C 110.574 -0.587 . . . . 0.0 110.574 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -136.77 101.83 4.72 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.303 0.573 . . . . 0.0 110.66 -178.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . -138.56 61.18 0.58 Allowed Glycine 0 N--CA 1.446 -0.695 0 N-CA-C 110.741 -0.944 . . . . 0.0 110.741 176.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 50.7 t -95.73 111.82 26.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 120.875 0.369 . . . . 0.0 110.581 -175.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -97.98 -41.01 8.18 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.184 0.516 . . . . 0.0 110.186 174.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 17.9 t -144.93 143.92 30.8 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.745 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 25.8 mp0 -71.23 -34.77 71.1 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.985 0.421 . . . . 0.0 109.926 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 40.0 m-20 -93.99 43.93 1.11 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.906 177.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . -75.96 68.69 2.24 Favored Glycine 0 N--CA 1.449 -0.454 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.932 179.219 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 2.8 p -141.73 109.13 2.16 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.705 0 CA-C-O 121.668 0.747 . . . . 0.0 110.648 179.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 727' ' ' ASP . . . . . 0.521 ' HB3' ' HB3' ' A' ' 730' ' ' ARG . 8.9 t70 -148.07 120.41 8.42 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 114.809 -1.087 . . . . 0.0 108.286 175.48 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -54.06 -63.31 1.19 Allowed 'General case' 0 C--N 1.327 -0.394 0 O-C-N 123.465 0.478 . . . . 0.0 111.202 -172.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -69.38 -32.96 72.33 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.832 -174.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 730' ' ' ARG . . . . . 0.521 ' HB3' ' HB3' ' A' ' 727' ' ' ASP . 57.8 ttm-85 -64.2 -45.78 86.82 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.227 177.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -62.24 -42.68 99.53 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.727 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 26.8 mmm -59.3 -44.71 92.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.687 177.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 66.7 mt -74.01 -43.04 52.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.146 -0.479 . . . . 0.0 112.174 -176.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 734' ' ' VAL . . . . . 0.44 ' HA ' ' HE2' ' A' ' 737' ' ' MET . 12.1 p -64.62 -40.3 88.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.19 -176.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -77.45 -26.38 51.45 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.367 178.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 736' ' ' PHE . . . . . 0.453 ' CZ ' ' HG3' ' A' ' 784' ' ' LYS . 23.8 t80 -60.52 -39.97 89.75 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.756 174.432 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 737' ' ' MET . . . . . 0.44 ' HE2' ' HA ' ' A' ' 734' ' ' VAL . 67.7 mtm -63.54 -25.38 68.22 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.02 0.438 . . . . 0.0 110.698 177.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -96.96 3.07 52.22 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.26 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 67.0 m -101.52 170.99 7.84 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.801 0.334 . . . . 0.0 110.992 -178.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -85.43 -11.27 54.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.389 -176.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -63.98 128.53 36.24 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.473 176.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 742' ' ' MET . . . . . 0.4 ' HG3' ' HG3' ' A' ' 743' ' ' GLN . 14.5 ptp -83.57 -24.71 31.44 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.838 0.351 . . . . 0.0 110.407 175.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 743' ' ' GLN . . . . . 0.4 ' HG3' ' HG3' ' A' ' 742' ' ' MET . 52.0 mt-30 -134.63 131.83 38.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.286 -178.266 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 744' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -94.71 98.63 10.91 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 175.211 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -83.29 101.3 11.19 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.386 -178.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 746' ' ' PHE . . . . . 0.405 ' O ' ' HB2' ' A' ' 779' ' ' PHE . 68.1 m-85 -85.56 148.29 48.82 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.734 179.586 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 747' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 746' ' ' PHE . 14.8 Cg_exo -68.29 155.0 70.87 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 122.68 2.253 . . . . 0.0 112.028 176.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -68.02 -8.71 23.48 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.729 2.286 . . . . 0.0 112.46 178.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 32.1 t -63.14 -22.67 67.02 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.284 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 11.2 mp -59.29 118.54 6.06 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 175.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -81.02 -178.2 6.78 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 179.494 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 14.0 p -54.63 -42.6 71.4 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.688 0.28 . . . . 0.0 111.201 -178.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 75.6 m80 -68.99 -40.0 79.03 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.886 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 41.5 m-20 -59.8 -51.0 71.62 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 121.07 0.462 . . . . 0.0 110.261 178.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 43.8 mtt180 -64.96 -43.72 91.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.519 -178.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 756' ' ' LEU . . . . . 0.527 ' HB2' " H4'" ' A' ' 801' ' ' DGP . 55.7 tp -54.26 -41.47 68.84 Favored 'General case' 0 C--N 1.33 -0.242 0 O-C-N 123.367 0.417 . . . . 0.0 110.292 177.518 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 757' ' ' ARG . . . . . 0.555 ' HA ' ' HE ' ' A' ' 757' ' ' ARG . 0.7 OUTLIER -60.39 -48.22 82.68 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.065 176.886 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 58.7 t -59.75 -50.18 81.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.022 178.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -55.26 -50.18 70.15 Favored 'General case' 0 C--O 1.226 -0.156 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.557 179.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -63.93 -37.72 88.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.829 -177.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 96.3 mt -69.54 -44.11 80.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 120.8 0.333 . . . . 0.0 110.65 178.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -66.01 -34.98 79.34 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.201 0.525 . . . . 0.0 110.182 177.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 763' ' ' GLU . . . . . 0.47 ' CD ' HN22 ' A' ' 801' ' ' DGP . 38.5 tt0 -66.53 -38.32 86.92 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.41 175.79 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -69.77 -42.81 73.33 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.906 177.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 11.7 m170 -75.24 -29.33 60.19 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.88 -178.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 92.99 43.49 4.1 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.117 178.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 82.8 mt -110.35 -170.16 1.59 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.923 0.392 . . . . 0.0 110.544 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 768' ' ' ARG . . . . . 0.417 ' HD3' ' HB2' ' A' ' 783' ' ' SER . 60.3 ttt-85 -106.67 126.63 52.52 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.822 -179.226 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -139.77 132.44 28.92 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.066 0.46 . . . . 0.0 111.243 -177.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -156.36 138.87 14.94 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.668 -176.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 771' ' ' SER . . . . . 0.402 ' HA ' ' HA ' ' A' ' 780' ' ' ILE . 19.2 m -85.31 135.81 33.75 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.047 0.451 . . . . 0.0 110.191 178.172 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 3.9 m -116.0 124.42 50.45 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.79 -173.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 89.46 175.39 46.07 Favored Glycine 0 N--CA 1.453 -0.212 0 CA-C-N 115.838 -0.619 . . . . 0.0 112.727 178.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 774' ' ' GLU . . . . . 0.418 ' OE1' ' HD2' ' A' ' 778' ' ' ARG . 4.1 mm-40 -135.42 -167.2 1.97 Allowed 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 122.66 0.384 . . . . 0.0 110.117 178.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . 65.48 -132.11 35.24 Favored Glycine 0 N--CA 1.447 -0.597 0 C-N-CA 120.644 -0.789 . . . . 0.0 111.18 -177.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 16.0 pttp -107.36 6.36 28.3 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.133 0.492 . . . . 0.0 110.06 176.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -93.63 -11.04 32.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.657 177.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 778' ' ' ARG . . . . . 0.418 ' HD2' ' OE1' ' A' ' 774' ' ' GLU . 35.1 ttt180 -58.2 122.28 12.77 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.948 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 779' ' ' PHE . . . . . 0.405 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 28.4 p90 -131.46 -171.99 2.74 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 176.657 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 780' ' ' ILE . . . . . 0.402 ' HA ' ' HA ' ' A' ' 771' ' ' SER . 9.8 tt -127.96 131.82 69.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 121.198 0.523 . . . . 0.0 111.238 -177.779 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 13.4 m -113.71 119.22 36.66 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.345 -178.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 43.3 t -102.09 121.15 52.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.007 177.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 783' ' ' SER . . . . . 0.417 ' HB2' ' HD3' ' A' ' 768' ' ' ARG . 4.2 m -109.3 138.96 44.85 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-O 120.738 0.304 . . . . 0.0 110.322 -179.128 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 784' ' ' LYS . . . . . 0.453 ' HG3' ' CZ ' ' A' ' 736' ' ' PHE . 61.4 mtpt -66.95 -51.97 48.65 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.663 178.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 58.7 mmt-85 -118.91 -76.98 0.57 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.357 176.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.288 -0.863 . . . . 0.0 110.064 179.209 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 801' ' ' DGP . . . . . 0.527 " H4'" ' HB2' ' A' ' 756' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo . . . . . 0 N--CA 1.477 0.507 0 N-CA-C 110.293 -0.695 . . . . 0.0 110.293 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 718' ' ' GLU . . . . . 0.419 ' HB3' HG23 ' A' ' 720' ' ' VAL . 5.2 mp0 -105.39 -75.78 0.62 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.49 -175.359 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . 107.28 -12.32 40.15 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.641 -0.79 . . . . 0.0 111.995 179.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 720' ' ' VAL . . . . . 0.419 HG23 ' HB3' ' A' ' 718' ' ' GLU . 22.0 m -90.7 20.7 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.504 -0.348 . . . . 0.0 111.191 -176.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -54.16 -34.34 60.2 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.522 177.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 53.7 m -147.4 93.72 2.28 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.105 175.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -73.77 -72.17 0.28 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.285 178.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -82.53 -86.89 0.1 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.856 176.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . 51.27 45.74 52.17 Favored Glycine 0 C--N 1.333 0.394 0 O-C-N 123.608 0.567 . . . . 0.0 113.259 175.507 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 6.7 p -108.58 112.63 41.2 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.684 0 CA-C-O 121.809 0.814 . . . . 0.0 109.933 -179.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 727' ' ' ASP . . . . . 0.423 ' HB3' ' HB3' ' A' ' 730' ' ' ARG . 3.3 t70 -138.4 154.95 48.9 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 114.777 -1.101 . . . . 0.0 108.606 178.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 15.6 t60 -54.24 -61.42 2.31 Favored 'General case' 0 C--N 1.331 -0.198 0 O-C-N 123.203 0.314 . . . . 0.0 110.63 -177.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -71.21 -33.01 69.52 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.466 -0.333 . . . . 0.0 110.755 -175.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 730' ' ' ARG . . . . . 0.423 ' HB3' ' HB3' ' A' ' 727' ' ' ASP . 10.4 tpt180 -55.31 -47.74 75.16 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.938 0.399 . . . . 0.0 110.355 173.054 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -64.89 -42.34 94.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.43 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 35.6 mmm -60.62 -39.6 88.81 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.011 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 733' ' ' ILE . . . . . 0.421 ' O ' ' HB3' ' A' ' 736' ' ' PHE . 74.3 mt -74.93 -45.45 43.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.781 -178.412 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 11.3 p -66.33 -37.42 79.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 C-N-CA 120.648 -0.421 . . . . 0.0 110.911 -177.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -80.59 -21.6 41.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.752 0.311 . . . . 0.0 110.374 178.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 736' ' ' PHE . . . . . 0.587 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 15.8 t80 -61.16 -46.08 91.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.532 174.015 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 64.7 mtm -60.66 -34.53 74.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.546 178.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -78.86 -29.63 44.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.182 -179.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 68.6 m -73.55 -17.64 61.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.064 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 58.5 mttp 69.99 17.25 7.46 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 173.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 741' ' ' LYS . . . . . 0.46 ' HE2' ' O ' ' A' ' 743' ' ' GLN . 46.1 mtpt -69.7 139.01 53.38 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 172.13 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -73.31 -31.14 63.84 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.854 0.359 . . . . 0.0 110.675 -178.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 743' ' ' GLN . . . . . 0.46 ' O ' ' HE2' ' A' ' 741' ' ' LYS . 54.9 mt-30 -143.73 136.94 27.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.943 -0.572 . . . . 0.0 109.726 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 744' ' ' LEU . . . . . 0.587 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 52.9 tp -112.24 110.74 21.16 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 176.235 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -86.07 108.02 18.08 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.741 178.616 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . 60.6 m-85 -78.97 154.33 77.73 Favored Pre-proline 0 C--N 1.322 -0.623 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.401 177.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 747' ' ' PRO . . . . . 0.442 ' O ' HD12 ' A' ' 750' ' ' LEU . 31.5 Cg_exo -60.4 147.78 92.83 Favored 'Trans proline' 0 CA--C 1.529 0.269 0 C-N-CA 122.689 2.259 . . . . 0.0 112.233 178.029 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -70.73 -7.45 21.37 Favored 'Trans proline' 0 CA--C 1.528 0.187 0 C-N-CA 122.704 2.269 . . . . 0.0 112.689 179.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 24.6 m -71.11 -16.88 62.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.377 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 750' ' ' LEU . . . . . 0.442 HD12 ' O ' ' A' ' 747' ' ' PRO . 10.9 mp -59.97 118.91 6.82 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.096 174.429 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 751' ' ' ASN . . . . . 0.494 ' ND2' ' H ' ' A' ' 753' ' ' HIS . 1.5 p-10 -88.11 -178.69 6.02 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 177.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 19.7 m -53.19 -31.41 42.69 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -176.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 753' ' ' HIS . . . . . 0.494 ' H ' ' ND2' ' A' ' 751' ' ' ASN . 61.8 m170 -79.42 -37.72 36.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.457 0.17 . . . . 0.0 111.124 -179.194 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 754' ' ' ASP . . . . . 0.405 ' HB3' ' HG ' ' A' ' 750' ' ' LEU . 67.6 m-20 -66.43 -44.39 83.02 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.222 0.534 . . . . 0.0 109.758 177.77 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 755' ' ' ARG . . . . . 0.4 ' CB ' " H5'" ' A' ' 801' ' ' DGP . 74.8 mtt180 -60.6 -50.28 74.16 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.179 177.309 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 756' ' ' LEU . . . . . 0.582 ' HB2' " H4'" ' A' ' 801' ' ' DGP . 55.8 tp -54.54 -39.69 67.93 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.702 179.629 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 757' ' ' ARG . . . . . 0.401 ' HB3' ' O ' ' A' ' 754' ' ' ASP . 3.8 tpt180 -55.98 -51.78 66.52 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.202 175.305 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 85.5 t -61.33 -49.22 85.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.974 179.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 89.6 m-70 -53.59 -56.28 18.5 Favored 'General case' 0 N--CA 1.463 0.217 0 O-C-N 123.419 0.449 . . . . 0.0 110.838 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -55.97 -45.24 78.98 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.057 0.392 . . . . 0.0 112.057 -179.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 98.5 mt -66.69 -48.55 79.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.574 0.226 . . . . 0.0 111.069 -178.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -65.44 -32.13 73.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.916 0.389 . . . . 0.0 110.68 -179.029 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -69.74 -33.45 72.47 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.347 178.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -73.46 -35.85 65.77 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.018 176.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 -67.19 -35.98 80.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.682 175.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 102.01 19.02 15.81 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.18 -179.251 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 71.2 mt -92.35 178.48 5.82 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 18.4 ttt180 -96.43 140.04 31.67 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 174.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.1 p80 -145.63 123.31 11.85 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.22 -179.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -151.07 167.52 27.43 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.07 -179.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 15.1 m -108.53 141.67 40.08 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 121.029 0.443 . . . . 0.0 110.745 -177.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 23.8 t -131.28 146.13 52.18 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.855 -178.058 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 80.68 165.34 33.02 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.727 -0.749 . . . . 0.0 111.798 -176.124 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -128.9 166.1 19.77 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.823 0.311 . . . . 0.0 110.414 179.25 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . 68.08 -133.79 29.06 Favored Glycine 0 N--CA 1.445 -0.715 0 C-N-CA 121.085 -0.579 . . . . 0.0 112.047 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp -91.35 8.38 36.39 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.125 0.488 . . . . 0.0 110.475 178.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 58.9 mtm180 -104.81 3.36 31.05 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.266 170.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 778' ' ' ARG . . . . . . . . . . . . . 19.8 ttt180 -80.73 115.45 20.23 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.598 178.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 45.7 p90 -133.8 166.69 22.07 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.406 -0.815 . . . . 0.0 109.794 -177.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 12.2 tt -102.49 132.59 48.24 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-O 121.155 0.503 . . . . 0.0 110.489 -179.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 6.1 m -113.6 118.75 35.27 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.047 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 50.4 t -98.57 130.23 47.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 177.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 8.5 t -122.26 142.26 50.64 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.063 0.459 . . . . 0.0 110.249 -177.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 9.6 mtpm? -78.69 143.41 36.29 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.751 -178.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 16.5 mtm180 -103.83 -4.57 23.39 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.472 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.16 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.164 175.244 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 801' ' ' DGP . . . . . 0.582 " H4'" ' HB2' ' A' ' 756' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_exo . . . . . 0 N--CA 1.479 0.65 0 N-CA-C 110.765 -0.513 . . . . 0.0 110.765 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 62.83 95.63 0.04 OUTLIER 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.472 0.653 . . . . 0.0 111.02 177.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . 105.61 56.75 0.67 Allowed Glycine 0 N--CA 1.444 -0.827 0 N-CA-C 111.12 -0.792 . . . . 0.0 111.12 -175.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 5.3 p -77.51 108.33 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 CA-C-O 121.715 0.769 . . . . 0.0 110.242 -178.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -76.84 93.23 3.7 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.141 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 23.1 t -147.9 120.49 8.56 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.493 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -68.17 -64.44 0.86 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.259 -176.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -71.35 -35.47 71.17 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-O 121.259 0.552 . . . . 0.0 110.124 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . 121.04 -50.38 0.83 Allowed Glycine 0 N--CA 1.444 -0.81 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.586 -179.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 11.2 p -135.62 136.59 50.38 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 CA-C-O 120.975 0.417 . . . . 0.0 110.664 -176.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 727' ' ' ASP . . . . . 0.484 ' HB3' ' HB2' ' A' ' 730' ' ' ARG . 4.5 t70 -64.14 140.37 58.86 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.899 175.553 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 14.3 t60 -61.22 -57.77 11.07 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.621 -172.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -72.35 -22.6 61.13 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.903 -175.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 730' ' ' ARG . . . . . 0.484 ' HB2' ' HB3' ' A' ' 727' ' ' ASP . 0.4 OUTLIER -60.7 -49.59 76.9 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 172.658 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 731' ' ' ALA . . . . . 0.416 ' HA ' HG13 ' A' ' 734' ' ' VAL . . . -59.81 -46.15 90.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.548 178.517 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 35.5 mmm -55.48 -44.55 76.58 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.011 178.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 59.1 mt -77.38 -38.22 26.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.188 -0.46 . . . . 0.0 112.003 -176.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 734' ' ' VAL . . . . . 0.416 HG13 ' HA ' ' A' ' 731' ' ' ALA . 8.8 p -68.01 -36.69 76.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 O-C-N 122.036 -0.415 . . . . 0.0 110.666 -178.724 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -73.47 -31.77 63.96 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 121.153 0.501 . . . . 0.0 109.804 175.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 736' ' ' PHE . . . . . 0.521 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 22.1 t80 -63.46 -40.82 98.15 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.824 175.293 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 737' ' ' MET . . . . . 0.433 ' HE2' ' ND1' ' A' ' 765' ' ' HIS . 73.2 mtm -72.99 -6.86 48.26 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.998 0.428 . . . . 0.0 110.833 177.237 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -103.24 0.46 31.63 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.857 174.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 32.8 t -102.67 169.77 8.43 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.28 -178.168 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 2.6 ptmt -90.9 -6.54 54.01 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.063 -177.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 741' ' ' LYS . . . . . 0.536 ' O ' ' HE2' ' A' ' 784' ' ' LYS . 27.6 mtpp -64.47 126.25 27.23 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.586 177.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 3.2 mpp? -67.73 -30.32 69.77 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.439 176.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -149.17 155.0 39.99 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 120.904 0.383 . . . . 0.0 111.372 176.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 744' ' ' LEU . . . . . 0.521 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 69.0 tp -115.17 111.31 20.8 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.277 -176.841 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -82.72 105.74 13.99 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.417 178.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 746' ' ' PHE . . . . . 0.453 ' O ' ' HB2' ' A' ' 779' ' ' PHE . 71.8 m-85 -79.01 154.81 77.71 Favored Pre-proline 0 C--N 1.325 -0.489 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 176.254 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 747' ' ' PRO . . . . . 0.446 ' O ' HD13 ' A' ' 750' ' ' LEU . 59.6 Cg_endo -76.4 156.39 36.84 Favored 'Trans proline' 0 CA--C 1.533 0.452 0 C-N-CA 122.453 2.102 . . . . 0.0 112.24 178.295 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -68.75 -5.12 14.68 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.959 2.44 . . . . 0.0 113.203 -179.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 4.4 p -69.23 -16.93 63.71 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.86 -178.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 750' ' ' LEU . . . . . 0.446 HD13 ' O ' ' A' ' 747' ' ' PRO . 11.2 mp -63.55 117.98 7.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.337 176.057 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -78.8 -176.95 5.22 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 20.0 t -54.47 -39.51 67.53 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 120.768 0.318 . . . . 0.0 110.871 -177.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 40.1 m80 -73.25 -38.83 65.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.304 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -63.37 -48.1 79.31 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.928 0.394 . . . . 0.0 110.259 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 755' ' ' ARG . . . . . 0.548 ' HB2' H5'' ' A' ' 801' ' ' DGP . 74.0 mtt180 -60.62 -46.77 89.02 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.985 177.518 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 60.9 tp -55.2 -44.38 75.28 Favored 'General case' 0 CA--C 1.523 -0.066 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.727 179.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 757' ' ' ARG . . . . . 0.419 ' HA ' ' HE ' ' A' ' 757' ' ' ARG . 2.6 mmp_? -51.5 -54.82 23.19 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.474 174.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 90.6 t -60.21 -46.79 94.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.495 -178.136 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -56.93 -52.22 66.04 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 110.314 -0.254 . . . . 0.0 110.314 178.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 99.3 mt-30 -56.71 -43.68 80.82 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.462 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 761' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 757' ' ' ARG . 95.4 mt -67.08 -50.06 67.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.257 -178.269 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -62.14 -38.66 89.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.045 0.45 . . . . 0.0 110.523 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -68.03 -30.68 69.97 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.554 178.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -76.49 -42.42 43.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.502 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 765' ' ' HIS . . . . . 0.433 ' ND1' ' HE2' ' A' ' 737' ' ' MET . 38.0 m-70 -75.41 -28.34 59.37 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.956 -179.523 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 103.67 24.42 7.79 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.657 177.411 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 767' ' ' LEU . . . . . 0.424 HD13 ' SD ' ' A' ' 737' ' ' MET . 79.2 mt -96.16 164.34 12.72 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.878 -0.415 . . . . 0.0 109.878 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 37.9 ttp180 -93.63 112.92 24.9 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.953 0.406 . . . . 0.0 110.151 -178.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 2.9 p80 -108.54 124.25 50.17 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.625 -178.229 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -137.7 130.27 29.7 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.298 -179.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 771' ' ' SER . . . . . 0.422 ' HA ' ' HA ' ' A' ' 780' ' ' ILE . 12.5 p -96.07 139.62 31.98 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.794 179.054 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 19.2 m -129.45 141.11 51.1 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.178 -177.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 110.67 176.29 20.61 Favored Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.647 -0.787 . . . . 0.0 111.49 -179.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -124.11 108.97 12.9 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.79 0.295 . . . . 0.0 111.424 -175.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . 54.66 -99.34 0.06 OUTLIER Glycine 0 C--N 1.332 0.347 0 CA-C-N 115.673 -0.694 . . . . 0.0 114.043 174.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 58.7 tptt -60.18 -34.48 73.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.097 0.475 . . . . 0.0 111.151 -178.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 68.4 mtp180 -106.48 20.01 19.64 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.752 -177.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 778' ' ' ARG . . . . . . . . . . . . . 78.9 ttt180 -87.61 122.42 31.27 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.912 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 779' ' ' PHE . . . . . 0.453 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 48.1 p90 -121.77 171.96 8.5 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.157 175.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 780' ' ' ILE . . . . . 0.422 ' HA ' ' HA ' ' A' ' 771' ' ' SER . 12.3 tt -120.68 138.39 51.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 121.063 0.459 . . . . 0.0 110.79 -178.696 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 8.8 m -121.86 120.91 35.92 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.374 -179.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 50.1 t -99.8 115.6 41.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 177.363 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 29.2 t -110.92 136.18 50.34 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 121.266 0.555 . . . . 0.0 110.553 -178.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 784' ' ' LYS . . . . . 0.536 ' HE2' ' O ' ' A' ' 741' ' ' LYS . 52.8 mtmt -80.28 -22.67 41.37 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.136 178.509 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -91.73 109.41 20.73 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.585 -177.828 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.958 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.083 172.912 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 801' ' ' DGP . . . . . 0.548 H5'' ' HB2' ' A' ' 755' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_exo . . . . . 0 N--CA 1.481 0.749 0 N-CA-C 110.48 -0.623 . . . . 0.0 110.48 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -69.36 -39.01 78.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.156 0.503 . . . . 0.0 109.843 178.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . -176.19 144.52 7.06 Favored Glycine 0 N--CA 1.444 -0.784 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.727 177.109 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 40.7 t -94.54 96.25 5.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 175.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -75.67 125.86 29.88 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.578 -172.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 22.8 t -88.02 89.22 7.91 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 172.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -73.72 -64.51 0.98 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.127 -177.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -97.86 105.07 17.15 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 174.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . -116.74 39.91 2.54 Favored Glycine 0 N--CA 1.444 -0.797 0 C-N-CA 120.481 -0.866 . . . . 0.0 112.242 -176.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 3.7 p -119.24 89.87 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.666 0 CA-C-O 122.674 1.225 . . . . 0.0 110.523 -179.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 727' ' ' ASP . . . . . 0.407 ' HB3' ' HB3' ' A' ' 730' ' ' ARG . 17.2 t70 -140.94 133.46 28.53 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 113.76 -1.564 . . . . 0.0 108.428 174.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 13.4 t60 -61.1 -49.2 78.24 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 123.344 0.403 . . . . 0.0 110.793 -173.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -71.97 -38.27 69.76 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.994 -176.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 730' ' ' ARG . . . . . 0.407 ' HB3' ' HB3' ' A' ' 727' ' ' ASP . 42.1 ttt85 -62.54 -38.84 91.58 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.184 176.823 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -64.65 -45.56 86.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.241 176.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 32.9 mmm -58.01 -42.74 85.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.886 177.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 72.8 mt -72.25 -42.92 66.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 N-CA-C 111.908 0.336 . . . . 0.0 111.908 -177.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 8.2 p -65.97 -36.99 78.82 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.576 -178.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -78.21 -24.44 47.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.073 0.463 . . . . 0.0 110.405 177.132 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 736' ' ' PHE . . . . . 0.54 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 34.9 t80 -64.43 -41.59 96.49 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.537 175.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 59.7 mtm -64.02 -28.81 70.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.844 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -85.81 -15.29 42.45 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.229 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 61.6 m -81.33 166.87 20.09 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.45 -179.271 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.98 7.22 44.94 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.924 0.392 . . . . 0.0 111.466 -179.579 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 73.5 mttt -85.22 126.92 34.06 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.024 173.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 95.5 mmm -81.6 -17.88 46.71 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.886 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -138.76 136.21 35.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.684 -178.178 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 744' ' ' LEU . . . . . 0.54 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 44.3 tp -120.17 109.97 16.06 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.096 178.62 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -90.09 113.08 24.75 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.457 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 746' ' ' PHE . . . . . 0.473 ' O ' ' HB2' ' A' ' 779' ' ' PHE . 84.1 m-85 -83.08 153.47 66.59 Favored Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.964 176.338 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 747' ' ' PRO . . . . . 0.441 ' O ' HD13 ' A' ' 750' ' ' LEU . 16.8 Cg_exo -67.18 155.79 69.1 Favored 'Trans proline' 0 CA--C 1.532 0.394 0 C-N-CA 122.508 2.139 . . . . 0.0 112.44 178.445 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -68.19 -7.71 20.73 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.838 2.359 . . . . 0.0 112.394 177.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 7.3 m -63.89 -20.25 65.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.552 179.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 750' ' ' LEU . . . . . 0.441 HD13 ' O ' ' A' ' 747' ' ' PRO . 11.2 mp -63.34 122.74 16.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.352 176.445 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 1.6 p30 -84.42 -178.61 6.96 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 15.2 m -48.55 -46.57 39.11 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 123.166 0.291 . . . . 0.0 111.381 179.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 50.9 m80 -72.03 -36.9 69.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.636 -178.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 -60.36 -50.67 72.69 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.133 0.492 . . . . 0.0 109.801 178.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 62.8 mtt85 -61.0 -45.15 95.98 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.181 178.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 756' ' ' LEU . . . . . 0.538 ' HB2' " H4'" ' A' ' 801' ' ' DGP . 53.4 tp -52.98 -42.81 65.89 Favored 'General case' 0 C--O 1.235 0.334 0 O-C-N 123.535 0.522 . . . . 0.0 111.03 -179.685 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 11.0 mmm180 -58.83 -53.69 55.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.017 176.168 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 60.9 t -56.79 -48.68 80.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.401 -179.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -55.28 -55.3 33.01 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.596 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 70.3 mt-30 -64.47 -33.37 75.73 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 -176.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 96.9 mt -70.14 -48.64 60.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 C-N-CA 120.894 -0.323 . . . . 0.0 110.464 178.057 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -63.49 -34.6 78.13 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.167 0.508 . . . . 0.0 110.28 177.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 763' ' ' GLU . . . . . 0.461 ' CD ' HN22 ' A' ' 801' ' ' DGP . 38.2 tt0 -64.28 -36.7 84.94 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.652 176.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -70.02 -46.54 64.85 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.189 176.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 11.2 m-70 -65.15 -30.12 71.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.108 -178.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 95.01 25.18 15.03 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.767 -0.73 . . . . 0.0 111.825 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 68.1 mt -99.3 176.93 5.36 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 22.6 ttp180 -99.66 135.29 41.29 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -132.69 127.69 35.33 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.189 0.518 . . . . 0.0 110.691 -178.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -133.85 143.12 48.12 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.98 -177.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 12.7 p -114.29 127.88 56.09 Favored 'General case' 0 C--N 1.317 -0.848 0 CA-C-O 121.275 0.56 . . . . 0.0 110.296 175.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -152.32 157.87 41.96 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.113 -174.204 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 128.85 159.9 10.11 Favored Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 111.382 -0.687 . . . . 0.0 111.382 -177.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -81.31 92.0 6.31 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -175.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . 56.25 -92.28 0.02 OUTLIER Glycine 0 C--N 1.334 0.424 0 O-C-N 123.68 0.613 . . . . 0.0 113.881 172.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . 0.494 ' HD2' ' H ' ' A' ' 776' ' ' LYS . 10.9 mptt -65.09 -34.44 78.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.282 0.563 . . . . 0.0 109.551 179.557 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.78 16.64 10.39 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.985 -178.604 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 778' ' ' ARG . . . . . . . . . . . . . 67.7 ttt180 -76.79 116.59 17.6 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 121.525 0.678 . . . . 0.0 110.13 177.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 779' ' ' PHE . . . . . 0.473 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 44.4 p90 -122.85 -172.01 2.4 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.208 -0.906 . . . . 0.0 109.833 -178.312 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 12.6 tt -127.5 133.82 66.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-O 120.984 0.421 . . . . 0.0 110.773 -178.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 24.7 m -119.71 116.01 25.08 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.415 -179.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 38.0 t -94.36 133.88 33.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.872 179.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -117.02 135.03 54.01 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.764 0.316 . . . . 0.0 111.16 -179.421 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 23.2 mtpp -66.16 147.15 53.77 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.171 175.267 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 785' ' ' ARG . . . . . 0.472 ' HA ' ' NE ' ' A' ' 785' ' ' ARG . 4.2 mmp_? -133.1 118.37 18.65 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.586 -176.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.973 0 CA-C-O 118.703 -0.665 . . . . 0.0 110.255 -178.884 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 801' ' ' DGP . . . . . 0.538 " H4'" ' HB2' ' A' ' 756' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo . . . . . 0 N--CA 1.478 0.567 0 N-CA-C 110.133 -0.756 . . . . 0.0 110.133 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -108.92 125.67 52.26 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.967 0.413 . . . . 0.0 110.49 -176.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . 172.05 139.75 2.9 Favored Glycine 0 N--CA 1.443 -0.849 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.709 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 16.4 t 58.59 67.3 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.651 0.739 . . . . 0.0 110.363 -178.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -97.34 70.26 2.3 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.791 0.805 . . . . 0.0 109.512 178.202 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 7.6 m -69.33 97.49 0.96 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.012 -0.994 . . . . 0.0 111.415 -174.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 92.4 mt-30 -129.99 -52.38 1.13 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.042 175.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -82.78 67.62 8.92 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.688 0.756 . . . . 0.0 110.415 175.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . -162.6 36.76 0.35 Allowed Glycine 0 N--CA 1.441 -1.0 0 CA-C-N 114.942 -1.027 . . . . 0.0 110.87 178.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 3.1 p -111.61 92.54 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.791 0 CA-C-O 122.415 1.103 . . . . 0.0 109.906 -177.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 727' ' ' ASP . . . . . 0.461 ' HB3' ' HB3' ' A' ' 730' ' ' ARG . 5.7 t70 -140.06 133.77 30.43 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 113.839 -1.528 . . . . 0.0 108.17 179.541 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 30.6 t60 -55.4 -43.95 75.72 Favored 'General case' 0 C--N 1.327 -0.411 0 O-C-N 123.366 0.416 . . . . 0.0 111.359 -173.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 729' ' ' PHE . . . . . 0.467 ' CZ ' ' HB3' ' A' ' 754' ' ' ASP . 55.6 m-85 -80.98 -36.47 30.69 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.679 -175.769 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 730' ' ' ARG . . . . . 0.461 ' HB3' ' HB3' ' A' ' 727' ' ' ASP . 15.2 tpp85 -56.95 -43.72 81.86 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 174.427 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -64.63 -47.46 78.45 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.239 -179.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 4.5 mtm -65.78 -35.52 80.95 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.164 -178.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 733' ' ' ILE . . . . . 0.417 HD12 HG12 ' A' ' 758' ' ' VAL . 81.2 mt -73.27 -42.78 57.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.581 -0.282 . . . . 0.0 111.535 179.392 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 9.1 p -66.06 -37.53 79.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 120.594 -0.442 . . . . 0.0 110.975 -176.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -75.14 -29.3 60.45 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.881 0.372 . . . . 0.0 110.251 176.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 736' ' ' PHE . . . . . 0.524 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 36.1 t80 -61.8 -40.11 94.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.1 176.535 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 49.1 mtm -62.46 -33.19 74.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.788 178.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -92.08 3.58 54.98 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.069 -178.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 22.8 t -97.44 166.99 11.27 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -88.72 -1.17 57.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.79 0.329 . . . . 0.0 111.132 -178.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 741' ' ' LYS . . . . . 0.511 ' O ' ' HE2' ' A' ' 784' ' ' LYS . 97.0 mttt -66.64 133.13 49.62 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 173.69 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 27.2 ptt? -88.26 -23.2 23.57 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 178.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -141.73 140.46 33.13 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.19 -179.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 744' ' ' LEU . . . . . 0.524 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 57.0 tp -118.76 103.65 9.85 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.353 177.437 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -87.69 109.22 19.53 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.855 179.295 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -77.01 148.3 78.41 Favored Pre-proline 0 C--N 1.321 -0.669 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.36 178.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -62.66 151.14 85.24 Favored 'Trans proline' 0 CA--C 1.529 0.263 0 C-N-CA 122.711 2.274 . . . . 0.0 112.237 179.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -65.76 -7.4 16.46 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.781 2.321 . . . . 0.0 112.619 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 41.6 t -68.63 -17.64 64.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.953 178.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.1 mp -66.07 110.69 3.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.919 173.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -82.08 -176.93 6.4 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 175.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 14.6 m -49.59 -48.56 48.75 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -174.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 753' ' ' HIS . . . . . 0.447 ' O ' ' HG2' ' A' ' 757' ' ' ARG . 37.4 t-80 -56.73 -46.84 81.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.508 178.099 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 754' ' ' ASP . . . . . 0.467 ' HB3' ' CZ ' ' A' ' 729' ' ' PHE . 58.9 m-20 -65.34 -46.63 79.48 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.803 -176.021 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 755' ' ' ARG . . . . . 0.512 ' HB2' H5'' ' A' ' 801' ' ' DGP . 80.8 mtt180 -59.66 -45.64 91.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.672 177.385 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 756' ' ' LEU . . . . . 0.549 HD21 " H1'" ' A' ' 801' ' ' DGP . 3.2 tm? -54.75 -45.82 74.21 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.768 179.173 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 757' ' ' ARG . . . . . 0.447 ' HG2' ' O ' ' A' ' 753' ' ' HIS . 31.1 mmm180 -54.69 -50.34 68.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.213 -0.448 . . . . 0.0 109.868 177.332 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 758' ' ' VAL . . . . . 0.417 HG12 HD12 ' A' ' 733' ' ' ILE . 73.6 t -59.24 -48.0 88.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.01 178.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 88.4 m-70 -54.74 -58.83 5.97 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.444 -0.343 . . . . 0.0 110.87 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -60.05 -36.23 76.85 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -177.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 91.5 mt -70.78 -48.43 57.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 C-N-CA 121.123 -0.231 . . . . 0.0 111.133 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -65.45 -34.32 78.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.208 0.528 . . . . 0.0 110.273 179.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 763' ' ' GLU . . . . . 0.469 ' CD ' HN22 ' A' ' 801' ' ' DGP . 35.2 tt0 -63.5 -37.27 86.66 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.241 176.337 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -74.0 -39.44 63.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.557 178.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 10.4 m170 -69.7 -22.18 63.43 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.36 179.369 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 89.37 23.39 34.35 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.112 179.047 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 72.2 mt -93.26 -179.38 5.05 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 -179.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 61.2 ttp180 -104.68 127.97 52.6 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 177.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 5.5 p80 -135.27 130.0 34.46 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.024 0.44 . . . . 0.0 110.681 -176.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -149.08 155.67 41.08 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.276 -178.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 15.8 m -103.81 146.75 28.18 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.724 -177.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 23.0 t -134.01 145.88 49.89 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 179.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 99.5 -174.88 27.51 Favored Glycine 0 N--CA 1.446 -0.633 0 C-N-CA 120.54 -0.838 . . . . 0.0 111.77 -178.288 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -136.07 132.81 36.64 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.452 0.168 . . . . 0.0 111.162 -176.037 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . 63.14 -116.42 9.32 Favored Glycine 0 C--N 1.331 0.272 0 CA-C-N 116.014 -0.539 . . . . 0.0 113.447 173.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -82.59 -15.55 51.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.847 0.356 . . . . 0.0 110.864 -178.332 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 83.6 mtt180 -96.5 12.3 31.98 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.81 175.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 778' ' ' ARG . . . . . . . . . . . . . 59.7 ttt180 -85.82 120.49 27.3 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.153 176.318 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 40.7 p90 -120.59 178.46 4.67 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.402 -0.817 . . . . 0.0 109.473 178.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 11.5 tt -125.41 135.02 65.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-O 121.076 0.465 . . . . 0.0 110.678 -178.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 25.0 m -119.3 120.64 37.56 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.406 -179.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 46.9 t -101.13 133.73 43.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.967 178.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 48.4 t -121.26 140.48 51.99 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 784' ' ' LYS . . . . . 0.511 ' HE2' ' O ' ' A' ' 741' ' ' LYS . 51.3 mtmt -75.06 143.73 43.33 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.614 -178.139 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -107.29 89.7 3.08 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.13 179.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.471 -0.776 . . . . 0.0 110.301 -177.859 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 801' ' ' DGP . . . . . 0.549 " H1'" HD21 ' A' ' 756' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_endo . . . . . 0 N--CA 1.48 0.724 0 N-CA-C 110.549 -0.597 . . . . 0.0 110.549 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -77.13 149.53 35.65 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.172 -178.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . 117.77 20.7 4.48 Favored Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 120.719 -0.753 . . . . 0.0 111.604 -175.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 34.6 m -69.73 -20.04 23.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-O 121.191 0.519 . . . . 0.0 110.595 -179.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -84.77 85.37 7.46 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 175.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 6.8 m -107.3 98.01 7.69 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.275 -174.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -128.4 135.79 50.01 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.757 0.313 . . . . 0.0 110.511 175.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -74.79 -70.29 0.42 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.991 -0.549 . . . . 0.0 109.801 175.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . -115.66 -118.84 3.18 Favored Glycine 0 N--CA 1.444 -0.8 0 N-CA-C 110.154 -1.178 . . . . 0.0 110.154 171.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 8.7 p -163.89 119.97 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 121.611 0.72 . . . . 0.0 110.412 172.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 727' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -84.3 150.11 25.62 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.066 179.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 48.1 t60 -52.77 -54.28 36.14 Favored 'General case' 0 C--N 1.331 -0.237 0 O-C-N 123.374 0.421 . . . . 0.0 111.062 -178.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 29.9 m-85 -72.9 -30.74 64.16 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.46 -175.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 16.6 tpp85 -61.63 -45.91 92.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.088 173.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -62.24 -46.72 87.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.95 179.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 22.7 mmm -62.11 -39.44 92.54 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.313 -179.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 733' ' ' ILE . . . . . 0.422 ' O ' ' HG3' ' A' ' 737' ' ' MET . 57.9 mt -75.84 -41.33 39.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -178.371 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 8.4 p -66.82 -34.08 67.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 C-N-CA 120.936 -0.305 . . . . 0.0 111.066 -177.605 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 61.7 mt-10 -76.97 -31.54 56.62 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.011 0.434 . . . . 0.0 110.087 175.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 736' ' ' PHE . . . . . 0.451 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 37.6 t80 -63.03 -37.29 86.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.522 178.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 737' ' ' MET . . . . . 0.422 ' HG3' ' O ' ' A' ' 733' ' ' ILE . 52.3 mtm -61.84 -26.51 68.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.944 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -101.65 4.08 40.44 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.122 0.486 . . . . 0.0 111.088 -178.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 40.2 t -88.99 166.63 13.78 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.974 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 30.2 mtpp -87.33 -10.37 52.4 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.861 0.362 . . . . 0.0 110.398 178.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 29.3 mtpp -67.6 124.46 23.32 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.269 177.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 22.9 ptp -75.37 -27.23 59.06 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.492 178.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -137.69 136.53 37.49 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.402 -178.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 744' ' ' LEU . . . . . 0.451 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 34.5 tp -106.89 104.99 14.8 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.19 -0.671 . . . . 0.0 109.19 176.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -87.76 104.6 16.71 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.979 -178.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -78.41 155.01 79.28 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.351 179.055 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_exo -70.04 152.69 67.96 Favored 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 122.358 2.039 . . . . 0.0 111.892 176.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -65.83 -4.53 10.13 Favored 'Trans proline' 0 CA--C 1.529 0.244 0 C-N-CA 122.897 2.398 . . . . 0.0 112.394 178.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 11.6 m -67.57 -18.35 64.98 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.065 177.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 11.0 mp -70.4 109.29 4.68 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.983 -0.376 . . . . 0.0 109.983 175.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -78.2 -178.03 5.43 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 -179.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 20.0 m -52.85 -41.05 63.91 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 111.64 0.237 . . . . 0.0 111.64 -178.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 65.5 m170 -68.93 -44.35 73.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.499 0.19 . . . . 0.0 110.97 179.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -58.28 -49.01 78.64 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.156 0.503 . . . . 0.0 110.143 177.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 755' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 755' ' ' ARG . 24.0 mtm180 -63.72 -43.3 96.96 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.833 -179.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 756' ' ' LEU . . . . . 0.551 ' HB2' " H4'" ' A' ' 801' ' ' DGP . 54.4 tp -54.91 -42.35 72.08 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.872 0.367 . . . . 0.0 111.024 179.273 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 757' ' ' ARG . . . . . 0.419 ' NE ' ' HA ' ' A' ' 757' ' ' ARG . 1.9 mmp_? -62.9 -47.07 84.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.519 176.233 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 758' ' ' VAL . . . . . 0.449 ' CG1' HD11 ' A' ' 780' ' ' ILE . 99.7 t -59.5 -48.05 88.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.895 179.341 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 88.6 m-70 -55.27 -55.41 31.68 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 120.843 0.354 . . . . 0.0 110.438 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -62.43 -38.61 90.4 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.962 -178.223 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 85.2 mt -67.43 -44.97 86.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 C-N-CA 121.144 -0.222 . . . . 0.0 111.081 178.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -65.9 -36.91 84.7 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.18 0.514 . . . . 0.0 110.353 178.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -67.07 -33.38 75.37 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.825 175.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -71.5 -40.18 70.34 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.593 178.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -71.86 -30.66 65.67 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.136 176.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 96.15 31.97 6.98 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.717 -0.754 . . . . 0.0 111.945 -179.12 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 61.5 mt -104.75 -178.96 3.81 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 768' ' ' ARG . . . . . 0.494 ' HD3' ' O ' ' A' ' 786' ' ' ALA . 50.6 ttt180 -100.6 142.85 31.5 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 177.276 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.7 p80 -149.17 141.64 24.29 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.861 0.362 . . . . 0.0 110.785 -178.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -160.14 152.42 20.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.696 179.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 6.4 m -95.92 136.92 35.72 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.25 0.547 . . . . 0.0 110.904 -177.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 772' ' ' SER . . . . . 0.524 ' O ' ' HA ' ' A' ' 778' ' ' ARG . 46.8 t -114.99 144.21 43.96 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.419 -179.46 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 95.56 168.86 35.55 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.651 -0.785 . . . . 0.0 111.988 -177.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 774' ' ' GLU . . . . . 0.43 ' O ' ' HD2' ' A' ' 778' ' ' ARG . 26.1 mt-10 -87.73 -77.48 0.34 Allowed 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 -177.309 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . -125.32 -76.37 0.27 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.58 -176.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 53.2 mttp -70.89 -31.18 67.76 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.992 0.425 . . . . 0.0 110.023 178.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -83.06 -3.05 56.87 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.638 176.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 778' ' ' ARG . . . . . 0.524 ' HA ' ' O ' ' A' ' 772' ' ' SER . 30.9 ttt85 -78.36 115.18 17.89 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.721 0.772 . . . . 0.0 111.75 -174.363 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 49.9 p90 -128.86 -176.68 3.93 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 114.569 -1.196 . . . . 0.0 108.498 176.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 780' ' ' ILE . . . . . 0.449 HD11 ' CG1' ' A' ' 758' ' ' VAL . 17.1 tt -118.04 140.12 42.58 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 C-N-CA 120.405 -0.518 . . . . 0.0 110.905 -179.02 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 25.1 m -121.64 117.98 28.05 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.883 -0.598 . . . . 0.0 109.944 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 22.1 t -100.95 133.95 42.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 179.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 20.0 p -124.09 143.09 50.66 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.391 0.615 . . . . 0.0 110.964 178.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 56.2 mtpt -69.13 -50.52 47.18 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.421 -177.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 24.2 mmm180 -118.86 -59.22 1.88 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.379 -176.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 786' ' ' ALA . . . . . 0.494 ' O ' ' HD3' ' A' ' 768' ' ' ARG . . . . . . . . 0 C--O 1.245 0.862 0 CA-C-O 118.345 -0.836 . . . . 0.0 110.218 -179.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 801' ' ' DGP . . . . . 0.551 " H4'" ' HB2' ' A' ' 756' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo . . . . . 0 N--CA 1.475 0.436 0 N-CA-C 110.4 -0.654 . . . . 0.0 110.4 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -105.2 -77.79 0.58 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.272 0.558 . . . . 0.0 110.076 -179.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . -178.61 152.16 11.14 Favored Glycine 0 N--CA 1.446 -0.677 0 N-CA-C 110.598 -1.001 . . . . 0.0 110.598 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 35.5 m -107.82 -15.08 9.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 117.217 0.508 . . . . 0.0 110.802 -177.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -71.74 -10.04 59.18 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.259 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 13.5 m -67.45 -17.57 64.75 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.823 178.043 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -139.97 -174.25 3.87 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.07 177.49 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -90.26 -4.57 57.09 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.227 0.537 . . . . 0.0 109.573 173.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . 91.82 -26.84 11.18 Favored Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 110.37 -1.092 . . . . 0.0 110.37 -170.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 27.9 t -106.91 91.49 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.654 0 CA-C-O 121.357 0.599 . . . . 0.0 110.098 176.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 727' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -84.94 152.27 23.63 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 170.302 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 728' ' ' HIS . . . . . 0.517 ' O ' ' HG3' ' A' ' 732' ' ' MET . 14.0 t60 -53.81 -50.91 65.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.094 0.473 . . . . 0.0 110.155 -176.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -77.88 -29.9 50.53 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.857 -176.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 44.6 ttm-85 -66.06 -37.88 86.93 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 176.416 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -65.84 -41.34 91.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.397 176.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 732' ' ' MET . . . . . 0.517 ' HG3' ' O ' ' A' ' 728' ' ' HIS . 93.5 mtp -63.81 -42.47 97.68 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.428 178.356 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 59.5 mt -71.51 -42.25 72.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.172 -0.467 . . . . 0.0 112.023 -178.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 11.4 p -65.3 -41.31 91.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 C-N-CA 120.784 -0.366 . . . . 0.0 111.162 -176.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -70.85 -33.09 70.29 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.963 0.411 . . . . 0.0 110.291 176.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 736' ' ' PHE . . . . . 0.486 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 11.7 t80 -59.97 -36.99 78.32 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.013 176.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 737' ' ' MET . . . . . 0.581 ' HA ' ' HD3' ' A' ' 784' ' ' LYS . 69.9 mtm -64.16 -32.28 73.8 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.62 177.689 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -92.4 9.12 35.55 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.791 0.329 . . . . 0.0 111.1 178.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 55.7 m -101.02 167.37 10.29 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.762 0.315 . . . . 0.0 110.87 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 740' ' ' LYS . . . . . 0.468 ' HZ1' ' HB2' ' A' ' 740' ' ' LYS . 0.1 OUTLIER -73.9 -30.02 62.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.179 -179.241 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -58.38 127.9 34.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.768 178.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 69.9 mtm -95.93 -10.62 28.26 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.84 0.353 . . . . 0.0 110.626 178.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -139.67 126.85 21.17 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.063 174.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 744' ' ' LEU . . . . . 0.486 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 48.0 tp -102.1 105.69 16.45 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -87.25 105.68 17.39 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.744 178.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 746' ' ' PHE . . . . . 0.421 ' HA ' ' HD3' ' A' ' 747' ' ' PRO . 70.6 m-85 -76.04 146.07 78.27 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.821 -178.493 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 747' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 746' ' ' PHE . 33.1 Cg_exo -62.38 152.36 77.33 Favored 'Trans proline' 0 C--O 1.234 0.285 0 C-N-CA 122.971 2.448 . . . . 0.0 112.51 177.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -65.84 -3.93 9.08 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 123.143 2.562 . . . . 0.0 112.62 177.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 13.8 m -66.56 -25.16 66.51 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.721 176.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.1 mp -71.35 112.27 7.35 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.221 176.336 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 751' ' ' ASN . . . . . 0.432 ' O ' ' HG3' ' A' ' 755' ' ' ARG . 1.6 p-10 -86.31 -177.59 6.26 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 178.237 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 10.8 m -52.18 -45.46 65.13 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 112.592 0.589 . . . . 0.0 112.592 -170.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 33.2 m170 -66.7 -40.35 88.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.653 0.263 . . . . 0.0 111.62 -179.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -67.23 -41.56 85.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.926 0.393 . . . . 0.0 110.55 178.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 755' ' ' ARG . . . . . 0.432 ' HG3' ' O ' ' A' ' 751' ' ' ASN . 43.7 mtm-85 -64.35 -39.28 93.58 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.945 177.789 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 756' ' ' LEU . . . . . 0.443 ' CD1' " H1'" ' A' ' 801' ' ' DGP . 62.9 tp -54.34 -45.23 72.65 Favored 'General case' 0 C--N 1.332 -0.191 0 O-C-N 123.474 0.484 . . . . 0.0 110.855 176.29 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 7.7 mmt85 -55.41 -50.06 70.76 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.484 175.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 84.8 t -58.58 -48.32 85.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.02 179.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -56.28 -52.32 64.95 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.707 179.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -60.36 -41.7 94.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.753 -177.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 95.0 mt -68.82 -46.79 78.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.192 -179.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -63.54 -35.63 81.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.319 0.581 . . . . 0.0 110.021 178.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 763' ' ' GLU . . . . . 0.434 ' CD ' HN22 ' A' ' 801' ' ' DGP . 39.7 tt0 -63.5 -39.86 95.56 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.361 176.524 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -68.3 -44.75 74.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.839 178.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 27.1 m-70 -73.98 -21.44 60.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.61 -176.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 90.3 39.41 6.03 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.251 177.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 64.6 mt -111.12 169.62 8.65 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 178.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 37.3 ttm180 -90.05 132.08 35.58 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 177.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.8 p80 -138.82 136.63 35.83 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 120.726 0.298 . . . . 0.0 110.482 -177.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -162.4 147.67 12.53 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.523 177.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 771' ' ' SER . . . . . 0.444 ' HA ' ' HA ' ' A' ' 780' ' ' ILE . 9.7 m -109.74 138.97 45.34 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.263 178.154 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 6.2 t -122.16 154.23 37.71 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 -178.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 87.22 -174.08 45.07 Favored Glycine 0 N--CA 1.445 -0.738 0 C-N-CA 120.589 -0.815 . . . . 0.0 112.001 -177.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -146.45 170.27 17.2 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.842 0.354 . . . . 0.0 110.852 178.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . 62.8 -133.51 43.91 Favored Glycine 0 N--CA 1.448 -0.554 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.684 178.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -84.72 -1.97 56.95 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.705 0.288 . . . . 0.0 110.754 -176.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 -113.17 12.14 18.97 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.109 -179.446 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 778' ' ' ARG . . . . . . . . . . . . . 35.7 ttt180 -81.68 112.97 19.34 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 121.169 0.509 . . . . 0.0 109.96 173.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 50.8 p90 -118.76 160.4 21.95 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.858 -176.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 780' ' ' ILE . . . . . 0.444 ' HA ' ' HA ' ' A' ' 771' ' ' SER . 11.9 tt -114.77 133.65 60.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-O 121.184 0.516 . . . . 0.0 111.039 -176.595 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 34.5 m -115.6 124.03 49.92 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.328 178.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 59.1 t -103.61 119.7 52.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.692 176.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 13.9 m -113.41 133.64 55.07 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 121.049 0.452 . . . . 0.0 111.011 -176.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 784' ' ' LYS . . . . . 0.581 ' HD3' ' HA ' ' A' ' 737' ' ' MET . 56.8 mtmt -81.75 -7.92 59.64 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.83 0.824 . . . . 0.0 110.354 177.173 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 785' ' ' ARG . . . . . 0.632 ' HA ' ' NE ' ' A' ' 785' ' ' ARG . 3.2 mmp_? -92.29 84.75 5.24 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 114.872 -1.058 . . . . 0.0 109.436 172.231 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.954 0 CA-C-O 118.387 -0.816 . . . . 0.0 110.522 -177.509 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 801' ' ' DGP . . . . . 0.443 " H1'" ' CD1' ' A' ' 756' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo . . . . . 0 N--CA 1.478 0.586 0 N-CA-C 110.918 -0.455 . . . . 0.0 110.918 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -129.03 178.95 6.03 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.876 178.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . 84.15 30.04 29.4 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.726 -0.749 . . . . 0.0 111.456 -177.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 45.0 t -83.58 -37.74 13.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.164 0.507 . . . . 0.0 110.303 -178.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -78.69 141.69 37.73 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.358 -179.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 14.6 m -96.89 -33.08 11.75 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.5 -178.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -101.63 112.15 24.63 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 178.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -67.57 -2.48 6.72 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -171.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . 89.51 79.79 1.33 Allowed Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 120.556 -0.831 . . . . 0.0 112.188 176.121 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 5.8 p -130.63 121.39 50.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.378 0.609 . . . . 0.0 110.955 -178.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 727' ' ' ASP . . . . . 0.411 ' HB2' ' HB2' ' A' ' 730' ' ' ARG . 4.1 m-20 -81.34 151.62 27.91 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.044 172.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 46.0 t60 -54.24 -48.11 71.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.294 0.569 . . . . 0.0 109.532 176.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -72.06 -26.09 62.04 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.261 -177.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 730' ' ' ARG . . . . . 0.411 ' HB2' ' HB2' ' A' ' 727' ' ' ASP . 12.0 tpt180 -65.77 -42.66 90.58 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 176.628 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -68.17 -46.05 71.77 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.629 177.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 35.5 mmm -56.96 -45.12 83.07 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.285 178.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 38.7 mt -67.28 -44.69 87.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.891 -177.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 12.4 p -66.75 -36.12 76.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 C-N-CA 120.298 -0.561 . . . . 0.0 111.015 -177.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -71.88 -28.22 63.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.148 0.499 . . . . 0.0 110.402 176.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 736' ' ' PHE . . . . . 0.416 ' CE2' ' HG3' ' A' ' 784' ' ' LYS . 23.4 t80 -71.18 -40.55 71.19 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.287 174.398 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 87.2 mtp -62.37 -41.68 98.81 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.099 179.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -80.88 -6.05 58.15 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.278 -179.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 14.7 t -92.91 167.33 11.9 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.593 -177.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -75.47 -9.68 58.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.817 178.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 741' ' ' LYS . . . . . 0.449 ' O ' ' HD3' ' A' ' 784' ' ' LYS . 61.9 mttp -61.35 133.6 56.01 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.538 -178.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 62.7 mtt -99.94 -17.36 17.6 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.076 177.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -144.71 140.53 28.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.155 175.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 744' ' ' LEU . . . . . 0.496 HD13 ' CZ ' ' A' ' 746' ' ' PHE . 0.8 OUTLIER -113.65 108.43 17.12 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 -179.935 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -85.63 96.35 9.64 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.439 176.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 746' ' ' PHE . . . . . 0.496 ' CZ ' HD13 ' A' ' 744' ' ' LEU . 61.1 m-85 -71.12 146.84 93.08 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.28 177.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -65.92 150.89 85.35 Favored 'Trans proline' 0 CA--C 1.529 0.247 0 C-N-CA 122.637 2.224 . . . . 0.0 112.509 -179.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -63.74 -6.22 10.33 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.845 2.363 . . . . 0.0 112.362 175.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 34.4 t -61.4 -25.18 67.02 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.077 174.155 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.1 mp -65.2 109.44 2.21 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.816 176.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -80.06 -177.37 6.0 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 173.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 20.0 m -57.68 -43.71 85.25 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -171.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 35.0 m80 -63.92 -39.82 95.04 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 120.954 0.406 . . . . 0.0 110.774 179.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -63.03 -49.03 76.2 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.706 178.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 755' ' ' ARG . . . . . 0.543 ' CB ' " H5'" ' A' ' 801' ' ' DGP . 63.8 mtt85 -57.6 -49.29 76.89 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.549 177.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 756' ' ' LEU . . . . . 0.512 ' HB2' " H4'" ' A' ' 801' ' ' DGP . 60.5 tp -54.72 -39.73 68.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.303 -179.009 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 23.8 tpt180 -65.04 -39.19 92.99 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.055 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 96.3 t -64.4 -50.98 73.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.752 176.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -53.8 -48.81 69.48 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 123.453 0.47 . . . . 0.0 110.243 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 760' ' ' GLN . . . . . 0.407 ' NE2' ' HG ' ' A' ' 756' ' ' LEU . 69.9 mt-30 -50.96 -51.27 54.19 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.888 176.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 88.5 mt -69.98 -42.33 79.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.439 -174.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -66.21 -38.16 87.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.075 0.464 . . . . 0.0 110.453 179.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 763' ' ' GLU . . . . . 0.502 ' CD ' HN22 ' A' ' 801' ' ' DGP . 29.7 tt0 -67.05 -36.64 82.5 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.127 177.706 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -65.76 -49.28 68.93 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.533 176.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 13.8 m170 -69.8 -29.42 66.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.636 -175.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 100.67 36.14 4.11 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.457 -0.877 . . . . 0.0 112.451 177.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 63.9 mt -111.85 170.64 8.01 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 32.5 ttp180 -89.89 136.52 32.99 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 178.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 5.5 p80 -137.45 121.95 18.39 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-O 121.464 0.65 . . . . 0.0 110.499 -179.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -144.1 153.76 42.49 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.239 -0.892 . . . . 0.0 109.971 -178.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 10.7 m -109.97 139.71 44.77 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.041 0.448 . . . . 0.0 110.57 -179.1 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 35.6 m -139.27 149.3 44.13 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.022 -177.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 134.41 177.46 14.96 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.596 -0.812 . . . . 0.0 111.923 178.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -105.64 107.55 18.6 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 -175.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . 59.42 -105.03 0.63 Allowed Glycine 0 N--CA 1.453 -0.168 0 CA-C-N 115.905 -0.589 . . . . 0.0 113.489 174.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -78.5 -23.72 46.23 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.015 0.436 . . . . 0.0 110.785 -178.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 61.1 mtp180 -85.71 13.44 7.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.023 0.439 . . . . 0.0 110.218 178.022 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 778' ' ' ARG . . . . . . . . . . . . . 50.4 ttt180 -72.61 116.96 13.7 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.964 175.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 44.1 p90 -118.92 165.27 14.28 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.781 -177.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 12.8 tt -104.09 133.82 47.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-O 121.163 0.506 . . . . 0.0 110.562 -178.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 781' ' ' THR . . . . . 0.448 ' HA ' ' O ' ' A' ' 744' ' ' LEU . 17.7 m -118.1 112.55 20.36 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.263 179.687 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 45.3 t -90.91 130.51 39.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 177.076 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 12.8 t -125.3 141.54 52.02 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.444 0.64 . . . . 0.0 111.492 -175.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 784' ' ' LYS . . . . . 0.449 ' HD3' ' O ' ' A' ' 741' ' ' LYS . 55.4 mtpt -92.68 -15.01 27.26 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-O 122.392 1.092 . . . . 0.0 108.7 175.517 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -99.89 111.27 23.59 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 113.473 -1.694 . . . . 0.0 111.016 -173.051 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.492 -0.766 . . . . 0.0 109.337 172.993 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 801' ' ' DGP . . . . . 0.543 " H5'" ' CB ' ' A' ' 755' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo . . . . . 0 N--CA 1.476 0.474 0 N-CA-C 110.796 -0.501 . . . . 0.0 110.796 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -71.82 -43.05 66.24 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 177.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . 81.73 30.77 34.76 Favored Glycine 0 N--CA 1.446 -0.657 0 CA-C-N 115.533 -0.758 . . . . 0.0 112.656 179.23 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 23.2 t -107.06 78.76 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.11 0.481 . . . . 0.0 110.032 179.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -97.54 -30.22 13.0 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.742 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 17.4 m -79.91 96.05 6.26 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 177.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 16.7 tm0? -75.0 -50.5 16.33 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.495 -174.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -110.78 88.44 2.78 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.297 0.57 . . . . 0.0 110.224 -178.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . -140.66 49.51 0.78 Allowed Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 111.023 -0.831 . . . . 0.0 111.023 178.182 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 44.1 t -113.15 108.19 24.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.901 0.381 . . . . 0.0 110.072 -175.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 727' ' ' ASP . . . . . 0.409 ' HB3' ' HB3' ' A' ' 730' ' ' ARG . 14.4 t70 -129.1 139.11 52.12 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.04 178.69 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 27.4 t60 -65.82 -58.49 5.5 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.641 -177.029 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -70.04 -32.03 69.96 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.209 -173.389 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 730' ' ' ARG . . . . . 0.409 ' HB3' ' HB3' ' A' ' 727' ' ' ASP . 12.3 tpt180 -58.62 -49.7 76.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.141 0.496 . . . . 0.0 109.828 174.625 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -61.62 -48.58 80.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.805 178.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 46.8 mmm -56.38 -39.79 73.53 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.599 -179.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 43.0 mt -70.72 -49.15 53.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 12.9 p -65.52 -36.36 77.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 C-N-CA 120.732 -0.387 . . . . 0.0 111.08 -176.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -71.65 -32.29 67.75 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 121.089 0.471 . . . . 0.0 110.423 177.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 736' ' ' PHE . . . . . 0.565 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 24.4 t80 -65.59 -36.54 84.06 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.518 175.596 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 737' ' ' MET . . . . . 0.478 ' HA ' ' HD3' ' A' ' 784' ' ' LYS . 84.9 mtp -65.83 -27.1 68.0 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.331 176.633 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -91.71 -0.62 57.57 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.743 178.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 24.3 t -97.0 168.15 10.64 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.584 -178.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 740' ' ' LYS . . . . . 0.548 ' HA ' ' HE2' ' A' ' 740' ' ' LYS . 11.0 mmpt? -84.6 -11.59 55.71 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.186 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 741' ' ' LYS . . . . . 0.468 ' O ' ' HE2' ' A' ' 784' ' ' LYS . 59.9 mttp -67.31 129.57 40.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.112 177.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 70.2 mtm -91.09 -17.83 25.55 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.648 177.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -136.13 130.06 32.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.605 179.121 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 744' ' ' LEU . . . . . 0.565 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 45.8 tp -112.95 109.0 18.14 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.786 177.581 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -94.36 110.14 21.93 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.158 -178.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 746' ' ' PHE . . . . . 0.5 ' O ' ' HB2' ' A' ' 779' ' ' PHE . 72.2 m-85 -80.53 156.56 73.23 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.158 -178.444 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 747' ' ' PRO . . . . . 0.424 ' O ' HD11 ' A' ' 750' ' ' LEU . 40.2 Cg_exo -58.9 156.33 33.9 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.966 2.444 . . . . 0.0 112.565 177.353 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -74.19 -11.76 23.15 Favored 'Trans proline' 0 CA--C 1.53 0.295 0 C-N-CA 122.764 2.309 . . . . 0.0 112.77 178.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 17.6 m -71.59 -12.61 61.44 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.989 -0.55 . . . . 0.0 112.354 -176.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 750' ' ' LEU . . . . . 0.424 HD11 ' O ' ' A' ' 747' ' ' PRO . 11.2 mp -61.22 121.53 12.79 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 110.416 -0.216 . . . . 0.0 110.416 176.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 751' ' ' ASN . . . . . 0.562 ' O ' ' HG2' ' A' ' 755' ' ' ARG . 2.0 p30 -80.38 176.92 9.35 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 179.495 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 14.4 t -53.6 -37.26 62.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.913 0.387 . . . . 0.0 111.352 -177.04 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 73.8 m80 -76.07 -27.87 57.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.976 -179.227 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -72.25 -40.37 67.73 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 175.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 755' ' ' ARG . . . . . 0.562 ' HG2' ' O ' ' A' ' 751' ' ' ASN . 33.1 mmt180 -56.69 -58.58 7.45 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.51 175.181 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 62.0 tp -54.16 -38.63 65.74 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 114.871 -1.059 . . . . 0.0 111.045 -178.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 26.5 tpt180 -57.45 -48.53 78.9 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 120.996 0.427 . . . . 0.0 110.187 178.034 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 79.8 t -65.79 -46.54 88.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.838 179.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -56.05 -50.89 69.71 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.903 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -55.52 -47.98 75.39 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.407 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 96.6 mt -67.58 -49.1 73.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.523 -176.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -63.34 -30.77 71.84 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.224 0.535 . . . . 0.0 110.67 -178.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 763' ' ' GLU . . . . . 0.429 ' CD ' HN22 ' A' ' 801' ' ' DGP . 39.9 tt0 -70.71 -37.75 73.59 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.768 177.273 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -68.57 -36.99 79.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.361 0.6 . . . . 0.0 110.243 178.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 12.0 m170 -74.89 -23.12 58.33 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.438 177.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 84.68 44.4 6.46 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.936 -0.65 . . . . 0.0 112.272 178.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 82.0 mt -111.86 177.63 4.58 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 178.093 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 75.4 ttt180 -96.72 133.47 41.22 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 5.7 p80 -145.92 133.39 20.8 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.079 0.466 . . . . 0.0 111.555 -176.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -170.56 164.59 8.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.215 -0.902 . . . . 0.0 108.976 176.184 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 771' ' ' SER . . . . . 0.469 ' HA ' ' HA ' ' A' ' 780' ' ' ILE . 14.3 m -110.17 146.76 34.97 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.357 0.599 . . . . 0.0 112.035 -173.83 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 20.1 m -109.76 155.81 21.11 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.14 175.395 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 90.01 -179.44 44.02 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.345 -0.931 . . . . 0.0 111.723 -178.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -134.21 144.95 48.76 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.787 0.293 . . . . 0.0 111.183 -176.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . 65.44 -117.29 9.85 Favored Glycine 0 N--CA 1.452 -0.256 0 CA-C-N 115.802 -0.635 . . . . 0.0 113.124 174.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 23.0 ttpp -98.81 -7.34 27.6 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.957 0.408 . . . . 0.0 110.125 -177.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 85.1 mtt180 -92.28 4.33 53.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.603 0.716 . . . . 0.0 109.463 172.004 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 778' ' ' ARG . . . . . . . . . . . . . 22.5 ttt180 -77.75 135.59 38.03 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.726 -1.125 . . . . 0.0 109.686 177.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 779' ' ' PHE . . . . . 0.5 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 37.7 p90 -136.39 137.54 40.63 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.685 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 780' ' ' ILE . . . . . 0.469 ' HA ' ' HA ' ' A' ' 771' ' ' SER . 10.8 tt -83.93 135.33 25.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 121.201 0.525 . . . . 0.0 110.826 -176.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 35.2 m -120.38 119.82 34.2 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.479 -179.27 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 43.1 t -95.97 125.12 48.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.322 176.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 34.3 t -119.29 130.27 55.32 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.322 0.582 . . . . 0.0 110.789 -176.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 784' ' ' LYS . . . . . 0.478 ' HD3' ' HA ' ' A' ' 737' ' ' MET . 48.0 mtmt -77.79 -19.33 55.23 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 172.568 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 14.0 mmt180 -84.14 102.88 12.9 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.231 174.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.36 -0.829 . . . . 0.0 109.533 177.498 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 801' ' ' DGP . . . . . 0.429 HN22 ' CD ' ' A' ' 763' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo . . . . . 0 N--CA 1.474 0.372 0 N-CA-C 110.405 -0.652 . . . . 0.0 110.405 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 60.65 99.16 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 O-C-N 123.691 0.619 . . . . 0.0 111.402 -178.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . 100.16 51.16 1.27 Allowed Glycine 0 N--CA 1.445 -0.746 0 C-N-CA 120.595 -0.812 . . . . 0.0 111.558 -177.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 39.5 t -77.37 92.16 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 177.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -123.86 87.17 2.69 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.46 -173.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 25.4 p -87.49 -39.75 14.91 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 169.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 37.1 tt0 55.01 41.32 31.97 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 114.685 -1.143 . . . . 0.0 109.872 175.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -97.13 -156.92 0.56 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.834 -1.076 . . . . 0.0 110.38 -178.29 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . 98.95 75.31 1.19 Allowed Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 120.628 -0.796 . . . . 0.0 111.487 -177.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 8.7 p -156.09 131.67 1.73 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-O 120.962 0.411 . . . . 0.0 110.627 -176.214 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 727' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -68.55 151.61 46.52 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 174.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 29.9 t60 -52.82 -44.2 66.5 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.485 0.66 . . . . 0.0 109.391 174.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 44.7 m-85 -75.15 -26.76 59.38 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.692 -176.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 23.6 ttt180 -71.22 -36.59 71.91 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 178.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -66.39 -42.66 87.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.177 175.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 12.3 mmm -62.0 -40.91 97.28 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.131 176.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 733' ' ' ILE . . . . . 0.454 ' O ' ' HG3' ' A' ' 737' ' ' MET . 49.3 mt -69.22 -44.11 80.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.684 -179.149 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 11.4 p -63.99 -37.01 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 C-N-CA 120.564 -0.454 . . . . 0.0 110.994 -177.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -74.62 -27.26 60.38 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.05 0.452 . . . . 0.0 110.472 176.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 736' ' ' PHE . . . . . 0.544 ' CE1' ' HB2' ' A' ' 744' ' ' LEU . 26.9 t80 -69.36 -35.89 76.31 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.531 175.135 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 737' ' ' MET . . . . . 0.454 ' HG3' ' O ' ' A' ' 733' ' ' ILE . 86.2 mtp -64.27 -39.72 94.5 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.58 178.018 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -78.97 -23.49 44.48 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.54 178.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 33.1 t -73.54 164.13 27.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.465 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 45.2 mtmt -78.54 -22.38 47.33 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.621 -177.023 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 56.1 mtmt -55.43 128.32 33.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.658 -175.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 27.0 ptm -86.66 -18.96 29.98 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.898 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 19.8 mm-40 -135.71 139.01 43.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.313 178.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 744' ' ' LEU . . . . . 0.544 ' HB2' ' CE1' ' A' ' 736' ' ' PHE . 37.3 tp -118.44 108.67 15.31 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 176.479 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -92.27 112.15 23.98 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.049 -178.144 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -88.34 145.15 35.14 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.568 178.044 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_exo -65.0 152.53 82.08 Favored 'Trans proline' 0 N--CA 1.463 -0.313 0 C-N-CA 122.638 2.225 . . . . 0.0 112.037 177.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -68.68 -7.32 20.15 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 123.126 2.55 . . . . 0.0 111.462 177.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 5.6 m -59.61 -21.4 60.35 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.685 173.013 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.8 mp -73.34 115.4 12.65 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.865 173.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 10.9 p30 -82.7 -178.56 7.13 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 178.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 65.1 m -58.81 -29.0 66.53 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -175.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 54.2 t-80 -71.52 -45.04 63.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.894 0.378 . . . . 0.0 110.087 177.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -61.49 -51.09 70.09 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.036 178.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 755' ' ' ARG . . . . . 0.581 ' HB2' H5'' ' A' ' 801' ' ' DGP . 22.3 mtm180 -57.96 -43.58 86.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.806 179.643 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 756' ' ' LEU . . . . . 0.502 ' CD1' " H1'" ' A' ' 801' ' ' DGP . 51.5 tp -55.45 -41.96 73.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.466 179.845 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 19.0 mmm180 -63.77 -47.43 81.0 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.998 -0.281 . . . . 0.0 110.465 176.088 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 61.9 t -56.48 -46.31 82.21 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.97 179.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 87.3 m-70 -56.7 -53.68 54.91 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.648 178.024 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -59.44 -40.42 86.76 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.69 -178.045 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 95.6 mt -65.29 -53.78 36.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.106 -179.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -62.0 -36.82 82.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.176 0.512 . . . . 0.0 110.597 -179.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -64.84 -31.58 72.88 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.915 177.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -81.86 -36.75 27.9 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.66 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 11.3 m170 -74.57 -23.01 58.7 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.215 179.436 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 95.85 31.09 7.55 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.577 -0.82 . . . . 0.0 112.52 177.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 66.3 mt -108.65 -176.56 3.08 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 110.267 -0.272 . . . . 0.0 110.267 -178.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 768' ' ' ARG . . . . . 0.41 ' HB3' ' HB3' ' A' ' 783' ' ' SER . 17.4 ttm180 -100.95 135.62 42.11 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.439 177.797 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 7.2 p80 -144.65 135.3 24.66 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.936 -178.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -164.54 150.09 10.24 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.48 177.444 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 771' ' ' SER . . . . . 0.405 ' HA ' ' HA ' ' A' ' 780' ' ' ILE . 3.8 m -113.95 132.88 55.8 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-O 120.932 0.396 . . . . 0.0 110.297 179.112 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 772' ' ' SER . . . . . 0.49 ' O ' ' HA ' ' A' ' 778' ' ' ARG . 24.8 m -113.38 145.77 40.58 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.105 -178.653 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 99.91 -169.26 21.89 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.887 -0.673 . . . . 0.0 111.684 -178.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -143.19 139.77 30.45 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.819 0.343 . . . . 0.0 111.332 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . 65.9 -123.36 24.04 Favored Glycine 0 N--CA 1.448 -0.503 0 CA-C-N 115.656 -0.702 . . . . 0.0 112.592 177.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 16.8 tppt? -85.58 -2.7 58.43 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.466 0.65 . . . . 0.0 110.054 -179.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -96.95 0.74 49.4 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.828 172.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 778' ' ' ARG . . . . . 0.49 ' HA ' ' O ' ' A' ' 772' ' ' SER . 31.6 ttt180 -97.47 117.82 32.57 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.6 -178.549 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 38.8 p90 -127.34 158.52 37.03 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.148 -179.497 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 780' ' ' ILE . . . . . 0.405 ' HA ' ' HA ' ' A' ' 771' ' ' SER . 13.3 tt -107.17 134.03 50.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-O 121.057 0.456 . . . . 0.0 111.147 -175.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 5.7 m -118.36 124.25 47.28 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.023 178.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 43.3 t -107.28 127.0 63.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.767 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 783' ' ' SER . . . . . 0.41 ' HB3' ' HB3' ' A' ' 768' ' ' ARG . 22.8 t -112.47 147.16 37.1 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 120.821 0.344 . . . . 0.0 110.493 -178.716 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 17.7 mtmm -76.88 -12.49 59.97 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.421 0.629 . . . . 0.0 110.073 173.537 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 16.8 mmm180 -94.9 113.94 25.73 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.483 -0.781 . . . . 0.0 111.071 179.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.244 0.801 0 CA-C-O 118.635 -0.698 . . . . 0.0 109.565 175.329 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 801' ' ' DGP . . . . . 0.581 H5'' ' HB2' ' A' ' 755' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo . . . . . 0 N--CA 1.478 0.581 0 N-CA-C 109.994 -0.81 . . . . 0.0 109.994 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -101.78 103.45 14.18 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 177.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . 166.5 108.67 0.21 Allowed Glycine 0 N--CA 1.443 -0.839 0 C-N-CA 120.693 -0.765 . . . . 0.0 111.67 -176.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 25.7 t 57.31 68.45 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.446 0 CA-C-O 121.676 0.751 . . . . 0.0 110.245 -178.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -67.54 -34.64 77.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.565 176.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 14.2 m -116.06 103.32 10.45 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.505 -0.771 . . . . 0.0 109.595 174.136 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -64.34 -40.15 95.31 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.209 0.528 . . . . 0.0 109.825 177.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -102.21 94.46 5.75 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.109 175.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . -123.43 26.55 6.0 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.039 -177.602 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 2.9 p -91.07 96.22 6.15 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 CA-C-O 122.33 1.062 . . . . 0.0 110.048 -179.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 727' ' ' ASP . . . . . 0.434 ' HB3' ' HB3' ' A' ' 730' ' ' ARG . 9.9 t70 -102.77 140.62 36.81 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 114.334 -1.303 . . . . 0.0 109.545 -178.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 18.1 t60 -55.69 -47.47 76.73 Favored 'General case' 0 C--N 1.328 -0.337 0 O-C-N 123.365 0.416 . . . . 0.0 111.289 -177.27 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -75.07 -36.85 61.76 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.462 -176.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 730' ' ' ARG . . . . . 0.434 ' HB3' ' HB3' ' A' ' 727' ' ' ASP . 27.7 ttm-85 -61.8 -42.36 98.91 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.765 0.316 . . . . 0.0 110.383 175.811 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -60.44 -45.73 92.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.815 179.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 31.8 mtm -68.52 -33.32 73.92 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.236 -179.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 733' ' ' ILE . . . . . 0.54 ' O ' ' HG3' ' A' ' 737' ' ' MET . 58.3 mt -70.34 -49.31 54.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 N-CA-C 111.339 0.126 . . . . 0.0 111.339 178.499 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 13.0 p -62.86 -34.65 67.22 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 120.801 -0.36 . . . . 0.0 110.829 -177.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -70.6 -41.61 72.06 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.021 0.439 . . . . 0.0 110.142 175.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 736' ' ' PHE . . . . . 0.505 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 44.1 t80 -57.59 -35.47 70.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.33 177.777 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 737' ' ' MET . . . . . 0.54 ' HG3' ' O ' ' A' ' 733' ' ' ILE . 87.6 mtp -61.34 -32.89 72.78 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.824 178.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -96.01 -7.18 37.04 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.278 -179.457 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 64.3 m -82.78 168.47 17.14 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.082 -177.635 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 740' ' ' LYS . . . . . 0.507 ' HB2' ' HZ3' ' A' ' 740' ' ' LYS . 4.4 ttmp? -81.29 -21.85 39.04 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.435 -178.69 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -62.83 127.9 33.41 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.668 179.294 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 25.6 ptt? -88.86 -17.22 30.11 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.617 178.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 28.2 mt-30 -139.05 119.65 14.03 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.139 -178.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 744' ' ' LEU . . . . . 0.505 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 49.1 tp -101.03 105.24 16.43 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.334 176.334 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -89.67 115.89 27.38 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.305 -179.204 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 746' ' ' PHE . . . . . 0.446 ' O ' ' HB2' ' A' ' 779' ' ' PHE . 58.5 m-85 -88.27 145.6 36.22 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.934 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -58.28 153.79 44.6 Favored 'Trans proline' 0 CA--C 1.533 0.441 0 C-N-CA 123.178 2.585 . . . . 0.0 112.771 178.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -69.61 -9.37 26.0 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.922 2.415 . . . . 0.0 112.936 -179.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 2.3 p -69.24 -24.07 63.95 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.878 -178.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.8 mp -55.7 117.49 3.68 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.256 175.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -76.68 174.73 10.08 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 13.7 t -55.35 -32.53 62.63 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.649 0.24 . . . . 0.0 111.649 -175.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 40.2 m80 -79.43 -31.86 42.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.456 0.17 . . . . 0.0 110.962 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -66.32 -45.37 80.52 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 174.447 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 755' ' ' ARG . . . . . 0.486 ' HB2' " H5'" ' A' ' 801' ' ' DGP . 63.3 mtt-85 -62.6 -47.42 83.88 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.733 177.456 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 756' ' ' LEU . . . . . 0.535 ' HB2' " H4'" ' A' ' 801' ' ' DGP . 62.5 tp -55.04 -40.6 70.41 Favored 'General case' 0 N--CA 1.464 0.272 0 O-C-N 123.346 0.404 . . . . 0.0 110.877 179.103 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 27.9 tpt180 -56.87 -51.0 70.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.915 176.011 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 99.1 t -60.51 -49.67 83.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.258 178.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 -53.79 -51.2 64.22 Favored 'General case' 0 N--CA 1.463 0.192 0 O-C-N 123.302 0.376 . . . . 0.0 110.635 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -60.59 -44.19 96.52 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -178.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 98.1 mt -66.3 -49.31 76.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.756 0.313 . . . . 0.0 110.963 -177.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -64.32 -32.74 74.47 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.945 0.402 . . . . 0.0 110.59 -179.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -66.01 -37.03 84.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.407 178.612 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 13.7 tp10 -75.0 -43.26 54.88 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.676 177.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 10.6 m-70 -69.22 -24.89 64.08 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.434 -176.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 99.45 29.91 6.82 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.496 -0.859 . . . . 0.0 113.14 174.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 54.3 mt -107.59 170.76 7.78 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 176.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 30.5 ttt180 -96.55 139.89 31.97 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 119.616 -0.834 . . . . 0.0 109.745 175.143 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.5 p80 -137.19 131.71 32.87 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.428 -0.806 . . . . 0.0 109.837 -176.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -159.62 144.91 15.56 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.306 -179.379 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 771' ' ' SER . . . . . 0.426 ' HA ' ' HA ' ' A' ' 780' ' ' ILE . 8.8 t -110.3 149.31 30.38 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.45 0.643 . . . . 0.0 110.084 178.55 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 772' ' ' SER . . . . . 0.46 ' O ' ' HA ' ' A' ' 778' ' ' ARG . 29.3 t -147.15 157.7 43.69 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.161 -173.578 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 773' ' ' GLY . . . . . 0.505 ' HA3' ' O ' ' A' ' 777' ' ' ARG . . . 90.53 175.41 44.6 Favored Glycine 0 N--CA 1.448 -0.523 0 O-C-N 123.623 0.577 . . . . 0.0 112.159 178.421 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -135.08 149.21 50.03 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 110.322 -0.251 . . . . 0.0 110.322 178.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . 63.8 -128.05 37.11 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 121.227 -0.511 . . . . 0.0 112.137 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -77.1 -5.25 48.23 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.989 0.423 . . . . 0.0 110.625 178.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 777' ' ' ARG . . . . . 0.505 ' O ' ' HA3' ' A' ' 773' ' ' GLY . 31.5 mmt180 -99.2 4.3 46.67 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.294 175.091 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 778' ' ' ARG . . . . . 0.46 ' HA ' ' O ' ' A' ' 772' ' ' SER . 65.6 ttt180 -93.42 111.2 22.8 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-O 121.315 0.579 . . . . 0.0 110.315 178.278 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 779' ' ' PHE . . . . . 0.446 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 14.3 p90 -140.88 156.08 46.18 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.453 -174.248 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 780' ' ' ILE . . . . . 0.426 ' HA ' ' HA ' ' A' ' 771' ' ' SER . 6.2 tt -103.9 130.17 54.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-O 121.138 0.494 . . . . 0.0 110.107 179.079 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 27.1 m -111.13 120.36 42.04 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.449 -179.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 55.8 t -96.42 118.68 43.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 173.066 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 53.9 p -113.61 137.81 51.07 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.458 -177.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 59.0 mtpt -68.2 -85.35 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 172.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 53.92 27.56 7.45 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 123.431 0.457 . . . . 0.0 111.919 168.054 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.959 0 CA-C-O 118.49 -0.767 . . . . 0.0 110.121 -177.692 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 801' ' ' DGP . . . . . 0.535 " H4'" ' HB2' ' A' ' 756' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_exo . . . . . 0 N--CA 1.478 0.584 0 N-CA-C 110.362 -0.668 . . . . 0.0 110.362 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -145.65 97.68 3.01 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.993 0.425 . . . . 0.0 110.069 -177.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . -103.29 50.59 0.88 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.253 -178.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 35.3 m -86.74 3.31 4.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.988 0.423 . . . . 0.0 111.065 -179.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -148.91 134.46 18.65 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 -179.368 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 7.2 t -112.66 100.13 8.47 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 -179.183 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 723' ' ' GLN . . . . . 0.533 ' HA ' ' NH2' ' A' ' 730' ' ' ARG . 25.9 mp0 -60.47 -35.32 75.61 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.652 -0.704 . . . . 0.0 112.089 -172.575 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -85.21 90.53 7.91 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.215 0.531 . . . . 0.0 110.203 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . 175.8 99.93 0.13 Allowed Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.005 -179.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 17.2 t -88.07 79.63 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.6 0.714 . . . . 0.0 109.68 -179.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 727' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -109.12 142.86 39.28 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 114.941 -1.027 . . . . 0.0 110.29 -177.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 9.7 t60 -55.68 -56.28 22.25 Favored 'General case' 0 C--N 1.332 -0.185 0 O-C-N 123.652 0.595 . . . . 0.0 110.792 -179.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 40.6 m-85 -75.56 -31.3 59.98 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.371 -172.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 730' ' ' ARG . . . . . 0.533 ' NH2' ' HA ' ' A' ' 723' ' ' GLN . 40.0 ttt-85 -59.77 -45.7 91.45 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.18 174.236 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -61.12 -42.53 98.7 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.536 -179.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 32.8 mmm -62.54 -39.09 92.49 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.925 178.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 733' ' ' ILE . . . . . 0.498 ' O ' ' HB3' ' A' ' 736' ' ' PHE . 68.1 mt -77.76 -39.57 26.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -177.678 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 10.8 p -65.16 -37.69 80.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.817 -178.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -78.19 -29.35 48.43 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 120.811 -0.355 . . . . 0.0 110.37 176.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 736' ' ' PHE . . . . . 0.529 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 29.2 t80 -52.88 -44.79 67.11 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.873 175.281 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 71.1 mtm -67.13 -23.21 65.78 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.732 -179.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -97.09 -9.63 27.63 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.696 0.284 . . . . 0.0 111.529 -178.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 50.7 m -90.01 2.55 55.04 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.604 -177.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 740' ' ' LYS . . . . . 0.441 ' HG2' ' O ' ' A' ' 740' ' ' LYS . 61.5 tttp 65.4 9.76 6.0 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.257 0.551 . . . . 0.0 111.03 -179.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 62.4 mttm -68.27 129.78 40.95 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.625 179.118 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 742' ' ' MET . . . . . 0.411 ' SD ' ' N ' ' A' ' 742' ' ' MET . 0.0 OUTLIER -78.08 -25.47 47.65 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.064 177.49 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -155.34 148.8 25.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.314 177.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 744' ' ' LEU . . . . . 0.529 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 59.0 tp -124.81 108.27 11.78 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.777 178.642 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -80.78 114.55 19.74 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.91 179.536 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 746' ' ' PHE . . . . . 0.405 ' HB2' HG23 ' A' ' 780' ' ' ILE . 68.1 m-85 -90.93 154.78 45.38 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.354 177.853 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 747' ' ' PRO . . . . . 0.405 ' O ' HD11 ' A' ' 750' ' ' LEU . 33.8 Cg_exo -59.17 155.36 40.31 Favored 'Trans proline' 0 CA--C 1.533 0.466 0 C-N-CA 122.666 2.244 . . . . 0.0 112.294 176.304 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -75.6 -14.46 19.87 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.653 2.236 . . . . 0.0 112.169 -179.366 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 7.8 p -71.75 -11.08 60.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.594 -175.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 750' ' ' LEU . . . . . 0.405 HD11 ' O ' ' A' ' 747' ' ' PRO . 11.1 mp -58.59 113.67 2.12 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 174.091 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 751' ' ' ASN . . . . . 0.569 ' O ' ' HG2' ' A' ' 755' ' ' ARG . 3.1 p30 -75.13 178.94 5.34 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 110.345 -0.243 . . . . 0.0 110.345 -175.325 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 30.2 m -51.76 -42.44 62.37 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 120.606 0.241 . . . . 0.0 111.522 -176.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 70.1 m80 -70.24 -36.98 74.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.106 -179.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 754' ' ' ASP . . . . . 0.409 ' O ' HG21 ' A' ' 758' ' ' VAL . 73.7 m-20 -64.38 -49.47 71.48 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 177.121 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 755' ' ' ARG . . . . . 0.569 ' HG2' ' O ' ' A' ' 751' ' ' ASN . 1.4 mmm-85 -54.36 -57.49 11.08 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.648 178.615 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 66.7 tp -52.29 -41.89 63.28 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 114.978 -1.01 . . . . 0.0 111.901 -178.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -63.09 -45.41 92.21 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 121.195 -0.202 . . . . 0.0 110.73 178.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 758' ' ' VAL . . . . . 0.409 HG21 ' O ' ' A' ' 754' ' ' ASP . 93.4 t -60.69 -47.16 94.24 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.728 178.234 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -56.79 -51.48 68.79 Favored 'General case' 0 N--CA 1.462 0.139 0 O-C-N 123.339 0.399 . . . . 0.0 110.206 178.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -54.96 -47.62 74.28 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.671 179.419 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 97.3 mt -63.55 -55.4 23.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.119 -178.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -60.24 -35.13 74.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.968 0.413 . . . . 0.0 110.88 -177.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -66.69 -38.16 86.2 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.144 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -77.22 -36.46 54.68 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.586 0.232 . . . . 0.0 110.448 179.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 9.8 m-70 -65.31 -23.48 67.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.959 0.409 . . . . 0.0 110.709 176.24 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 89.25 35.75 7.91 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.108 177.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 62.9 mt -114.0 177.16 4.74 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.275 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 22.5 ttp180 -95.56 143.92 26.46 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 178.416 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 5.3 p80 -140.32 122.47 15.78 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.092 0.472 . . . . 0.0 110.276 -178.244 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -134.83 155.19 51.07 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.926 -174.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 10.0 m -120.79 129.57 53.64 Favored 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 172.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 16.0 t -153.61 176.68 11.79 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.106 -171.079 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 118.8 165.6 13.27 Favored Glycine 0 N--CA 1.441 -1.0 0 C-N-CA 120.877 -0.678 . . . . 0.0 111.577 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 39.8 mm-40 -70.54 178.8 2.8 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.653 0.263 . . . . 0.0 110.69 178.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . -57.75 -35.75 75.97 Favored Glycine 0 CA--C 1.519 0.312 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.349 179.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -102.3 12.09 37.16 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.84 0.352 . . . . 0.0 110.87 178.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 17.3 mmm180 -137.03 19.34 3.0 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.236 -175.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 778' ' ' ARG . . . . . . . . . . . . . 49.2 ttt180 -75.78 113.99 13.87 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.375 0.607 . . . . 0.0 111.589 -177.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 11.1 p90 -135.07 -166.92 1.9 Allowed 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.241 -0.89 . . . . 0.0 109.986 -179.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 780' ' ' ILE . . . . . 0.405 HG23 ' HB2' ' A' ' 746' ' ' PHE . 6.5 tt -126.32 140.26 49.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 120.906 0.384 . . . . 0.0 110.265 177.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 26.3 m -128.23 117.98 22.49 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.656 -179.008 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 49.5 t -86.72 127.86 40.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 174.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 26.2 m -127.83 139.68 52.49 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.345 0.593 . . . . 0.0 112.059 -173.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 10.0 mtpm? -85.23 -12.88 51.54 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.93 0.871 . . . . 0.0 109.092 172.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 16.6 mmm180 -76.37 139.5 40.99 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 114.114 -1.403 . . . . 0.0 110.657 174.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.917 0 CA-C-O 118.734 -0.651 . . . . 0.0 110.41 177.847 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 801' ' ' DGP . . . . . 0.468 " H5'" ' CB ' ' A' ' 755' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo . . . . . 0 N--CA 1.475 0.413 0 N-CA-C 111.52 -0.223 . . . . 0.0 111.52 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -74.79 149.7 39.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.047 0.451 . . . . 0.0 111.707 -176.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . -138.5 99.9 0.28 Allowed Glycine 0 N--CA 1.444 -0.771 0 N-CA-C 110.906 -0.877 . . . . 0.0 110.906 174.036 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 15.4 m -78.39 56.38 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.432 0.634 . . . . 0.0 111.344 -175.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -75.56 -60.04 2.48 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.591 -179.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 10.3 m -75.62 95.25 3.33 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.01 -177.104 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -103.47 83.37 2.16 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 176.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -113.33 -179.0 3.52 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.612 -175.796 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . 81.07 72.71 1.22 Allowed Glycine 0 N--CA 1.448 -0.559 0 N-CA-C 110.715 -0.954 . . . . 0.0 110.715 -176.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 2.9 p -105.74 108.57 25.36 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.945 0 CA-C-O 121.922 0.868 . . . . 0.0 110.987 -171.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 727' ' ' ASP . . . . . 0.497 ' HB3' ' HB3' ' A' ' 730' ' ' ARG . 8.1 t70 -128.85 128.45 43.89 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 114.772 -1.104 . . . . 0.0 108.217 172.26 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 23.1 t60 -57.94 -45.54 86.42 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.089 0.471 . . . . 0.0 111.392 -172.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -82.41 -37.55 25.37 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.738 -174.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 730' ' ' ARG . . . . . 0.497 ' HB3' ' HB3' ' A' ' 727' ' ' ASP . 17.1 tpt180 -55.76 -44.58 77.79 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.975 0.417 . . . . 0.0 109.96 175.721 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 731' ' ' ALA . . . . . 0.438 ' O ' ' HG3' ' A' ' 735' ' ' GLU . . . -63.43 -52.08 63.02 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.872 179.72 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 31.6 mtm -63.63 -33.49 75.74 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.757 -177.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 81.2 mt -72.74 -43.13 61.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 11.9 p -67.98 -36.55 75.96 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.339 -179.204 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 735' ' ' GLU . . . . . 0.438 ' HG3' ' O ' ' A' ' 731' ' ' ALA . 52.4 mt-10 -68.83 -35.84 77.47 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.077 0.465 . . . . 0.0 109.768 175.376 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 736' ' ' PHE . . . . . 0.4 ' CE2' ' HG3' ' A' ' 784' ' ' LYS . 26.8 t80 -61.69 -38.23 87.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.39 178.591 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 737' ' ' MET . . . . . 0.517 ' HA ' ' HD3' ' A' ' 784' ' ' LYS . 42.0 mtm -62.29 -40.23 95.58 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 121.077 -0.249 . . . . 0.0 111.028 179.563 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -81.49 -17.98 46.75 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.948 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 32.7 t -74.08 160.77 30.8 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.905 -178.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 740' ' ' LYS . . . . . 0.499 ' H ' ' HD2' ' A' ' 740' ' ' LYS . 0.0 OUTLIER -77.43 -12.2 59.93 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.819 -178.944 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -67.24 133.29 49.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.154 -0.475 . . . . 0.0 109.859 177.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 59.2 mtt -95.76 -20.56 18.77 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.04 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -133.31 124.53 27.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.854 179.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 744' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -93.34 97.53 10.65 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 176.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -84.3 101.35 11.87 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.166 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -79.66 154.02 75.94 Favored Pre-proline 0 C--N 1.321 -0.645 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.58 179.29 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -75.27 160.16 39.59 Favored 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 122.759 2.306 . . . . 0.0 111.602 175.049 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -68.14 -4.35 12.46 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.796 2.331 . . . . 0.0 112.612 177.033 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 12.2 p -63.9 -27.13 68.94 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.553 179.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.2 mp -63.22 115.34 4.43 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.466 -0.333 . . . . 0.0 110.552 176.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 751' ' ' ASN . . . . . 0.415 ' O ' ' HG3' ' A' ' 755' ' ' ARG . 2.6 p-10 -91.86 -170.04 2.45 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 174.577 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 12.8 p -46.19 -61.81 1.61 Allowed 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -173.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -55.53 -43.74 76.05 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.412 -178.006 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -62.94 -47.35 83.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.991 -178.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 755' ' ' ARG . . . . . 0.523 ' HB2' " H5'" ' A' ' 801' ' ' DGP . 82.8 mtt180 -60.89 -48.22 82.8 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.798 177.345 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 756' ' ' LEU . . . . . 0.406 ' HB2' " H4'" ' A' ' 801' ' ' DGP . 65.3 tp -54.26 -40.98 68.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.059 -179.065 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 9.9 mmt180 -59.02 -48.76 80.41 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.448 175.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 59.3 t -62.27 -48.42 88.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.059 -179.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -57.0 -49.67 75.06 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 110.442 -0.207 . . . . 0.0 110.442 179.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 67.0 mt-30 -56.21 -50.37 71.44 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.599 179.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 95.5 mt -67.32 -46.23 84.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.542 -176.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -62.53 -39.59 94.09 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.838 0.351 . . . . 0.0 110.421 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -65.75 -33.87 76.87 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.58 177.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -73.89 -35.23 64.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.513 178.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 11.3 m170 -79.08 -11.77 60.0 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.389 179.416 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 81.92 21.68 60.89 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.482 179.382 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 71.8 mt -95.06 172.68 7.99 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 -179.183 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 768' ' ' ARG . . . . . 0.407 ' HD2' ' O ' ' A' ' 786' ' ' ALA . 58.0 ttt180 -96.15 132.71 41.27 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.891 0.377 . . . . 0.0 110.226 178.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -133.6 124.62 27.16 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 121.293 0.568 . . . . 0.0 110.537 178.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -145.25 145.24 31.21 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.424 -177.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 14.3 m -115.68 143.99 44.58 Favored 'General case' 0 C--N 1.316 -0.849 0 C-N-CA 120.843 -0.343 . . . . 0.0 111.005 -176.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 28.4 t -119.71 148.11 43.79 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.641 -0.708 . . . . 0.0 109.478 179.09 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 103.36 -178.8 25.54 Favored Glycine 0 N--CA 1.447 -0.606 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.08 -178.037 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -101.05 -84.39 0.43 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -175.282 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . -117.01 -86.65 1.22 Allowed Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.267 -0.968 . . . . 0.0 113.011 -174.247 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -76.4 -14.72 60.05 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.649 0.261 . . . . 0.0 111.434 -176.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 777' ' ' ARG . . . . . 0.409 HH11 ' HD3' ' A' ' 777' ' ' ARG . 47.1 mtt180 -107.0 7.35 29.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.821 0.343 . . . . 0.0 110.952 175.4 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 778' ' ' ARG . . . . . . . . . . . . . 47.0 ttt180 -74.59 119.22 18.49 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.029 0.442 . . . . 0.0 110.193 177.391 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -117.41 148.47 41.74 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.842 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 9.3 tt -102.74 136.76 33.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.587 -177.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 18.6 m -120.75 116.04 24.47 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.58 -178.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 47.2 t -92.28 117.03 34.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.841 177.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 34.3 t -111.6 127.79 55.85 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.108 0.48 . . . . 0.0 110.43 -178.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 784' ' ' LYS . . . . . 0.517 ' HD3' ' HA ' ' A' ' 737' ' ' MET . 52.4 mtmt -83.53 -24.53 31.61 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.486 0.66 . . . . 0.0 109.222 174.481 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 20.9 mmt180 -90.64 162.43 14.96 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.99 -1.005 . . . . 0.0 110.801 179.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 786' ' ' ALA . . . . . 0.407 ' O ' ' HD2' ' A' ' 768' ' ' ARG . . . . . . . . 0 C--O 1.25 1.086 0 O-C-N 123.994 0.809 . . . . 0.0 111.372 178.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 801' ' ' DGP . . . . . 0.732 ' H8 ' ' OP3' ' A' ' 801' ' ' DGP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo . . . . . 0 N--CA 1.483 0.864 0 N-CA-C 111.245 -0.329 . . . . 0.0 111.245 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 718' ' ' GLU . . . . . 0.451 ' H ' ' CD ' ' A' ' 718' ' ' GLU . 0.1 OUTLIER -62.24 -30.12 70.88 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.787 178.527 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . -76.75 72.43 2.02 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.082 -0.807 . . . . 0.0 111.082 174.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 3.7 p -81.33 109.59 15.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 121.694 0.759 . . . . 0.0 110.922 -177.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.32 127.64 33.2 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 114.976 -1.011 . . . . 0.0 108.801 178.148 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 34.5 t -116.26 10.27 14.78 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -167.495 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -55.83 144.74 26.72 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.662 175.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -52.35 -37.36 55.92 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.785 -176.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . 144.85 -57.98 0.52 Allowed Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.733 -0.746 . . . . 0.0 111.93 178.718 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 27.9 t -104.89 97.89 6.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.692 0.758 . . . . 0.0 109.712 -177.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 727' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -127.98 139.71 52.41 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 114.727 -1.124 . . . . 0.0 109.006 178.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 728' ' ' HIS . . . . . 0.438 ' O ' ' HG2' ' A' ' 732' ' ' MET . 22.3 t60 -54.41 -55.19 31.19 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 123.534 0.521 . . . . 0.0 111.161 -176.545 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -70.75 -39.63 73.15 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.101 -174.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 730' ' ' ARG . . . . . 0.421 HH11 ' HD3' ' A' ' 730' ' ' ARG . 26.8 ttt180 -55.71 -40.45 72.43 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.215 0.531 . . . . 0.0 110.059 176.188 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 731' ' ' ALA . . . . . 0.501 ' O ' HG12 ' A' ' 734' ' ' VAL . . . -71.82 -42.57 66.86 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.96 179.05 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 732' ' ' MET . . . . . 0.438 ' HG2' ' O ' ' A' ' 728' ' ' HIS . 44.8 mmm -60.65 -37.49 81.69 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.767 0.318 . . . . 0.0 110.895 178.638 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 70.8 mt -71.02 -41.0 76.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.528 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 734' ' ' VAL . . . . . 0.501 HG12 ' O ' ' A' ' 731' ' ' ALA . 10.0 p -67.66 -34.32 67.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.664 -179.167 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 735' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' A' ' 731' ' ' ALA . 51.9 mt-10 -63.08 -45.56 91.57 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-O 121.349 0.595 . . . . 0.0 109.543 173.436 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 736' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -57.41 -44.52 84.67 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.849 -1.069 . . . . 0.0 111.535 -179.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 45.8 mtm -69.15 -34.34 74.85 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.035 -179.345 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -78.04 -28.64 49.07 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.902 0.382 . . . . 0.0 111.224 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 25.2 t -80.69 -172.04 3.43 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.496 -179.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 740' ' ' LYS . . . . . 0.577 ' H ' ' HD2' ' A' ' 740' ' ' LYS . 0.0 OUTLIER -110.53 12.46 22.83 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.154 0.502 . . . . 0.0 110.848 -175.094 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -71.75 142.09 49.76 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.368 -0.605 . . . . 0.0 109.368 172.12 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 742' ' ' MET . . . . . 0.482 ' O ' ' HA ' ' A' ' 783' ' ' SER . 17.6 ptp -104.12 -14.91 15.71 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.468 177.454 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -140.7 116.34 10.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.662 179.122 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 744' ' ' LEU . . . . . 0.435 HD12 ' CZ ' ' A' ' 746' ' ' PHE . 1.4 tt -89.63 103.55 16.18 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 177.646 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -88.27 99.07 11.95 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.646 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 746' ' ' PHE . . . . . 0.435 ' CZ ' HD12 ' A' ' 744' ' ' LEU . 71.6 m-85 -77.03 153.35 82.64 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.352 178.674 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_exo -66.23 156.32 65.51 Favored 'Trans proline' 0 CA--C 1.532 0.422 0 C-N-CA 122.8 2.333 . . . . 0.0 112.13 176.045 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -71.41 -5.24 16.61 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.928 2.419 . . . . 0.0 112.665 177.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 23.6 p -65.01 -25.23 67.77 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.156 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.9 mp -60.17 118.12 5.97 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.577 177.441 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -90.12 -176.53 4.89 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.075 176.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 17.4 m -48.29 -53.99 15.31 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 113.237 0.828 . . . . 0.0 113.237 -171.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -68.0 -37.86 81.97 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.693 0.282 . . . . 0.0 110.956 -175.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -65.16 -45.58 84.37 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.781 0.324 . . . . 0.0 110.405 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 78.2 mtt180 -58.53 -48.62 80.24 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 174.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 756' ' ' LEU . . . . . 0.443 ' HB2' " H4'" ' A' ' 801' ' ' DGP . 56.9 tp -53.68 -43.32 68.81 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.61 179.894 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -60.53 -41.73 95.02 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.293 -0.412 . . . . 0.0 109.963 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 91.7 t -64.18 -48.27 86.38 Favored 'Isoleucine or valine' 0 C--O 1.232 0.175 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.067 176.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -55.08 -48.35 73.64 Favored 'General case' 0 N--CA 1.464 0.236 0 O-C-N 123.255 0.347 . . . . 0.0 111.056 -179.737 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -58.98 -48.58 81.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.692 -179.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 98.5 mt -65.65 -49.17 79.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.987 -177.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -60.96 -41.41 96.27 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 120.912 0.387 . . . . 0.0 110.841 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 763' ' ' GLU . . . . . 0.424 ' CD ' HN22 ' A' ' 801' ' ' DGP . 37.7 tt0 -63.28 -39.68 95.27 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.033 -179.602 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -74.62 -36.79 62.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.807 0.337 . . . . 0.0 110.765 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 11.8 m170 -65.79 -25.06 67.08 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.908 177.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 100.15 14.62 32.94 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.384 177.408 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 39.7 mt -94.52 169.61 10.07 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 -179.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 768' ' ' ARG . . . . . 0.558 ' HB2' ' HA ' ' A' ' 786' ' ' ALA . 59.8 ttt180 -100.73 152.3 20.64 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 179.228 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 5.8 p80 -153.14 142.82 21.94 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.736 0.303 . . . . 0.0 110.803 -176.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -142.21 160.9 39.33 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.204 178.136 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 4.4 m -124.74 135.64 53.17 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.601 176.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 38.7 m -135.64 140.96 44.95 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.816 -175.247 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 115.01 170.74 16.47 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 121.147 -0.549 . . . . 0.0 111.952 178.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -109.77 129.89 55.58 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.788 0.327 . . . . 0.0 111.463 -177.216 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . 61.31 -112.05 4.39 Favored Glycine 0 N--CA 1.451 -0.342 0 CA-C-N 115.843 -0.617 . . . . 0.0 113.251 172.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 19.3 tptm -97.63 -0.76 45.11 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.147 0.499 . . . . 0.0 110.607 -177.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 9.8 mtm-85 -91.38 0.49 57.51 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 172.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 778' ' ' ARG . . . . . . . . . . . . . 55.8 ttt85 -83.51 125.45 31.76 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 114.431 -1.259 . . . . 0.0 110.909 -176.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 43.8 p90 -118.92 170.61 8.87 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.816 178.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 8.3 tt -122.7 141.22 43.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-O 120.928 0.394 . . . . 0.0 110.594 179.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 781' ' ' THR . . . . . 0.401 ' HA ' ' O ' ' A' ' 744' ' ' LEU . 25.7 m -127.14 127.63 44.88 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.468 -179.648 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 35.4 t -106.19 124.44 61.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.653 178.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 783' ' ' SER . . . . . 0.482 ' HA ' ' O ' ' A' ' 742' ' ' MET . 55.6 p -112.36 139.55 47.83 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.072 0.463 . . . . 0.0 111.259 -177.114 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -69.4 -28.22 65.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.408 0.623 . . . . 0.0 110.326 175.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 785' ' ' ARG . . . . . 0.56 ' HA ' ' NE ' ' A' ' 785' ' ' ARG . 4.1 mmp_? -87.15 114.31 23.64 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.821 177.342 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 786' ' ' ALA . . . . . 0.558 ' HA ' ' HB2' ' A' ' 768' ' ' ARG . . . . . . . . 0 C--O 1.245 0.841 0 CA-C-O 118.438 -0.792 . . . . 0.0 111.136 -175.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 801' ' ' DGP . . . . . 0.566 ' H8 ' ' OP3' ' A' ' 801' ' ' DGP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo . . . . . 0 N--CA 1.474 0.354 0 N-CA-C 110.876 -0.471 . . . . 0.0 110.876 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -102.54 114.67 29.08 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.225 -179.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . -75.52 81.9 0.95 Allowed Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 121.098 -0.572 . . . . 0.0 112.334 179.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 48.5 t -92.39 115.28 30.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 121.027 0.441 . . . . 0.0 110.496 -178.113 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -107.57 156.32 19.15 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.758 -0.655 . . . . 0.0 109.424 175.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 14.9 m -75.97 103.57 6.1 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.887 -178.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -79.29 93.07 5.22 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.061 0.458 . . . . 0.0 109.822 175.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -140.01 151.62 45.61 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.866 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . 91.12 51.26 2.63 Favored Glycine 0 N--CA 1.445 -0.753 0 N-CA-C 110.068 -1.213 . . . . 0.0 110.068 -172.166 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 17.4 t -98.14 104.69 16.26 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 CA-C-O 120.94 0.4 . . . . 0.0 110.752 -171.246 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 727' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -72.55 158.93 34.75 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 173.038 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 31.8 t60 -55.28 -51.36 66.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.212 0.529 . . . . 0.0 109.602 177.422 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 36.2 m-85 -70.24 -24.24 63.05 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.45 -178.494 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 730' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 730' ' ' ARG . 12.0 ttm180 -70.34 -39.76 74.52 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 178.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -63.96 -41.73 97.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.133 175.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 35.0 mmm -59.83 -43.36 94.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.549 178.004 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 733' ' ' ILE . . . . . 0.454 ' O ' ' HG3' ' A' ' 737' ' ' MET . 48.7 mt -70.03 -45.15 77.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.871 -0.604 . . . . 0.0 112.101 -178.304 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 10.9 p -63.47 -37.12 78.71 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 120.968 -0.293 . . . . 0.0 111.166 -176.075 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -74.02 -36.01 64.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.06 0.457 . . . . 0.0 110.186 176.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 736' ' ' PHE . . . . . 0.456 ' CE1' ' HB2' ' A' ' 744' ' ' LEU . 19.3 t80 -60.76 -37.02 80.41 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.819 175.838 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 737' ' ' MET . . . . . 0.454 ' HG3' ' O ' ' A' ' 733' ' ' ILE . 87.6 mtp -63.23 -36.24 82.98 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.093 178.863 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -86.28 -16.14 38.5 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.383 -178.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 58.9 m -84.53 169.41 14.48 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.874 0.369 . . . . 0.0 111.316 -177.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -73.36 -16.38 61.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.936 -0.575 . . . . 0.0 112.061 -176.304 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -60.16 134.59 57.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.127 0.489 . . . . 0.0 111.051 -177.338 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 56.6 mtm -92.47 -26.96 17.74 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.935 177.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -137.35 135.68 37.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.311 -179.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 744' ' ' LEU . . . . . 0.456 ' HB2' ' CE1' ' A' ' 736' ' ' PHE . 30.4 tp -112.94 105.37 13.43 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 176.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -91.37 112.65 24.65 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.243 -178.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 746' ' ' PHE . . . . . 0.514 ' O ' ' HB2' ' A' ' 779' ' ' PHE . 87.4 m-85 -85.51 150.07 53.19 Favored Pre-proline 0 C--N 1.321 -0.661 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.154 178.023 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -67.41 158.81 55.29 Favored 'Trans proline' 0 N--CA 1.461 -0.391 0 C-N-CA 122.407 2.071 . . . . 0.0 112.008 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -66.09 -5.64 12.74 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.787 2.324 . . . . 0.0 112.532 176.683 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 3.4 m -63.4 -20.74 65.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.476 -0.783 . . . . 0.0 111.42 178.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.5 mp -69.06 113.85 6.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.372 177.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 751' ' ' ASN . . . . . 0.49 HD21 ' C ' ' A' ' 751' ' ' ASN . 0.3 OUTLIER -84.86 -167.36 1.79 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 110.247 -0.279 . . . . 0.0 110.247 179.061 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 6.2 m -52.25 -52.09 54.56 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 111.664 0.246 . . . . 0.0 111.664 -177.059 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 753' ' ' HIS . . . . . 0.437 ' O ' ' HG2' ' A' ' 757' ' ' ARG . 32.0 t-80 -59.54 -49.71 76.7 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.625 -0.261 . . . . 0.0 111.347 179.097 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -56.63 -55.73 30.34 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.168 -176.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 755' ' ' ARG . . . . . 0.456 ' HB2' H5'' ' A' ' 801' ' ' DGP . 77.1 mtt85 -56.55 -49.69 74.06 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.35 -179.788 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 756' ' ' LEU . . . . . 0.525 HD22 " H1'" ' A' ' 801' ' ' DGP . 3.1 tm? -53.08 -46.25 68.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.218 -178.07 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 757' ' ' ARG . . . . . 0.437 ' HG2' ' O ' ' A' ' 753' ' ' HIS . 31.9 mmm180 -60.35 -45.86 91.96 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.355 178.48 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 91.9 t -60.45 -47.39 92.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.648 -0.251 . . . . 0.0 110.943 179.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 87.8 m-70 -52.33 -56.73 12.95 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.711 178.431 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -60.79 -41.95 96.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.041 -0.527 . . . . 0.0 112.099 -178.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.59 -50.5 79.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.749 0.309 . . . . 0.0 110.845 179.257 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -64.39 -36.73 85.1 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.889 0.376 . . . . 0.0 110.58 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 763' ' ' GLU . . . . . 0.437 ' CD ' HN22 ' A' ' 801' ' ' DGP . 31.8 tt0 -65.32 -40.25 93.49 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.573 178.919 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.21 -43.37 78.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.053 -0.522 . . . . 0.0 109.852 177.686 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 10.5 m170 -69.09 -17.0 63.81 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.431 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 84.38 34.99 15.3 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.457 177.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 80.1 mt -110.4 172.95 6.56 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.03 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 73.3 ttt180 -92.71 143.75 25.99 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 177.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 5.5 p80 -146.06 121.49 10.32 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.222 0.534 . . . . 0.0 110.638 179.498 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -129.32 138.07 51.37 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.7 -176.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 5.1 m -104.02 128.08 51.59 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 174.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 20.4 p -132.06 150.22 52.21 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.783 -175.125 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 117.79 -157.68 15.03 Favored Glycine 0 N--CA 1.444 -0.77 0 N-CA-C 111.435 -0.666 . . . . 0.0 111.435 -177.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -94.76 -88.79 0.24 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.605 0.241 . . . . 0.0 111.585 -178.746 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . -142.93 -66.21 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.622 -0.799 . . . . 0.0 112.08 -179.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -79.62 -28.28 40.95 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.108 0.48 . . . . 0.0 110.439 179.079 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 777' ' ' ARG . . . . . 0.426 HH11 ' HD3' ' A' ' 777' ' ' ARG . 51.4 mtt180 -97.38 3.11 51.14 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.51 175.857 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 778' ' ' ARG . . . . . . . . . . . . . 28.2 ttt180 -72.42 129.48 38.46 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.0 178.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 779' ' ' PHE . . . . . 0.514 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 45.8 p90 -121.34 166.53 13.92 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.274 -178.309 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 6.7 tt -116.41 135.5 56.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-O 121.278 0.561 . . . . 0.0 110.775 -178.028 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 55.9 m -119.91 120.24 35.83 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.733 -179.496 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 46.5 t -94.14 122.53 45.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.51 176.109 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 45.5 t -114.22 134.05 55.19 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-O 121.072 0.463 . . . . 0.0 110.835 -176.018 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 50.9 mtpt -88.03 -43.23 11.87 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.771 179.268 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 785' ' ' ARG . . . . . 0.697 ' HA ' ' NE ' ' A' ' 785' ' ' ARG . 2.0 mmp_? -121.08 122.3 39.75 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.665 -175.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.882 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.323 176.574 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 801' ' ' DGP . . . . . 0.534 " H3'" ' OP3' ' A' ' 801' ' ' DGP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_endo . . . . . 0 N--CA 1.478 0.6 0 N-CA-C 109.892 -0.849 . . . . 0.0 109.892 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -78.87 70.23 5.17 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.169 0.509 . . . . 0.0 110.85 178.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . -87.79 65.66 3.49 Favored Glycine 0 N--CA 1.445 -0.726 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.72 178.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 3.4 p -126.72 100.34 6.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-O 121.574 0.702 . . . . 0.0 110.227 178.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -65.71 114.09 4.75 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.556 177.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 46.7 m -74.08 120.13 19.25 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.954 -0.388 . . . . 0.0 109.954 178.615 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 47.7 tt0 -71.53 -47.82 52.74 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.238 -0.437 . . . . 0.0 109.872 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -156.28 -167.57 2.47 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.374 178.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . 86.0 31.71 19.65 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.538 -0.839 . . . . 0.0 112.516 178.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 17.4 t -89.27 100.52 10.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 176.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 727' ' ' ASP . . . . . 0.517 ' CG ' ' HB2' ' A' ' 730' ' ' ARG . 2.1 p-10 -75.89 137.41 40.39 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.748 -175.327 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 44.2 t60 -51.1 -54.97 20.15 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 114.842 -1.072 . . . . 0.0 111.948 -175.671 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -64.22 -23.03 67.16 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.187 -176.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 730' ' ' ARG . . . . . 0.517 ' HB2' ' CG ' ' A' ' 727' ' ' ASP . 1.8 ttm180 -69.2 -47.69 64.17 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 178.284 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -63.5 -42.43 98.52 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.668 178.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 37.9 mmm -60.63 -38.15 83.83 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.381 179.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 48.8 mt -72.9 -45.99 53.88 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.661 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 11.1 p -64.9 -35.1 74.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 C-N-CA 120.861 -0.335 . . . . 0.0 110.94 -176.665 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -74.73 -33.34 62.34 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 121.023 0.439 . . . . 0.0 110.208 176.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 736' ' ' PHE . . . . . 0.459 ' CE2' ' HG3' ' A' ' 784' ' ' LYS . 32.2 t80 -61.79 -36.26 80.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.913 174.347 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 80.8 mtp -74.14 -26.05 60.1 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.15 177.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -87.77 -24.97 23.62 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.859 0.362 . . . . 0.0 110.609 -176.46 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 77.3 p -89.9 -173.81 4.03 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.45 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -100.92 16.47 25.13 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.436 -176.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 741' ' ' LYS . . . . . 0.44 ' O ' ' HD3' ' A' ' 784' ' ' LYS . 58.3 mttp -72.78 132.23 43.33 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 177.049 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 25.7 mmt -88.97 -28.51 20.2 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.727 0.299 . . . . 0.0 110.583 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -141.19 136.76 32.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.321 -177.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 744' ' ' LEU . . . . . 0.44 HD12 ' CZ ' ' A' ' 746' ' ' PHE . 0.7 OUTLIER -107.78 103.79 13.14 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 179.059 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -86.52 103.29 14.9 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.981 0.42 . . . . 0.0 110.554 177.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 746' ' ' PHE . . . . . 0.44 ' CZ ' HD12 ' A' ' 744' ' ' LEU . 72.2 m-85 -81.83 151.9 68.27 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.474 176.82 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -65.45 153.6 77.48 Favored 'Trans proline' 0 CA--C 1.531 0.367 0 C-N-CA 122.706 2.27 . . . . 0.0 112.47 178.431 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -67.15 -5.68 14.28 Favored 'Trans proline' 0 N--CA 1.474 0.352 0 C-N-CA 123.218 2.612 . . . . 0.0 113.051 179.235 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 23.2 t -71.5 -13.95 61.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.786 179.32 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.9 mp -71.51 112.59 7.75 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 175.281 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 31.1 p30 -85.3 -170.59 3.19 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.425 -179.326 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 19.5 m -57.63 -38.43 74.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.509 0.195 . . . . 0.0 111.366 -176.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 38.2 t-80 -69.64 -48.67 59.13 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.834 178.515 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -59.39 -50.6 73.32 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 121.217 0.532 . . . . 0.0 110.5 -179.178 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 755' ' ' ARG . . . . . 0.418 ' HB2' " H5'" ' A' ' 801' ' ' DGP . 22.9 mtm180 -60.9 -40.59 93.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.339 179.645 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 756' ' ' LEU . . . . . 0.535 ' HB2' " H4'" ' A' ' 801' ' ' DGP . 54.5 tp -55.54 -44.03 76.36 Favored 'General case' 0 C--N 1.332 -0.194 0 O-C-N 123.287 0.367 . . . . 0.0 110.819 178.399 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 19.2 tpt180 -59.74 -43.1 94.39 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 121.033 0.444 . . . . 0.0 110.07 179.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 48.6 t -64.83 -48.35 84.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.937 178.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -57.2 -47.25 81.74 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 110.324 -0.25 . . . . 0.0 110.324 178.407 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -52.03 -53.62 39.79 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.687 177.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 74.8 mt -65.82 -43.57 93.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.398 -175.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -64.8 -37.0 86.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.987 0.422 . . . . 0.0 110.679 179.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 763' ' ' GLU . . . . . 0.495 ' CD ' HN22 ' A' ' 801' ' ' DGP . 40.7 tt0 -69.65 -36.92 76.5 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.378 178.478 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -64.51 -49.33 71.76 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.412 175.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 13.1 m170 -69.44 -31.41 69.71 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.365 -176.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 98.77 38.41 3.9 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.203 179.031 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 78.6 mt -111.26 174.39 5.89 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 178.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 768' ' ' ARG . . . . . 0.413 HH11 ' HD2' ' A' ' 768' ' ' ARG . 21.5 ttt180 -93.52 136.6 33.63 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 178.892 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.7 p80 -142.35 134.24 27.12 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 120.648 0.261 . . . . 0.0 110.805 -177.268 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -146.56 142.91 28.48 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.345 179.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 3.3 p -127.97 125.69 39.95 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.276 176.419 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 3.0 p -157.73 -176.73 6.1 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.117 -173.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 126.96 -107.46 0.9 Allowed Glycine 0 N--CA 1.449 -0.434 0 N-CA-C 111.455 -0.658 . . . . 0.0 111.455 -179.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 774' ' ' GLU . . . . . 0.591 ' O ' ' HB2' ' A' ' 778' ' ' ARG . 44.8 mt-10 -124.82 -175.84 3.39 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 175.014 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . -71.1 -49.27 28.02 Favored Glycine 0 N--CA 1.445 -0.706 0 C-N-CA 120.094 -1.05 . . . . 0.0 111.148 174.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . 0.42 ' HZ1' ' HB2' ' A' ' 776' ' ' LYS . 0.0 OUTLIER -72.04 -38.98 69.42 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.216 -0.492 . . . . 0.0 111.159 177.461 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 777' ' ' ARG . . . . . 0.405 ' O ' ' HG2' ' A' ' 777' ' ' ARG . 33.2 ttp85 -106.91 27.93 8.48 Favored 'General case' 0 N--CA 1.439 -0.984 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.679 -170.198 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 778' ' ' ARG . . . . . 0.591 ' HB2' ' O ' ' A' ' 774' ' ' GLU . 60.8 ttt180 -72.25 111.17 7.23 Favored 'General case' 0 C--N 1.315 -0.918 0 C-N-CA 119.814 -0.754 . . . . 0.0 110.187 177.096 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 50.7 p90 -113.33 156.68 22.97 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 115.114 -0.948 . . . . 0.0 109.481 -177.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 15.2 tt -107.85 133.41 52.78 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-O 121.387 0.613 . . . . 0.0 110.733 -179.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 781' ' ' THR . . . . . 0.436 ' HA ' ' O ' ' A' ' 744' ' ' LEU . 26.7 m -116.05 115.75 26.66 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.048 177.686 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 33.5 t -91.04 134.18 30.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 176.112 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 33.7 t -125.26 137.12 54.09 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.126 0.489 . . . . 0.0 110.731 -175.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 784' ' ' LYS . . . . . 0.459 ' HG3' ' CE2' ' A' ' 736' ' ' PHE . 60.1 mtpt -86.78 -18.63 30.61 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.411 178.775 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 18.4 mmm180 -115.4 -81.42 0.61 Allowed 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.246 -178.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.244 0.794 0 CA-C-O 118.158 -0.925 . . . . 0.0 110.257 -179.409 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 801' ' ' DGP . . . . . 0.535 " H4'" ' HB2' ' A' ' 756' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_endo . . . . . 0 N--CA 1.479 0.658 0 N-CA-C 110.774 -0.51 . . . . 0.0 110.774 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.82 -36.98 1.97 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.159 0.504 . . . . 0.0 110.719 -178.628 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . 124.19 50.06 0.21 Allowed Glycine 0 N--CA 1.443 -0.873 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.16 179.384 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 11.7 p -65.51 -21.78 29.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 121.284 0.564 . . . . 0.0 110.062 176.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -66.47 146.99 53.93 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.965 176.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 33.0 t -162.0 158.53 25.21 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 178.525 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 43.3 tt0 -83.26 62.66 6.8 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.708 0.766 . . . . 0.0 109.556 179.029 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -139.06 -174.08 3.75 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 179.824 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . 57.78 48.18 83.65 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.933 -0.651 . . . . 0.0 111.882 -177.122 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 18.1 t -77.63 82.07 0.83 Allowed 'Isoleucine or valine' 0 CA--C 1.512 -0.481 0 CA-C-O 121.69 0.757 . . . . 0.0 109.127 -175.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 727' ' ' ASP . . . . . 0.443 ' HB3' ' CB ' ' A' ' 730' ' ' ARG . 13.2 t70 -107.48 133.93 51.25 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.144 -174.459 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 26.1 t60 -55.17 -52.66 62.6 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 123.473 0.483 . . . . 0.0 111.252 -178.237 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 24.7 m-85 -74.46 -35.54 63.31 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.672 -174.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 730' ' ' ARG . . . . . 0.443 ' CB ' ' HB3' ' A' ' 727' ' ' ASP . 17.1 ttp85 -64.34 -39.65 94.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.744 0.307 . . . . 0.0 110.351 178.947 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -64.06 -48.14 77.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.704 178.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 11.9 mtm -61.96 -35.42 78.42 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.145 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 733' ' ' ILE . . . . . 0.507 ' O ' ' HG3' ' A' ' 737' ' ' MET . 66.4 mt -71.72 -49.86 42.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.706 -0.224 . . . . 0.0 111.6 179.316 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 11.2 p -63.58 -34.6 68.63 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 120.988 -0.285 . . . . 0.0 111.39 -175.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -77.49 -31.18 53.46 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.95 0.405 . . . . 0.0 110.356 177.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 736' ' ' PHE . . . . . 0.502 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 0.7 OUTLIER -66.22 -37.01 84.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.447 174.489 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 737' ' ' MET . . . . . 0.507 ' HG3' ' O ' ' A' ' 733' ' ' ILE . 88.7 mtp -61.74 -28.65 69.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.013 179.408 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -102.85 9.55 38.85 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.005 -179.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 7.6 t -96.54 -164.54 1.16 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.028 -179.033 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -108.19 10.66 27.86 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.731 0.301 . . . . 0.0 111.628 -176.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 56.5 mttp -91.7 136.97 32.74 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.827 0.346 . . . . 0.0 110.541 177.679 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.86 -24.63 35.67 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.534 179.501 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -152.87 138.12 17.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.11 0.481 . . . . 0.0 111.092 177.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 744' ' ' LEU . . . . . 0.502 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 59.7 tp -102.67 105.75 16.27 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.607 -179.61 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -87.36 114.16 23.72 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.278 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . 80.9 m-85 -84.77 151.33 57.9 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.501 179.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 747' ' ' PRO . . . . . 0.425 ' HB2' ' OG ' ' A' ' 749' ' ' SER . 13.8 Cg_exo -68.33 155.71 68.28 Favored 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 122.606 2.204 . . . . 0.0 112.184 177.456 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -67.94 -3.01 9.73 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 122.995 2.463 . . . . 0.0 112.821 178.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 749' ' ' SER . . . . . 0.425 ' OG ' ' HB2' ' A' ' 747' ' ' PRO . 5.3 p -68.62 -23.18 64.42 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.251 178.648 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.7 mp -63.14 115.65 4.68 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.01 175.166 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -84.62 -171.38 3.59 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.186 -179.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 2.8 m -48.19 -54.25 14.07 Favored 'General case' 0 C--N 1.328 -0.349 0 O-C-N 123.59 0.556 . . . . 0.0 111.914 -178.387 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 34.9 m80 -73.31 -31.16 63.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.462 -175.258 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -64.47 -47.4 79.11 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 176.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 23.3 mtm180 -61.87 -45.98 91.39 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.041 177.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 756' ' ' LEU . . . . . 0.579 ' HB2' " H4'" ' A' ' 801' ' ' DGP . 57.8 tp -52.69 -41.82 64.23 Favored 'General case' 0 C--N 1.332 -0.168 0 O-C-N 123.432 0.457 . . . . 0.0 110.848 178.543 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 26.2 tpt180 -61.47 -45.91 92.26 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.952 179.357 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 99.6 t -64.83 -47.42 88.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.188 179.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -55.23 -48.6 73.69 Favored 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 178.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 63.8 mt-30 -52.74 -51.79 59.05 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.516 177.489 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 77.3 mt -66.36 -47.65 83.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.505 -175.341 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -64.22 -39.03 93.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.834 0.349 . . . . 0.0 110.463 -179.113 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -65.86 -40.79 92.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.216 178.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -66.95 -45.52 77.55 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.741 178.276 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 10.7 m170 -70.38 -27.76 64.56 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.445 -177.177 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 98.24 30.69 6.87 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.527 -0.844 . . . . 0.0 112.544 177.592 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 53.1 mt -107.05 162.78 13.55 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 177.677 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 26.0 ttp180 -84.43 132.39 34.57 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.654 -0.418 . . . . 0.0 109.893 178.698 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 4.4 p80 -130.71 123.68 29.83 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-O 121.111 0.482 . . . . 0.0 110.254 178.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -136.83 155.76 49.38 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.944 -179.002 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 9.4 t -113.05 162.01 16.4 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 178.307 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 772' ' ' SER . . . . . 0.502 ' O ' ' HA ' ' A' ' 778' ' ' ARG . 23.0 t -151.52 149.66 29.47 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.61 -179.233 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 89.13 167.96 43.36 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.988 -0.625 . . . . 0.0 111.883 -178.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -125.79 138.42 53.84 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.762 0.315 . . . . 0.0 111.007 179.113 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . 65.68 -120.43 16.9 Favored Glycine 0 N--CA 1.449 -0.488 0 CA-C-N 115.871 -0.604 . . . . 0.0 112.559 177.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 20.5 tptm -74.96 -10.83 59.85 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.271 0.558 . . . . 0.0 110.39 -179.336 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 19.6 mtt180 -91.18 -6.32 53.65 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.944 176.17 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 778' ' ' ARG . . . . . 0.502 ' HA ' ' O ' ' A' ' 772' ' ' SER . 36.9 ttt180 -81.11 120.74 25.22 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.186 0.517 . . . . 0.0 111.152 -175.092 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 45.3 p90 -134.47 174.67 10.28 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.291 -0.868 . . . . 0.0 108.809 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 8.9 tt -127.07 143.49 40.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-O 121.025 0.44 . . . . 0.0 111.166 -175.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 57.3 m -124.6 125.83 44.78 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.678 179.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 47.5 t -102.94 114.29 42.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 176.125 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 11.2 t -110.78 140.0 45.59 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.087 0.47 . . . . 0.0 110.726 -175.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -80.63 -36.48 32.55 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.955 176.138 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 19.2 mmm180 -104.13 156.07 18.19 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.098 -178.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.365 -0.826 . . . . 0.0 109.708 175.993 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 801' ' ' DGP . . . . . 0.823 ' H8 ' ' OP3' ' A' ' 801' ' ' DGP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo . . . . . 0 N--CA 1.481 0.74 0 N-CA-C 110.542 -0.599 . . . . 0.0 110.542 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -111.9 -17.26 12.95 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.334 -177.477 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . 83.27 57.21 2.53 Favored Glycine 0 N--CA 1.444 -0.773 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 -175.3 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 35.2 m -127.12 163.22 30.44 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 CA-C-O 121.186 0.517 . . . . 0.0 110.321 -176.385 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -143.89 92.59 2.35 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.695 179.216 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 50.9 m -69.91 105.7 2.91 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.848 -172.2 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -107.3 103.98 13.48 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.833 179.14 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 724' ' ' ASP . . . . . 0.53 ' CG ' ' H ' ' A' ' 725' ' ' GLY . 14.4 t70 -104.09 -156.26 0.56 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.794 -176.269 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 725' ' ' GLY . . . . . 0.53 ' H ' ' CG ' ' A' ' 724' ' ' ASP . . . 99.72 -79.95 0.5 Allowed Glycine 0 N--CA 1.445 -0.738 0 N-CA-C 111.137 -0.785 . . . . 0.0 111.137 -176.544 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 14.9 p -170.29 137.9 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 176.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 727' ' ' ASP . . . . . 0.429 ' HB3' ' CB ' ' A' ' 730' ' ' ARG . 13.4 t70 -159.71 134.98 8.19 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 177.319 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 728' ' ' HIS . . . . . 0.465 ' O ' ' HG3' ' A' ' 732' ' ' MET . 4.8 t60 -64.02 -46.55 83.96 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.452 -175.328 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -77.03 -31.38 56.28 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.007 -175.229 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 730' ' ' ARG . . . . . 0.429 ' CB ' ' HB3' ' A' ' 727' ' ' ASP . 15.7 tpt180 -57.75 -43.23 85.27 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 174.589 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -64.8 -48.22 75.22 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.665 177.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 732' ' ' MET . . . . . 0.465 ' HG3' ' O ' ' A' ' 728' ' ' HIS . 92.2 mtp -57.37 -45.76 84.08 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.933 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 733' ' ' ILE . . . . . 0.452 ' O ' ' HG3' ' A' ' 737' ' ' MET . 72.9 mt -67.17 -45.57 86.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.912 -178.236 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 11.3 p -66.98 -38.42 81.33 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 120.594 -0.442 . . . . 0.0 111.065 -176.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 735' ' ' GLU . . . . . 0.448 ' O ' ' HB2' ' A' ' 739' ' ' SER . 42.8 mt-10 -72.09 -33.35 67.82 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-O 120.842 0.353 . . . . 0.0 110.114 177.33 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 736' ' ' PHE . . . . . 0.615 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 7.0 t80 -60.12 -42.66 95.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.354 177.31 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 737' ' ' MET . . . . . 0.465 ' SD ' HD11 ' A' ' 767' ' ' LEU . 46.4 mtm -62.4 -25.8 68.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.59 -176.592 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -112.61 12.89 19.9 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.907 0.384 . . . . 0.0 111.152 -178.446 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 739' ' ' SER . . . . . 0.448 ' HB2' ' O ' ' A' ' 735' ' ' GLU . 7.7 t -94.98 7.09 47.18 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.407 -176.937 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? 65.27 16.81 10.74 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.201 -177.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -97.32 125.04 41.66 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 176.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.0 -20.11 33.36 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.147 -177.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -147.06 129.15 15.55 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.145 -174.528 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 744' ' ' LEU . . . . . 0.615 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 42.6 tp -118.61 102.29 8.76 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 110.067 -0.345 . . . . 0.0 110.067 179.805 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 11.3 mp0 -85.72 108.16 17.93 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.214 -0.448 . . . . 0.0 109.946 177.052 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -75.23 152.02 85.94 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.647 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -64.89 149.59 89.33 Favored 'Trans proline' 0 CA--C 1.53 0.316 0 C-N-CA 122.774 2.316 . . . . 0.0 112.06 177.011 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -67.31 -2.44 8.17 Favored 'Trans proline' 0 N--CA 1.474 0.346 0 C-N-CA 123.239 2.626 . . . . 0.0 113.145 -179.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 13.0 t -74.02 -18.1 60.89 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.93 179.351 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.8 mp -64.38 113.76 3.84 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.155 176.409 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 751' ' ' ASN . . . . . 0.455 ' O ' ' HG3' ' A' ' 755' ' ' ARG . 4.5 p30 -81.25 -176.69 6.11 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 -179.019 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 44.3 t -49.44 -49.11 46.59 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.515 -179.065 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 41.1 m80 -67.87 -37.54 81.94 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.524 -178.262 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -64.0 -49.68 71.53 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.142 0.496 . . . . 0.0 110.218 179.176 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 755' ' ' ARG . . . . . 0.455 ' HG3' ' O ' ' A' ' 751' ' ' ASN . 23.5 mtm180 -63.83 -38.46 91.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.208 -179.718 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 756' ' ' LEU . . . . . 0.427 ' HB2' " H4'" ' A' ' 801' ' ' DGP . 62.1 tp -54.41 -44.71 72.62 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 123.393 0.433 . . . . 0.0 110.779 177.789 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 31.2 mmm180 -58.9 -47.02 86.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.974 177.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 59.0 t -59.24 -48.47 86.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.976 178.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -57.38 -55.02 40.22 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.638 -0.255 . . . . 0.0 110.841 179.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -53.45 -46.3 69.84 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 121.097 0.475 . . . . 0.0 111.416 -178.532 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 96.4 mt -68.56 -47.52 76.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.294 -176.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -65.37 -34.1 77.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.937 0.399 . . . . 0.0 110.532 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -64.0 -35.15 79.76 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.39 178.179 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -74.81 -42.64 57.69 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 120.975 0.417 . . . . 0.0 110.848 176.66 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 11.4 m170 -65.28 -26.23 67.99 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.401 -179.127 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 93.29 20.68 31.9 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.928 -0.653 . . . . 0.0 111.838 -179.409 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 767' ' ' LEU . . . . . 0.465 HD11 ' SD ' ' A' ' 737' ' ' MET . 32.6 mt -97.62 166.49 11.48 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 -177.251 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 28.7 ttt180 -85.68 125.18 32.98 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.057 175.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 3.3 p80 -121.2 116.63 25.29 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.113 174.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 41.2 t0 -141.83 156.9 45.53 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.802 -172.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 6.1 p -126.22 144.49 50.76 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 120.982 0.42 . . . . 0.0 111.305 -175.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 772' ' ' SER . . . . . 0.41 ' O ' ' HA ' ' A' ' 778' ' ' ARG . 15.2 m -134.3 137.58 44.34 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.535 -178.323 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 773' ' ' GLY . . . . . 0.437 ' HA3' ' HA ' ' A' ' 778' ' ' ARG . . . 122.97 -176.95 16.61 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.916 -0.659 . . . . 0.0 112.727 177.795 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -84.88 -92.64 0.08 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.559 0.219 . . . . 0.0 111.385 -176.299 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . -118.91 -82.64 0.81 Allowed Glycine 0 N--CA 1.451 -0.345 0 N-CA-C 111.536 -0.626 . . . . 0.0 111.536 178.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 21.3 tptm -70.93 -26.13 63.05 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.388 0.613 . . . . 0.0 109.593 175.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 3.3 mmt180 -86.56 8.24 22.93 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.044 175.529 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 778' ' ' ARG . . . . . 0.437 ' HA ' ' HA3' ' A' ' 773' ' ' GLY . 46.6 ttt85 -97.84 110.84 23.33 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 121.46 0.648 . . . . 0.0 110.717 177.525 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 50.4 p90 -110.92 172.68 6.73 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.819 -177.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 12.7 tt -116.06 143.0 27.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-O 121.1 0.476 . . . . 0.0 110.519 -179.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 49.5 m -129.72 130.15 45.09 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.639 179.342 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 98.7 t -106.85 132.27 54.6 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.722 178.223 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 16.4 m -124.88 139.41 53.86 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.208 -179.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp -68.57 137.59 54.42 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.49 -177.287 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 16.0 mmm180 -147.47 98.72 3.03 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.394 -179.266 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.514 -0.755 . . . . 0.0 110.384 179.026 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 801' ' ' DGP . . . . . 0.926 " H3'" ' OP3' ' A' ' 801' ' ' DGP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 728' ' ' HIS . . . . . 0.478 ' O ' ' HG2' ' A' ' 732' ' ' MET . 51.1 t60 . . . . . 0 CA--C 1.52 -0.199 0 CA-C-O 120.739 0.304 . . . . 0.0 110.885 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 729' ' ' PHE . . . . . 0.419 ' CZ ' ' HB3' ' A' ' 754' ' ' ASP . 66.1 m-85 -71.96 -32.48 67.33 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.314 -173.804 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 17.2 ttt180 -67.99 -35.13 77.81 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.152 177.259 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -67.17 -39.84 86.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.324 176.015 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 732' ' ' MET . . . . . 0.478 ' HG2' ' O ' ' A' ' 728' ' ' HIS . 38.7 mmm -61.86 -40.46 95.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.681 177.729 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 733' ' ' ILE . . . . . 0.413 ' O ' ' HG3' ' A' ' 737' ' ' MET . 64.5 mt -71.53 -42.99 72.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.898 -178.932 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 8.0 p -64.7 -35.37 74.71 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 C-N-CA 120.738 -0.385 . . . . 0.0 110.763 -177.871 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -66.33 -47.35 73.79 Favored 'General case' 0 CA--C 1.522 -0.124 0 CA-C-O 121.25 0.547 . . . . 0.0 109.577 173.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 736' ' ' PHE . . . . . 0.599 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 45.2 t80 -52.96 -42.73 65.78 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.015 -0.993 . . . . 0.0 111.676 179.014 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 737' ' ' MET . . . . . 0.413 ' HG3' ' O ' ' A' ' 733' ' ' ILE . 83.6 mtp -61.08 -32.68 72.33 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.673 -177.594 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -101.02 2.38 40.49 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.488 -177.224 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 60.7 m -98.44 174.45 6.46 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.18 0.514 . . . . 0.0 112.049 -175.57 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 16.5 ptmt -74.43 -18.26 60.67 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.726 177.023 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 29.9 mttm -57.93 111.18 1.08 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.101 -178.489 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 26.6 ptt? -78.1 -22.21 49.27 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.219 0.533 . . . . 0.0 109.717 175.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 28.6 pt20 -143.19 135.99 27.7 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.329 -0.851 . . . . 0.0 109.698 178.152 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 744' ' ' LEU . . . . . 0.599 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 36.4 tp -105.69 105.77 15.96 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 179.095 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -86.47 115.41 23.95 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.146 -0.933 . . . . 0.0 110.208 178.613 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 746' ' ' PHE . . . . . 0.409 ' HA ' ' HD3' ' A' ' 747' ' ' PRO . 68.3 m-85 -90.34 149.73 41.68 Favored Pre-proline 0 C--N 1.319 -0.737 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.756 177.978 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 747' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 746' ' ' PHE . 11.3 Cg_exo -69.32 156.04 65.62 Favored 'Trans proline' 0 N--CA 1.462 -0.358 0 C-N-CA 122.758 2.305 . . . . 0.0 111.953 177.057 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -66.15 -4.13 9.82 Favored 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 122.73 2.286 . . . . 0.0 112.771 176.84 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 32.9 t -67.04 -16.52 64.41 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.516 179.225 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.8 mp -71.97 128.63 36.33 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.699 0.285 . . . . 0.0 110.391 177.719 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 751' ' ' ASN . . . . . 0.489 ' O ' ' HG3' ' A' ' 755' ' ' ARG . 4.7 p30 -93.97 -176.89 4.15 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 175.469 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 20.7 t -54.13 -41.81 68.8 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 122.971 0.169 . . . . 0.0 111.303 -177.314 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 49.1 t-80 -65.06 -45.47 85.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.68 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 754' ' ' ASP . . . . . 0.419 ' HB3' ' CZ ' ' A' ' 729' ' ' PHE . 45.2 m-20 -62.03 -43.17 99.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.222 0.534 . . . . 0.0 110.057 -177.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 755' ' ' ARG . . . . . 0.489 ' HG3' ' O ' ' A' ' 751' ' ' ASN . 70.9 mtt-85 -65.21 -46.56 80.21 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.964 177.972 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 56.1 tp -52.78 -40.87 63.57 Favored 'General case' 0 N--CA 1.463 0.223 0 O-C-N 123.443 0.465 . . . . 0.0 110.533 177.856 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 757' ' ' ARG . . . . . 0.565 ' HE ' ' HA ' ' A' ' 757' ' ' ARG . 1.6 tpm_? -57.65 -50.81 71.94 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.248 176.545 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 61.2 t -63.15 -48.08 89.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.297 -179.095 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -55.74 -46.72 77.75 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.425 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 64.4 mt-30 -56.89 -52.96 63.11 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.949 0.404 . . . . 0.0 111.607 178.463 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 76.1 mt -65.55 -47.12 87.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.356 -175.201 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -63.74 -36.55 84.23 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.744 0.307 . . . . 0.0 110.876 -178.833 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -65.98 -39.16 90.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.719 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -73.99 -39.66 63.5 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.124 178.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 10.5 m170 -70.43 -34.97 73.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.086 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 107.4 31.41 3.77 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.414 -0.898 . . . . 0.0 112.925 176.46 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 29.3 mt -111.14 164.75 12.52 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 179.354 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 70.8 ttt-85 -88.5 132.99 34.27 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 -179.398 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.0 p80 -134.34 130.85 37.57 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.566 -177.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -155.43 146.22 22.29 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.831 -177.629 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 771' ' ' SER . . . . . 0.409 ' HA ' ' HA ' ' A' ' 780' ' ' ILE . 4.3 m . . . . . 0 N--CA 1.443 -0.793 0 CA-C-O 121.227 0.537 . . . . 0.0 109.823 176.824 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 37.0 p90 . . . . . 0 N--CA 1.451 -0.403 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 780' ' ' ILE . . . . . 0.409 ' HA ' ' HA ' ' A' ' 771' ' ' SER . 8.0 tt -116.22 133.54 62.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-O 121.12 0.486 . . . . 0.0 110.904 -177.827 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 4.0 m -115.17 124.73 52.2 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.365 -178.442 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 60.0 t -104.89 129.71 57.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 174.65 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 41.5 t -118.93 143.74 46.84 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.136 0.493 . . . . 0.0 110.979 -177.294 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 784' ' ' LYS . . . . . 0.56 ' HG3' ' CZ ' ' A' ' 736' ' ' PHE . 62.6 mtpt . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.973 -179.449 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 13.5 t60 . . . . . 0 N--CA 1.455 -0.201 0 CA-C-O 121.065 0.459 . . . . 0.0 110.638 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -77.53 -36.93 51.92 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.398 -172.603 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 53.2 ttp180 -59.92 -41.02 90.85 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 175.659 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -65.76 -45.59 81.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.714 178.045 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 19.3 mmm -58.24 -45.02 88.49 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.93 178.089 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 74.9 mt -70.71 -43.39 77.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.827 -177.461 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 8.5 p -66.28 -35.5 75.12 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.14 -177.5 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -77.15 -27.6 53.9 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-O 120.789 0.328 . . . . 0.0 110.449 176.418 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 736' ' ' PHE . . . . . 0.507 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 25.7 t80 -65.34 -41.1 94.28 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.299 178.015 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 65.6 mtm -63.58 -29.71 70.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.071 0.463 . . . . 0.0 110.518 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -96.45 8.45 44.03 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.026 -0.533 . . . . 0.0 111.097 179.252 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 44.2 t -93.68 165.88 12.5 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.363 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -84.91 -1.65 56.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.292 -179.02 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -73.79 160.47 31.44 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.719 179.224 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 4.4 mpp? -108.89 -28.56 9.09 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.217 175.102 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 26.9 pt20 -142.92 127.68 18.18 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.211 0.529 . . . . 0.0 111.145 178.846 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 744' ' ' LEU . . . . . 0.507 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 52.7 tp -96.73 106.13 18.37 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.312 179.057 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -90.94 106.07 18.26 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.089 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -75.14 157.18 85.44 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.19 -177.407 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 747' ' ' PRO . . . . . 0.411 ' HA ' ' HD3' ' A' ' 748' ' ' PRO . 19.6 Cg_exo -68.33 161.8 43.2 Favored 'Trans proline' 0 CA--C 1.535 0.539 0 C-N-CA 122.641 2.228 . . . . 0.0 112.057 175.125 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 748' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 747' ' ' PRO . 5.5 Cg_exo -76.39 -9.75 18.89 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.505 2.137 . . . . 0.0 111.753 178.742 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 20.1 t -64.07 -21.44 66.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.427 -179.139 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 11.2 mp -61.5 121.24 12.21 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.655 -0.248 . . . . 0.0 110.74 178.578 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 751' ' ' ASN . . . . . 0.489 ' O ' ' HG2' ' A' ' 755' ' ' ARG . 3.4 p-10 -90.72 -176.65 4.77 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 177.661 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 15.1 m -50.11 -49.83 50.42 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -173.418 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 38.7 t-80 -54.04 -47.9 71.11 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.977 177.368 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 754' ' ' ASP . . . . . 0.491 ' O ' HG23 ' A' ' 758' ' ' VAL . 57.9 m-20 -62.75 -45.43 92.76 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.629 -176.86 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 755' ' ' ARG . . . . . 0.489 ' HG2' ' O ' ' A' ' 751' ' ' ASN . 23.7 mmt180 -52.99 -60.59 3.09 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.835 176.263 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -52.62 -45.04 66.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 114.654 -1.157 . . . . 0.0 111.269 -177.298 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 10.2 mmt85 -55.48 -49.04 73.56 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.991 178.366 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 758' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 754' ' ' ASP . 63.1 t -62.71 -45.34 99.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.738 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -55.69 -54.33 45.61 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.824 179.588 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 99.3 mt-30 -54.69 -52.04 63.65 Favored 'General case' 0 C--O 1.232 0.183 0 O-C-N 123.25 0.344 . . . . 0.0 111.528 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 94.3 mt -62.77 -50.42 79.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.228 -176.578 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -64.1 -38.78 92.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.842 0.353 . . . . 0.0 111.166 -178.078 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -66.25 -35.83 81.43 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.035 -178.8 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -85.19 -29.55 24.63 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.757 0.313 . . . . 0.0 110.942 -178.65 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 6.7 m170 -70.08 -24.44 63.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.835 0.35 . . . . 0.0 110.598 174.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 96.2 28.82 8.88 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.871 -0.681 . . . . 0.0 112.366 177.925 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 56.0 mt -105.08 170.89 7.61 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 768' ' ' ARG . . . . . 0.566 ' HB3' ' OG ' ' A' ' 783' ' ' SER . 30.4 ttt180 -98.89 140.12 33.53 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 -178.06 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -150.92 134.05 16.04 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.28 0.562 . . . . 0.0 111.782 -176.688 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -155.47 168.23 27.79 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.493 175.291 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 7.2 m . . . . . 0 C--N 1.318 -0.799 0 CA-C-O 121.12 0.486 . . . . 0.0 110.694 -176.76 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 49.0 p90 . . . . . 0 N--CA 1.448 -0.551 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 6.2 tt -121.13 135.64 60.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.85 0.357 . . . . 0.0 110.68 -178.152 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 29.5 m -116.97 124.86 50.39 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.697 -177.403 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 47.5 t -108.53 124.06 64.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.095 176.805 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 783' ' ' SER . . . . . 0.566 ' OG ' ' HB3' ' A' ' 768' ' ' ARG . 4.6 p -113.37 140.78 47.75 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 121.311 0.577 . . . . 0.0 111.099 -179.59 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 784' ' ' LYS . . . . . 0.481 ' HG3' ' CZ ' ' A' ' 736' ' ' PHE . 62.7 mtpt . . . . . 0 C--N 1.326 -0.439 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.084 179.231 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 10.6 t60 . . . . . 0 N--CA 1.461 0.082 0 CA-C-O 120.801 0.334 . . . . 0.0 111.202 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -69.38 -32.96 72.33 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.832 -174.294 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 57.8 ttm-85 -64.2 -45.78 86.82 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.227 177.868 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 731' ' ' ALA . . . . . 0.438 ' HA ' HG12 ' A' ' 734' ' ' VAL . . . -62.24 -42.68 99.53 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.727 179.619 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 26.8 mmm -59.3 -44.71 92.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.687 177.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 733' ' ' ILE . . . . . 0.422 HD11 HG13 ' A' ' 758' ' ' VAL . 66.7 mt -74.01 -43.04 52.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.146 -0.479 . . . . 0.0 112.174 -176.724 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 734' ' ' VAL . . . . . 0.438 HG12 ' HA ' ' A' ' 731' ' ' ALA . 12.1 p -64.62 -40.3 88.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.19 -176.67 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -77.45 -26.38 51.45 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.367 178.231 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 736' ' ' PHE . . . . . 0.47 ' CZ ' ' HG3' ' A' ' 784' ' ' LYS . 23.8 t80 -60.52 -39.97 89.75 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.756 174.432 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 67.7 mtm -63.54 -25.38 68.22 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.02 0.438 . . . . 0.0 110.698 177.858 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -96.96 3.07 52.22 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.26 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 67.0 m -101.52 170.99 7.84 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.801 0.334 . . . . 0.0 110.992 -178.59 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -85.43 -11.27 54.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.389 -176.939 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -63.98 128.53 36.24 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.473 176.612 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 742' ' ' MET . . . . . 0.401 ' HG3' ' HG3' ' A' ' 743' ' ' GLN . 14.5 ptp -83.57 -24.71 31.44 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.838 0.351 . . . . 0.0 110.407 175.846 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 743' ' ' GLN . . . . . 0.401 ' HG3' ' HG3' ' A' ' 742' ' ' MET . 52.0 mt-30 -134.63 131.83 38.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.286 -178.266 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 744' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -94.71 98.63 10.91 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 175.211 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -83.29 101.3 11.19 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.386 -178.878 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 746' ' ' PHE . . . . . 0.426 ' HA ' ' HD3' ' A' ' 747' ' ' PRO . 68.1 m-85 -85.56 148.29 48.82 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.734 179.586 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 747' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 746' ' ' PHE . 14.8 Cg_exo -68.29 155.0 70.87 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 122.68 2.253 . . . . 0.0 112.028 176.693 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -68.02 -8.71 23.48 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.729 2.286 . . . . 0.0 112.46 178.688 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 32.1 t -63.14 -22.67 67.02 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.284 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 11.2 mp -59.29 118.54 6.06 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 175.724 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 751' ' ' ASN . . . . . 0.408 HD21 ' HB2' ' A' ' 753' ' ' HIS . 1.0 OUTLIER -81.02 -178.2 6.78 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 179.494 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 14.0 p -54.63 -42.6 71.4 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.688 0.28 . . . . 0.0 111.201 -178.309 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 753' ' ' HIS . . . . . 0.408 ' HB2' HD21 ' A' ' 751' ' ' ASN . 75.6 m80 -68.99 -40.0 79.03 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.886 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 41.5 m-20 -59.8 -51.0 71.62 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 121.07 0.462 . . . . 0.0 110.261 178.634 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 43.8 mtt180 -64.96 -43.72 91.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.519 -178.181 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 55.7 tp -54.26 -41.47 68.84 Favored 'General case' 0 C--N 1.33 -0.242 0 O-C-N 123.367 0.417 . . . . 0.0 110.292 177.518 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 757' ' ' ARG . . . . . 0.616 ' HE ' ' HA ' ' A' ' 757' ' ' ARG . 0.7 OUTLIER -60.39 -48.22 82.68 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.065 176.886 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 758' ' ' VAL . . . . . 0.422 HG13 HD11 ' A' ' 733' ' ' ILE . 58.7 t -59.75 -50.18 81.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.022 178.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -55.26 -50.18 70.15 Favored 'General case' 0 C--O 1.226 -0.156 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.557 179.148 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -63.93 -37.72 88.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.829 -177.624 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 96.3 mt -69.54 -44.11 80.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 120.8 0.333 . . . . 0.0 110.65 178.914 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -66.01 -34.98 79.34 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.201 0.525 . . . . 0.0 110.182 177.35 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -66.53 -38.32 86.92 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.41 175.79 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -69.77 -42.81 73.33 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.906 177.771 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 11.7 m170 -75.24 -29.33 60.19 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.88 -178.836 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 92.99 43.49 4.1 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.117 178.51 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 82.8 mt -110.35 -170.16 1.59 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.923 0.392 . . . . 0.0 110.544 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 768' ' ' ARG . . . . . 0.435 ' HD3' ' HB2' ' A' ' 783' ' ' SER . 60.3 ttt-85 -106.67 126.63 52.52 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.822 -179.226 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -139.77 132.44 28.92 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.066 0.46 . . . . 0.0 111.243 -177.018 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -156.36 138.87 14.94 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.668 -176.615 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 771' ' ' SER . . . . . 0.424 ' HA ' ' HA ' ' A' ' 780' ' ' ILE . 19.2 m . . . . . 0 C--N 1.321 -0.65 0 CA-C-O 121.047 0.451 . . . . 0.0 110.191 178.172 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 779' ' ' PHE . . . . . 0.413 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 28.4 p90 . . . . . 0 N--CA 1.454 -0.234 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 780' ' ' ILE . . . . . 0.424 ' HA ' ' HA ' ' A' ' 771' ' ' SER . 9.8 tt -127.96 131.82 69.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 121.198 0.523 . . . . 0.0 111.238 -177.779 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 13.4 m -113.71 119.22 36.66 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.345 -178.247 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 43.3 t -102.09 121.15 52.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.007 177.2 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 783' ' ' SER . . . . . 0.435 ' HB2' ' HD3' ' A' ' 768' ' ' ARG . 4.2 m -109.3 138.96 44.85 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-O 120.738 0.304 . . . . 0.0 110.322 -179.128 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 784' ' ' LYS . . . . . 0.47 ' HG3' ' CZ ' ' A' ' 736' ' ' PHE . 61.4 mtpt . . . . . 0 C--N 1.324 -0.533 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.663 178.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 15.6 t60 . . . . . 0 N--CA 1.462 0.17 0 CA-C-O 120.66 0.267 . . . . 0.0 110.63 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -71.21 -33.01 69.52 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.466 -0.333 . . . . 0.0 110.755 -175.083 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 10.4 tpt180 -55.31 -47.74 75.16 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.938 0.399 . . . . 0.0 110.355 173.054 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 731' ' ' ALA . . . . . 0.408 ' HA ' HG12 ' A' ' 734' ' ' VAL . . . -64.89 -42.34 94.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.43 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 35.6 mmm -60.62 -39.6 88.81 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.011 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 733' ' ' ILE . . . . . 0.435 HD11 HG13 ' A' ' 758' ' ' VAL . 74.3 mt -74.93 -45.45 43.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.781 -178.412 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 734' ' ' VAL . . . . . 0.408 HG12 ' HA ' ' A' ' 731' ' ' ALA . 11.3 p -66.33 -37.42 79.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 C-N-CA 120.648 -0.421 . . . . 0.0 110.911 -177.577 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -80.59 -21.6 41.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.752 0.311 . . . . 0.0 110.374 178.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 736' ' ' PHE . . . . . 0.599 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 15.8 t80 -61.16 -46.08 91.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.532 174.015 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 64.7 mtm -60.66 -34.53 74.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.546 178.036 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -78.86 -29.63 44.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.182 -179.144 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 68.6 m -73.55 -17.64 61.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.064 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 58.5 mttp 69.99 17.25 7.46 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 173.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 741' ' ' LYS . . . . . 0.474 ' HE2' ' O ' ' A' ' 743' ' ' GLN . 46.1 mtpt -69.7 139.01 53.38 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 172.13 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -73.31 -31.14 63.84 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.854 0.359 . . . . 0.0 110.675 -178.666 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 743' ' ' GLN . . . . . 0.474 ' O ' ' HE2' ' A' ' 741' ' ' LYS . 54.9 mt-30 -143.73 136.94 27.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.943 -0.572 . . . . 0.0 109.726 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 744' ' ' LEU . . . . . 0.599 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 52.9 tp -112.24 110.74 21.16 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 176.235 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 745' ' ' GLU . . . . . 0.411 ' H ' ' CD ' ' A' ' 745' ' ' GLU . 0.7 OUTLIER -86.07 108.02 18.08 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.741 178.616 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . 60.6 m-85 -78.97 154.33 77.73 Favored Pre-proline 0 C--N 1.322 -0.623 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.401 177.771 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 747' ' ' PRO . . . . . 0.46 ' O ' HD13 ' A' ' 750' ' ' LEU . 31.5 Cg_exo -60.4 147.78 92.83 Favored 'Trans proline' 0 CA--C 1.529 0.269 0 C-N-CA 122.689 2.259 . . . . 0.0 112.233 178.029 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -70.73 -7.45 21.37 Favored 'Trans proline' 0 CA--C 1.528 0.187 0 C-N-CA 122.704 2.269 . . . . 0.0 112.689 179.648 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 24.6 m -71.11 -16.88 62.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.377 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 750' ' ' LEU . . . . . 0.46 HD13 ' O ' ' A' ' 747' ' ' PRO . 10.9 mp -59.97 118.91 6.82 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.096 174.429 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -88.11 -178.69 6.02 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 177.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 19.7 m -53.19 -31.41 42.69 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -176.675 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -79.42 -37.72 36.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.457 0.17 . . . . 0.0 111.124 -179.194 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 754' ' ' ASP . . . . . 0.428 ' HB3' ' HG ' ' A' ' 750' ' ' LEU . 67.6 m-20 -66.43 -44.39 83.02 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.222 0.534 . . . . 0.0 109.758 177.77 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 74.8 mtt180 -60.6 -50.28 74.16 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.179 177.309 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 55.8 tp -54.54 -39.69 67.93 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.702 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 757' ' ' ARG . . . . . 0.416 ' HB3' ' O ' ' A' ' 754' ' ' ASP . 3.8 tpt180 -55.98 -51.78 66.52 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.202 175.305 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 758' ' ' VAL . . . . . 0.435 HG13 HD11 ' A' ' 733' ' ' ILE . 85.5 t -61.33 -49.22 85.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.974 179.356 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 89.6 m-70 -53.59 -56.28 18.5 Favored 'General case' 0 N--CA 1.463 0.217 0 O-C-N 123.419 0.449 . . . . 0.0 110.838 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -55.97 -45.24 78.98 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.057 0.392 . . . . 0.0 112.057 -179.173 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 98.5 mt -66.69 -48.55 79.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.574 0.226 . . . . 0.0 111.069 -178.385 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -65.44 -32.13 73.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.916 0.389 . . . . 0.0 110.68 -179.029 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -69.74 -33.45 72.47 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.347 178.56 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -73.46 -35.85 65.77 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.018 176.687 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 -67.19 -35.98 80.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.682 175.744 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 102.01 19.02 15.81 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.18 -179.251 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 71.2 mt -92.35 178.48 5.82 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 18.4 ttt180 -96.43 140.04 31.67 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 174.494 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.1 p80 -145.63 123.31 11.85 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.22 -179.552 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -151.07 167.52 27.43 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.07 -179.135 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 15.1 m . . . . . 0 C--N 1.318 -0.761 0 CA-C-O 121.029 0.443 . . . . 0.0 110.745 -177.671 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 45.7 p90 . . . . . 0 N--CA 1.449 -0.518 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 12.2 tt -102.49 132.59 48.24 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-O 121.155 0.503 . . . . 0.0 110.489 -179.495 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 6.1 m -113.6 118.75 35.27 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.047 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 50.4 t -98.57 130.23 47.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 177.628 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 8.5 t -122.26 142.26 50.64 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.063 0.459 . . . . 0.0 110.249 -177.856 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 9.6 mtpm? . . . . . 0 C--N 1.324 -0.542 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.751 -178.638 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 14.3 t60 . . . . . 0 N--CA 1.463 0.222 0 CA-C-O 120.767 0.317 . . . . 0.0 111.621 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -72.35 -22.6 61.13 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.903 -175.283 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 730' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 730' ' ' ARG . 0.4 OUTLIER -60.7 -49.59 76.9 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 172.658 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 731' ' ' ALA . . . . . 0.512 ' HA ' HG12 ' A' ' 734' ' ' VAL . . . -59.81 -46.15 90.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.548 178.517 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 35.5 mmm -55.48 -44.55 76.58 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.011 178.222 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 59.1 mt -77.38 -38.22 26.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.188 -0.46 . . . . 0.0 112.003 -176.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 734' ' ' VAL . . . . . 0.512 HG12 ' HA ' ' A' ' 731' ' ' ALA . 8.8 p -68.01 -36.69 76.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 O-C-N 122.036 -0.415 . . . . 0.0 110.666 -178.724 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -73.47 -31.77 63.96 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 121.153 0.501 . . . . 0.0 109.804 175.55 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 736' ' ' PHE . . . . . 0.535 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 22.1 t80 -63.46 -40.82 98.15 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.824 175.293 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 737' ' ' MET . . . . . 0.437 ' SD ' HD11 ' A' ' 767' ' ' LEU . 73.2 mtm -72.99 -6.86 48.26 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.998 0.428 . . . . 0.0 110.833 177.237 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -103.24 0.46 31.63 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.857 174.099 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 32.8 t -102.67 169.77 8.43 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.28 -178.168 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 2.6 ptmt -90.9 -6.54 54.01 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.063 -177.017 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 741' ' ' LYS . . . . . 0.542 ' O ' ' HE2' ' A' ' 784' ' ' LYS . 27.6 mtpp -64.47 126.25 27.23 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.586 177.668 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 3.2 mpp? -67.73 -30.32 69.77 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.439 176.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -149.17 155.0 39.99 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 120.904 0.383 . . . . 0.0 111.372 176.696 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 744' ' ' LEU . . . . . 0.535 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 69.0 tp -115.17 111.31 20.8 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.277 -176.841 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -82.72 105.74 13.99 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.417 178.836 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 746' ' ' PHE . . . . . 0.467 ' O ' ' HB2' ' A' ' 779' ' ' PHE . 71.8 m-85 -79.01 154.81 77.71 Favored Pre-proline 0 C--N 1.325 -0.489 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 176.254 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 747' ' ' PRO . . . . . 0.445 ' O ' HD13 ' A' ' 750' ' ' LEU . 59.6 Cg_endo -76.4 156.39 36.84 Favored 'Trans proline' 0 CA--C 1.533 0.452 0 C-N-CA 122.453 2.102 . . . . 0.0 112.24 178.295 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -68.75 -5.12 14.68 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.959 2.44 . . . . 0.0 113.203 -179.632 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 4.4 p -69.23 -16.93 63.71 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.86 -178.827 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 750' ' ' LEU . . . . . 0.445 HD13 ' O ' ' A' ' 747' ' ' PRO . 11.2 mp -63.55 117.98 7.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.337 176.057 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -78.8 -176.95 5.22 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.882 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 20.0 t -54.47 -39.51 67.53 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 120.768 0.318 . . . . 0.0 110.871 -177.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 40.1 m80 -73.25 -38.83 65.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.304 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 754' ' ' ASP . . . . . 0.423 ' HB3' ' HG ' ' A' ' 750' ' ' LEU . 66.2 m-20 -63.37 -48.1 79.31 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.928 0.394 . . . . 0.0 110.259 179.287 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 74.0 mtt180 -60.62 -46.77 89.02 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.985 177.518 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 60.9 tp -55.2 -44.38 75.28 Favored 'General case' 0 CA--C 1.523 -0.066 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.727 179.353 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 757' ' ' ARG . . . . . 0.457 ' HE ' ' HA ' ' A' ' 757' ' ' ARG . 2.6 mmp_? -51.5 -54.82 23.19 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.474 174.598 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 90.6 t -60.21 -46.79 94.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.495 -178.136 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -56.93 -52.22 66.04 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 110.314 -0.254 . . . . 0.0 110.314 178.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 99.3 mt-30 -56.71 -43.68 80.82 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.462 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 95.4 mt -67.08 -50.06 67.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.257 -178.269 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -62.14 -38.66 89.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.045 0.45 . . . . 0.0 110.523 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -68.03 -30.68 69.97 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.554 178.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -76.49 -42.42 43.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.502 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 38.0 m-70 -75.41 -28.34 59.37 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.956 -179.523 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 103.67 24.42 7.79 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.657 177.411 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 767' ' ' LEU . . . . . 0.437 HD11 ' SD ' ' A' ' 737' ' ' MET . 79.2 mt -96.16 164.34 12.72 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.878 -0.415 . . . . 0.0 109.878 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 37.9 ttp180 -93.63 112.92 24.9 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.953 0.406 . . . . 0.0 110.151 -178.832 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 769' ' ' HIS . . . . . 0.442 ' H ' ' CD2' ' A' ' 769' ' ' HIS . 2.9 p80 -108.54 124.25 50.17 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.625 -178.229 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -137.7 130.27 29.7 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.298 -179.584 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 771' ' ' SER . . . . . 0.448 ' HA ' ' HA ' ' A' ' 780' ' ' ILE . 12.5 p . . . . . 0 C--N 1.314 -0.963 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.794 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 779' ' ' PHE . . . . . 0.467 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 48.1 p90 . . . . . 0 N--CA 1.448 -0.563 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 780' ' ' ILE . . . . . 0.448 ' HA ' ' HA ' ' A' ' 771' ' ' SER . 12.3 tt -120.68 138.39 51.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 121.063 0.459 . . . . 0.0 110.79 -178.696 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 8.8 m -121.86 120.91 35.92 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.374 -179.674 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 50.1 t -99.8 115.6 41.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 177.363 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 29.2 t -110.92 136.18 50.34 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 121.266 0.555 . . . . 0.0 110.553 -178.304 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 784' ' ' LYS . . . . . 0.542 ' HE2' ' O ' ' A' ' 741' ' ' LYS . 52.8 mtmt . . . . . 0 C--N 1.324 -0.506 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.136 178.509 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 13.4 t60 . . . . . 0 N--CA 1.455 -0.186 0 CA-C-O 120.538 0.209 . . . . 0.0 110.793 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -71.97 -38.27 69.76 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.994 -176.459 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 42.1 ttt85 -62.54 -38.84 91.58 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.184 176.823 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -64.65 -45.56 86.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.241 176.639 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 32.9 mmm -58.01 -42.74 85.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.886 177.849 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 733' ' ' ILE . . . . . 0.43 HD11 HG13 ' A' ' 758' ' ' VAL . 72.8 mt -72.25 -42.92 66.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 N-CA-C 111.908 0.336 . . . . 0.0 111.908 -177.889 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 8.2 p -65.97 -36.99 78.82 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.576 -178.124 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -78.21 -24.44 47.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.073 0.463 . . . . 0.0 110.405 177.132 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 736' ' ' PHE . . . . . 0.551 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 34.9 t80 -64.43 -41.59 96.49 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.537 175.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 59.7 mtm -64.02 -28.81 70.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.844 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -85.81 -15.29 42.45 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.229 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 61.6 m -81.33 166.87 20.09 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.45 -179.271 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.98 7.22 44.94 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.924 0.392 . . . . 0.0 111.466 -179.579 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 73.5 mttt -85.22 126.92 34.06 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.024 173.638 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 95.5 mmm -81.6 -17.88 46.71 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.886 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -138.76 136.21 35.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.684 -178.178 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 744' ' ' LEU . . . . . 0.551 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 44.3 tp -120.17 109.97 16.06 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.096 178.62 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -90.09 113.08 24.75 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.457 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 746' ' ' PHE . . . . . 0.484 ' O ' ' HB2' ' A' ' 779' ' ' PHE . 84.1 m-85 -83.08 153.47 66.59 Favored Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.964 176.338 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 747' ' ' PRO . . . . . 0.438 ' O ' HD13 ' A' ' 750' ' ' LEU . 16.8 Cg_exo -67.18 155.79 69.1 Favored 'Trans proline' 0 CA--C 1.532 0.394 0 C-N-CA 122.508 2.139 . . . . 0.0 112.44 178.445 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -68.19 -7.71 20.73 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.838 2.359 . . . . 0.0 112.394 177.216 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 7.3 m -63.89 -20.25 65.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.552 179.403 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 750' ' ' LEU . . . . . 0.438 HD13 ' O ' ' A' ' 747' ' ' PRO . 11.2 mp -63.34 122.74 16.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.352 176.445 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 1.6 p30 -84.42 -178.61 6.96 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.341 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 15.2 m -48.55 -46.57 39.11 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 123.166 0.291 . . . . 0.0 111.381 179.726 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 50.9 m80 -72.03 -36.9 69.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.636 -178.212 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 -60.36 -50.67 72.69 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.133 0.492 . . . . 0.0 109.801 178.455 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 62.8 mtt85 -61.0 -45.15 95.98 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.181 178.334 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 756' ' ' LEU . . . . . 0.424 HD11 HE21 ' A' ' 760' ' ' GLN . 53.4 tp -52.98 -42.81 65.89 Favored 'General case' 0 C--O 1.235 0.334 0 O-C-N 123.535 0.522 . . . . 0.0 111.03 -179.685 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 11.0 mmm180 -58.83 -53.69 55.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.017 176.168 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 758' ' ' VAL . . . . . 0.43 HG13 HD11 ' A' ' 733' ' ' ILE . 60.9 t -56.79 -48.68 80.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.401 -179.378 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -55.28 -55.3 33.01 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.596 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 760' ' ' GLN . . . . . 0.424 HE21 HD11 ' A' ' 756' ' ' LEU . 70.3 mt-30 -64.47 -33.37 75.73 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 -176.776 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 96.9 mt -70.14 -48.64 60.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 C-N-CA 120.894 -0.323 . . . . 0.0 110.464 178.057 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -63.49 -34.6 78.13 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.167 0.508 . . . . 0.0 110.28 177.67 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -64.28 -36.7 84.94 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.652 176.838 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -70.02 -46.54 64.85 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.189 176.02 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 11.2 m-70 -65.15 -30.12 71.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.108 -178.139 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 95.01 25.18 15.03 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.767 -0.73 . . . . 0.0 111.825 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 68.1 mt -99.3 176.93 5.36 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 22.6 ttp180 -99.66 135.29 41.29 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -132.69 127.69 35.33 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.189 0.518 . . . . 0.0 110.691 -178.653 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -133.85 143.12 48.12 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.98 -177.268 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 12.7 p . . . . . 0 C--N 1.317 -0.848 0 CA-C-O 121.275 0.56 . . . . 0.0 110.296 175.962 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 779' ' ' PHE . . . . . 0.484 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 44.4 p90 . . . . . 0 N--CA 1.448 -0.57 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 12.6 tt -127.5 133.82 66.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-O 120.984 0.421 . . . . 0.0 110.773 -178.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 24.7 m -119.71 116.01 25.08 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.415 -179.774 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 38.0 t -94.36 133.88 33.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.872 179.661 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -117.02 135.03 54.01 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.764 0.316 . . . . 0.0 111.16 -179.421 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 23.2 mtpp . . . . . 0 C--O 1.234 0.237 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.171 175.267 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 30.6 t60 . . . . . 0 C--O 1.233 0.202 0 CA-C-O 120.843 0.354 . . . . 0.0 111.359 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 729' ' ' PHE . . . . . 0.467 ' CZ ' ' HB3' ' A' ' 754' ' ' ASP . 55.6 m-85 -80.98 -36.47 30.69 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.679 -175.769 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 15.2 tpp85 -56.95 -43.72 81.86 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 174.427 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -64.63 -47.46 78.45 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.239 -179.556 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 4.5 mtm -65.78 -35.52 80.95 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.164 -178.428 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 733' ' ' ILE . . . . . 0.507 HD11 HG13 ' A' ' 758' ' ' VAL . 81.2 mt -73.27 -42.78 57.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.581 -0.282 . . . . 0.0 111.535 179.392 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 9.1 p -66.06 -37.53 79.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 120.594 -0.442 . . . . 0.0 110.975 -176.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -75.14 -29.3 60.45 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.881 0.372 . . . . 0.0 110.251 176.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 736' ' ' PHE . . . . . 0.535 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 36.1 t80 -61.8 -40.11 94.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.1 176.535 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 49.1 mtm -62.46 -33.19 74.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.788 178.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -92.08 3.58 54.98 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.069 -178.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 22.8 t -97.44 166.99 11.27 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -88.72 -1.17 57.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.79 0.329 . . . . 0.0 111.132 -178.569 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 741' ' ' LYS . . . . . 0.509 ' O ' ' HE2' ' A' ' 784' ' ' LYS . 97.0 mttt -66.64 133.13 49.62 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 173.69 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 27.2 ptt? -88.26 -23.2 23.57 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 178.213 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 743' ' ' GLN . . . . . 0.406 ' HA ' ' O ' ' A' ' 782' ' ' VAL . 29.6 pt20 -141.73 140.46 33.13 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.19 -179.13 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 744' ' ' LEU . . . . . 0.535 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 57.0 tp -118.76 103.65 9.85 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.353 177.437 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 745' ' ' GLU . . . . . 0.444 ' H ' ' CD ' ' A' ' 745' ' ' GLU . 0.1 OUTLIER -87.69 109.22 19.53 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.855 179.295 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 746' ' ' PHE . . . . . 0.412 ' HA ' ' HD3' ' A' ' 747' ' ' PRO . 75.3 m-85 -77.01 148.3 78.41 Favored Pre-proline 0 C--N 1.321 -0.669 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.36 178.978 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 747' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 746' ' ' PHE . 25.5 Cg_exo -62.66 151.14 85.24 Favored 'Trans proline' 0 CA--C 1.529 0.263 0 C-N-CA 122.711 2.274 . . . . 0.0 112.237 179.348 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -65.76 -7.4 16.46 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.781 2.321 . . . . 0.0 112.619 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 41.6 t -68.63 -17.64 64.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.953 178.364 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.1 mp -66.07 110.69 3.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.919 173.498 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -82.08 -176.93 6.4 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 175.594 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 14.6 m -49.59 -48.56 48.75 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -174.751 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 753' ' ' HIS . . . . . 0.457 ' O ' ' HG2' ' A' ' 757' ' ' ARG . 37.4 t-80 -56.73 -46.84 81.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.508 178.099 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 754' ' ' ASP . . . . . 0.467 ' HB3' ' CZ ' ' A' ' 729' ' ' PHE . 58.9 m-20 -65.34 -46.63 79.48 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.803 -176.021 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 80.8 mtt180 -59.66 -45.64 91.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.672 177.385 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 756' ' ' LEU . . . . . 0.413 HD13 ' C ' ' A' ' 756' ' ' LEU . 3.2 tm? -54.75 -45.82 74.21 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.768 179.173 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 757' ' ' ARG . . . . . 0.457 ' HG2' ' O ' ' A' ' 753' ' ' HIS . 31.1 mmm180 -54.69 -50.34 68.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.213 -0.448 . . . . 0.0 109.868 177.332 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 758' ' ' VAL . . . . . 0.507 HG13 HD11 ' A' ' 733' ' ' ILE . 73.6 t -59.24 -48.0 88.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.01 178.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 88.4 m-70 -54.74 -58.83 5.97 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.444 -0.343 . . . . 0.0 110.87 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 18.3 mt-30 -60.05 -36.23 76.85 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -177.489 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 91.5 mt -70.78 -48.43 57.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 C-N-CA 121.123 -0.231 . . . . 0.0 111.133 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -65.45 -34.32 78.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.208 0.528 . . . . 0.0 110.273 179.142 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -63.5 -37.27 86.66 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.241 176.337 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -74.0 -39.44 63.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.557 178.038 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 10.4 m170 -69.7 -22.18 63.43 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.36 179.369 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 89.37 23.39 34.35 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.112 179.047 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 72.2 mt -93.26 -179.38 5.05 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 -179.125 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 768' ' ' ARG . . . . . 0.408 ' HE ' ' HB3' ' A' ' 783' ' ' SER . 61.2 ttp180 -104.68 127.97 52.6 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 177.385 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 5.5 p80 -135.27 130.0 34.46 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.024 0.44 . . . . 0.0 110.681 -176.868 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -149.08 155.67 41.08 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.276 -178.67 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 15.8 m . . . . . 0 C--N 1.32 -0.706 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.724 -177.315 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 779' ' ' PHE . . . . . 0.401 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 40.7 p90 . . . . . 0 N--CA 1.45 -0.461 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 11.5 tt -125.41 135.02 65.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-O 121.076 0.465 . . . . 0.0 110.678 -178.398 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 25.0 m -119.3 120.64 37.56 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.406 -179.088 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 782' ' ' VAL . . . . . 0.406 ' O ' ' HA ' ' A' ' 743' ' ' GLN . 46.9 t -101.13 133.73 43.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.967 178.619 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 783' ' ' SER . . . . . 0.408 ' HB3' ' HE ' ' A' ' 768' ' ' ARG . 48.4 t -121.26 140.48 51.99 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 784' ' ' LYS . . . . . 0.509 ' HE2' ' O ' ' A' ' 741' ' ' LYS . 51.3 mtmt . . . . . 0 C--N 1.321 -0.636 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.614 -178.139 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 . . . . . 0 CA--C 1.529 0.147 0 CA-C-O 120.89 0.376 . . . . 0.0 111.062 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 29.9 m-85 -72.9 -30.74 64.16 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.46 -175.596 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 16.6 tpp85 -61.63 -45.91 92.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.088 173.618 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -62.24 -46.72 87.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.95 179.615 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 22.7 mmm -62.11 -39.44 92.54 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.313 -179.326 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 733' ' ' ILE . . . . . 0.436 ' O ' ' HG3' ' A' ' 737' ' ' MET . 57.9 mt -75.84 -41.33 39.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -178.371 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 8.4 p -66.82 -34.08 67.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 C-N-CA 120.936 -0.305 . . . . 0.0 111.066 -177.605 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 61.7 mt-10 -76.97 -31.54 56.62 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.011 0.434 . . . . 0.0 110.087 175.679 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 736' ' ' PHE . . . . . 0.461 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 37.6 t80 -63.03 -37.29 86.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.522 178.71 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 737' ' ' MET . . . . . 0.436 ' HG3' ' O ' ' A' ' 733' ' ' ILE . 52.3 mtm -61.84 -26.51 68.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.944 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -101.65 4.08 40.44 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.122 0.486 . . . . 0.0 111.088 -178.896 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 40.2 t -88.99 166.63 13.78 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.974 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 30.2 mtpp -87.33 -10.37 52.4 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.861 0.362 . . . . 0.0 110.398 178.556 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 29.3 mtpp -67.6 124.46 23.32 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.269 177.59 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 22.9 ptp -75.37 -27.23 59.06 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.492 178.24 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 -137.69 136.53 37.49 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.402 -178.125 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 744' ' ' LEU . . . . . 0.461 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 34.5 tp -106.89 104.99 14.8 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.19 -0.671 . . . . 0.0 109.19 176.585 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -87.76 104.6 16.71 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.979 -178.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 746' ' ' PHE . . . . . 0.406 ' HA ' ' HD3' ' A' ' 747' ' ' PRO . 68.2 m-85 -78.41 155.01 79.28 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.351 179.055 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 747' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 746' ' ' PHE . 14.5 Cg_exo -70.04 152.69 67.96 Favored 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 122.358 2.039 . . . . 0.0 111.892 176.909 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -65.83 -4.53 10.13 Favored 'Trans proline' 0 CA--C 1.529 0.244 0 C-N-CA 122.897 2.398 . . . . 0.0 112.394 178.453 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 11.6 m -67.57 -18.35 64.98 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.065 177.541 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 11.0 mp -70.4 109.29 4.68 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.983 -0.376 . . . . 0.0 109.983 175.32 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -78.2 -178.03 5.43 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 -179.227 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 20.0 m -52.85 -41.05 63.91 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 111.64 0.237 . . . . 0.0 111.64 -178.307 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 65.5 m170 -68.93 -44.35 73.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.499 0.19 . . . . 0.0 110.97 179.044 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -58.28 -49.01 78.64 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.156 0.503 . . . . 0.0 110.143 177.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 755' ' ' ARG . . . . . 0.44 HH11 ' HD3' ' A' ' 755' ' ' ARG . 24.0 mtm180 -63.72 -43.3 96.96 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.833 -179.676 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 54.4 tp -54.91 -42.35 72.08 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.872 0.367 . . . . 0.0 111.024 179.273 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 757' ' ' ARG . . . . . 0.434 ' HA ' ' NE ' ' A' ' 757' ' ' ARG . 1.9 mmp_? -62.9 -47.07 84.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.519 176.233 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 758' ' ' VAL . . . . . 0.468 ' CG1' HD13 ' A' ' 780' ' ' ILE . 99.7 t -59.5 -48.05 88.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.895 179.341 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 88.6 m-70 -55.27 -55.41 31.68 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 120.843 0.354 . . . . 0.0 110.438 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -62.43 -38.61 90.4 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.962 -178.223 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 85.2 mt -67.43 -44.97 86.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 C-N-CA 121.144 -0.222 . . . . 0.0 111.081 178.403 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -65.9 -36.91 84.7 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.18 0.514 . . . . 0.0 110.353 178.081 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -67.07 -33.38 75.37 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.825 175.764 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -71.5 -40.18 70.34 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.593 178.243 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -71.86 -30.66 65.67 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.136 176.676 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 96.15 31.97 6.98 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.717 -0.754 . . . . 0.0 111.945 -179.12 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 61.5 mt -104.75 -178.96 3.81 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 50.6 ttt180 -100.6 142.85 31.5 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 177.276 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.7 p80 -149.17 141.64 24.29 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.861 0.362 . . . . 0.0 110.785 -178.146 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -160.14 152.42 20.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.696 179.235 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 6.4 m . . . . . 0 C--N 1.32 -0.686 0 CA-C-O 121.25 0.547 . . . . 0.0 110.904 -177.803 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 49.9 p90 . . . . . 0 N--CA 1.447 -0.578 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 780' ' ' ILE . . . . . 0.468 HD13 ' CG1' ' A' ' 758' ' ' VAL . 17.1 tt -118.04 140.12 42.58 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 C-N-CA 120.405 -0.518 . . . . 0.0 110.905 -179.02 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 25.1 m -121.64 117.98 28.05 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.883 -0.598 . . . . 0.0 109.944 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 22.1 t -100.95 133.95 42.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 179.124 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 20.0 p -124.09 143.09 50.66 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.391 0.615 . . . . 0.0 110.964 178.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 56.2 mtpt . . . . . 0 C--N 1.326 -0.455 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.421 -177.056 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 728' ' ' HIS . . . . . 0.519 ' O ' ' HG3' ' A' ' 732' ' ' MET . 14.0 t60 . . . . . 0 C--O 1.233 0.231 0 CA-C-O 121.094 0.473 . . . . 0.0 110.155 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -77.88 -29.9 50.53 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.857 -176.072 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 44.6 ttm-85 -66.06 -37.88 86.93 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 176.416 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -65.84 -41.34 91.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.397 176.583 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 732' ' ' MET . . . . . 0.519 ' HG3' ' O ' ' A' ' 728' ' ' HIS . 93.5 mtp -63.81 -42.47 97.68 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.428 178.356 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 59.5 mt -71.51 -42.25 72.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.172 -0.467 . . . . 0.0 112.023 -178.741 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 11.4 p -65.3 -41.31 91.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 C-N-CA 120.784 -0.366 . . . . 0.0 111.162 -176.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -70.85 -33.09 70.29 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.963 0.411 . . . . 0.0 110.291 176.738 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 736' ' ' PHE . . . . . 0.497 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 11.7 t80 -59.97 -36.99 78.32 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.013 176.394 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 737' ' ' MET . . . . . 0.63 ' HA ' ' HD3' ' A' ' 784' ' ' LYS . 69.9 mtm -64.16 -32.28 73.8 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.62 177.689 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -92.4 9.12 35.55 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.791 0.329 . . . . 0.0 111.1 178.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 55.7 m -101.02 167.37 10.29 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.762 0.315 . . . . 0.0 110.87 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 740' ' ' LYS . . . . . 0.427 ' NZ ' ' HB2' ' A' ' 740' ' ' LYS . 0.1 OUTLIER -73.9 -30.02 62.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.179 -179.241 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -58.38 127.9 34.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.768 178.88 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 69.9 mtm -95.93 -10.62 28.26 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.84 0.353 . . . . 0.0 110.626 178.219 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 743' ' ' GLN . . . . . 0.41 ' HA ' ' O ' ' A' ' 782' ' ' VAL . 9.2 pt20 -139.67 126.85 21.17 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.063 174.285 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 744' ' ' LEU . . . . . 0.497 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 48.0 tp -102.1 105.69 16.45 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -87.25 105.68 17.39 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.744 178.276 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 746' ' ' PHE . . . . . 0.439 ' HA ' ' HD3' ' A' ' 747' ' ' PRO . 70.6 m-85 -76.04 146.07 78.27 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.821 -178.493 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 747' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 746' ' ' PHE . 33.1 Cg_exo -62.38 152.36 77.33 Favored 'Trans proline' 0 C--O 1.234 0.285 0 C-N-CA 122.971 2.448 . . . . 0.0 112.51 177.869 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -65.84 -3.93 9.08 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 123.143 2.562 . . . . 0.0 112.62 177.752 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 13.8 m -66.56 -25.16 66.51 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.721 176.379 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.1 mp -71.35 112.27 7.35 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.221 176.336 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 751' ' ' ASN . . . . . 0.434 ' O ' ' HG3' ' A' ' 755' ' ' ARG . 1.6 p-10 -86.31 -177.59 6.26 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 178.237 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 10.8 m -52.18 -45.46 65.13 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 112.592 0.589 . . . . 0.0 112.592 -170.888 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 33.2 m170 -66.7 -40.35 88.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.653 0.263 . . . . 0.0 111.62 -179.75 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -67.23 -41.56 85.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.926 0.393 . . . . 0.0 110.55 178.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 755' ' ' ARG . . . . . 0.434 ' HG3' ' O ' ' A' ' 751' ' ' ASN . 43.7 mtm-85 -64.35 -39.28 93.58 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.945 177.789 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 62.9 tp -54.34 -45.23 72.65 Favored 'General case' 0 C--N 1.332 -0.191 0 O-C-N 123.474 0.484 . . . . 0.0 110.855 176.29 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 7.7 mmt85 -55.41 -50.06 70.76 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.484 175.38 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 84.8 t -58.58 -48.32 85.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.02 179.264 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -56.28 -52.32 64.95 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.707 179.093 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -60.36 -41.7 94.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.753 -177.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 95.0 mt -68.82 -46.79 78.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.192 -179.237 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -63.54 -35.63 81.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.319 0.581 . . . . 0.0 110.021 178.195 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -63.5 -39.86 95.56 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.361 176.524 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -68.3 -44.75 74.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.839 178.347 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 27.1 m-70 -73.98 -21.44 60.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.61 -176.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 90.3 39.41 6.03 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.251 177.48 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 64.6 mt -111.12 169.62 8.65 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 178.694 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 37.3 ttm180 -90.05 132.08 35.58 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 177.571 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.8 p80 -138.82 136.63 35.83 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 120.726 0.298 . . . . 0.0 110.482 -177.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -162.4 147.67 12.53 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.523 177.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 771' ' ' SER . . . . . 0.466 ' HA ' ' HA ' ' A' ' 780' ' ' ILE . 9.7 m . . . . . 0 N--CA 1.445 -0.681 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.263 178.154 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 50.8 p90 . . . . . 0 N--CA 1.452 -0.357 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 780' ' ' ILE . . . . . 0.466 ' HA ' ' HA ' ' A' ' 771' ' ' SER . 11.9 tt -114.77 133.65 60.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-O 121.184 0.516 . . . . 0.0 111.039 -176.595 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 34.5 m -115.6 124.03 49.92 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.328 178.571 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 782' ' ' VAL . . . . . 0.41 ' O ' ' HA ' ' A' ' 743' ' ' GLN . 59.1 t -103.61 119.7 52.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.692 176.67 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 13.9 m -113.41 133.64 55.07 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 121.049 0.452 . . . . 0.0 111.011 -176.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 784' ' ' LYS . . . . . 0.63 ' HD3' ' HA ' ' A' ' 737' ' ' MET . 56.8 mtmt . . . . . 0 C--N 1.325 -0.484 0 CA-C-O 121.83 0.824 . . . . 0.0 110.354 177.173 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 46.0 t60 . . . . . 0 N--CA 1.461 0.113 0 CA-C-O 121.294 0.569 . . . . 0.0 109.532 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -72.06 -26.09 62.04 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.261 -177.807 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -65.77 -42.66 90.58 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 176.628 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -68.17 -46.05 71.77 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.629 177.82 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 35.5 mmm -56.96 -45.12 83.07 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.285 178.795 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 38.7 mt -67.28 -44.69 87.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.891 -177.775 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 12.4 p -66.75 -36.12 76.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 C-N-CA 120.298 -0.561 . . . . 0.0 111.015 -177.772 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 735' ' ' GLU . . . . . 0.404 ' O ' ' HB2' ' A' ' 739' ' ' SER . 45.4 mt-10 -71.88 -28.22 63.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.148 0.499 . . . . 0.0 110.402 176.8 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 736' ' ' PHE . . . . . 0.431 ' CE2' ' HG3' ' A' ' 784' ' ' LYS . 23.4 t80 -71.18 -40.55 71.19 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.287 174.398 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 87.2 mtp -62.37 -41.68 98.81 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.099 179.222 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -80.88 -6.05 58.15 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.278 -179.388 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 739' ' ' SER . . . . . 0.404 ' HB2' ' O ' ' A' ' 735' ' ' GLU . 14.7 t -92.91 167.33 11.9 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.593 -177.777 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -75.47 -9.68 58.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.817 178.218 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 741' ' ' LYS . . . . . 0.462 ' O ' ' HD3' ' A' ' 784' ' ' LYS . 61.9 mttp -61.35 133.6 56.01 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.538 -178.961 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 62.7 mtt -99.94 -17.36 17.6 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.076 177.656 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -144.71 140.53 28.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.155 175.766 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 744' ' ' LEU . . . . . 0.486 HD13 ' CZ ' ' A' ' 746' ' ' PHE . 0.8 OUTLIER -113.65 108.43 17.12 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 -179.935 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -85.63 96.35 9.64 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.439 176.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 746' ' ' PHE . . . . . 0.486 ' CZ ' HD13 ' A' ' 744' ' ' LEU . 61.1 m-85 -71.12 146.84 93.08 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.28 177.796 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -65.92 150.89 85.35 Favored 'Trans proline' 0 CA--C 1.529 0.247 0 C-N-CA 122.637 2.224 . . . . 0.0 112.509 -179.293 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -63.74 -6.22 10.33 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.845 2.363 . . . . 0.0 112.362 175.457 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 34.4 t -61.4 -25.18 67.02 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.077 174.155 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.1 mp -65.2 109.44 2.21 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.816 176.713 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -80.06 -177.37 6.0 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 173.684 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 20.0 m -57.68 -43.71 85.25 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -171.893 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 35.0 m80 -63.92 -39.82 95.04 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 120.954 0.406 . . . . 0.0 110.774 179.39 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -63.03 -49.03 76.2 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.706 178.97 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 63.8 mtt85 -57.6 -49.29 76.89 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.549 177.968 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 756' ' ' LEU . . . . . 0.401 ' HG ' ' NE2' ' A' ' 760' ' ' GLN . 60.5 tp -54.72 -39.73 68.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.303 -179.009 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 23.8 tpt180 -65.04 -39.19 92.99 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.055 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 96.3 t -64.4 -50.98 73.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.752 176.773 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -53.8 -48.81 69.48 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 123.453 0.47 . . . . 0.0 110.243 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 760' ' ' GLN . . . . . 0.401 ' NE2' ' HG ' ' A' ' 756' ' ' LEU . 69.9 mt-30 -50.96 -51.27 54.19 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.888 176.954 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 88.5 mt -69.98 -42.33 79.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.439 -174.983 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -66.21 -38.16 87.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.075 0.464 . . . . 0.0 110.453 179.571 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -67.05 -36.64 82.5 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.127 177.706 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -65.76 -49.28 68.93 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.533 176.64 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 13.8 m170 -69.8 -29.42 66.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.636 -175.608 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 100.67 36.14 4.11 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.457 -0.877 . . . . 0.0 112.451 177.74 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 63.9 mt -111.85 170.64 8.01 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.294 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 32.5 ttp180 -89.89 136.52 32.99 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 178.389 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 5.5 p80 -137.45 121.95 18.39 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-O 121.464 0.65 . . . . 0.0 110.499 -179.377 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -144.1 153.76 42.49 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.239 -0.892 . . . . 0.0 109.971 -178.201 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 10.7 m . . . . . 0 C--N 1.319 -0.747 0 CA-C-O 121.041 0.448 . . . . 0.0 110.57 -179.1 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 44.1 p90 . . . . . 0 N--CA 1.448 -0.545 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 12.8 tt -104.09 133.82 47.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-O 121.163 0.506 . . . . 0.0 110.562 -178.571 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 781' ' ' THR . . . . . 0.456 ' HA ' ' O ' ' A' ' 744' ' ' LEU . 17.7 m -118.1 112.55 20.36 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.263 179.687 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 45.3 t -90.91 130.51 39.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 177.076 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 12.8 t -125.3 141.54 52.02 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.444 0.64 . . . . 0.0 111.492 -175.507 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 784' ' ' LYS . . . . . 0.462 ' HD3' ' O ' ' A' ' 741' ' ' LYS . 55.4 mtpt . . . . . 0 CA--C 1.511 -0.523 0 CA-C-O 122.392 1.092 . . . . 0.0 108.7 175.517 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 27.4 t60 . . . . . 0 N--CA 1.453 -0.289 0 CA-C-O 120.778 0.323 . . . . 0.0 110.641 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -70.04 -32.03 69.96 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.209 -173.389 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 -58.62 -49.7 76.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.141 0.496 . . . . 0.0 109.828 174.625 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -61.62 -48.58 80.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.805 178.731 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 46.8 mmm -56.38 -39.79 73.53 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.599 -179.405 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 43.0 mt -70.72 -49.15 53.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.542 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 12.9 p -65.52 -36.36 77.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 C-N-CA 120.732 -0.387 . . . . 0.0 111.08 -176.176 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -71.65 -32.29 67.75 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 121.089 0.471 . . . . 0.0 110.423 177.211 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 736' ' ' PHE . . . . . 0.574 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 24.4 t80 -65.59 -36.54 84.06 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.518 175.596 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 737' ' ' MET . . . . . 0.513 ' HA ' ' HD3' ' A' ' 784' ' ' LYS . 84.9 mtp -65.83 -27.1 68.0 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.331 176.633 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -91.71 -0.62 57.57 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.743 178.471 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 24.3 t -97.0 168.15 10.64 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.584 -178.072 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 740' ' ' LYS . . . . . 0.574 ' HA ' ' HE2' ' A' ' 740' ' ' LYS . 11.0 mmpt? -84.6 -11.59 55.71 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.186 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 741' ' ' LYS . . . . . 0.474 ' O ' ' HE2' ' A' ' 784' ' ' LYS . 59.9 mttp -67.31 129.57 40.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.112 177.969 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 70.2 mtm -91.09 -17.83 25.55 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.648 177.865 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -136.13 130.06 32.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.605 179.121 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 744' ' ' LEU . . . . . 0.574 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 45.8 tp -112.95 109.0 18.14 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.786 177.581 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -94.36 110.14 21.93 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.158 -178.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 746' ' ' PHE . . . . . 0.52 ' O ' ' HB2' ' A' ' 779' ' ' PHE . 72.2 m-85 -80.53 156.56 73.23 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.158 -178.444 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 747' ' ' PRO . . . . . 0.435 ' O ' HD13 ' A' ' 750' ' ' LEU . 40.2 Cg_exo -58.9 156.33 33.9 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.966 2.444 . . . . 0.0 112.565 177.353 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -74.19 -11.76 23.15 Favored 'Trans proline' 0 CA--C 1.53 0.295 0 C-N-CA 122.764 2.309 . . . . 0.0 112.77 178.818 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 17.6 m -71.59 -12.61 61.44 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.989 -0.55 . . . . 0.0 112.354 -176.893 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 750' ' ' LEU . . . . . 0.435 HD13 ' O ' ' A' ' 747' ' ' PRO . 11.2 mp -61.22 121.53 12.79 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 110.416 -0.216 . . . . 0.0 110.416 176.527 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 751' ' ' ASN . . . . . 0.571 ' O ' ' HG2' ' A' ' 755' ' ' ARG . 2.0 p30 -80.38 176.92 9.35 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 179.495 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 14.4 t -53.6 -37.26 62.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.913 0.387 . . . . 0.0 111.352 -177.04 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 73.8 m80 -76.07 -27.87 57.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.976 -179.227 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -72.25 -40.37 67.73 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 175.719 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 755' ' ' ARG . . . . . 0.571 ' HG2' ' O ' ' A' ' 751' ' ' ASN . 33.1 mmt180 -56.69 -58.58 7.45 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.51 175.181 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 62.0 tp -54.16 -38.63 65.74 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 114.871 -1.059 . . . . 0.0 111.045 -178.895 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 26.5 tpt180 -57.45 -48.53 78.9 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 120.996 0.427 . . . . 0.0 110.187 178.034 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 79.8 t -65.79 -46.54 88.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.838 179.009 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -56.05 -50.89 69.71 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.903 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -55.52 -47.98 75.39 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.407 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 96.6 mt -67.58 -49.1 73.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.523 -176.844 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -63.34 -30.77 71.84 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.224 0.535 . . . . 0.0 110.67 -178.61 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -70.71 -37.75 73.59 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.768 177.273 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -68.57 -36.99 79.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.361 0.6 . . . . 0.0 110.243 178.291 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 12.0 m170 -74.89 -23.12 58.33 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.438 177.803 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 84.68 44.4 6.46 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.936 -0.65 . . . . 0.0 112.272 178.482 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 82.0 mt -111.86 177.63 4.58 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 178.093 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 75.4 ttt180 -96.72 133.47 41.22 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.079 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 5.7 p80 -145.92 133.39 20.8 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.079 0.466 . . . . 0.0 111.555 -176.009 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -170.56 164.59 8.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.215 -0.902 . . . . 0.0 108.976 176.184 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 771' ' ' SER . . . . . 0.471 ' HA ' ' HA ' ' A' ' 780' ' ' ILE . 14.3 m . . . . . 0 C--N 1.32 -0.704 0 CA-C-O 121.357 0.599 . . . . 0.0 112.035 -173.83 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 779' ' ' PHE . . . . . 0.52 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 37.7 p90 . . . . . 0 N--CA 1.451 -0.409 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 780' ' ' ILE . . . . . 0.471 ' HA ' ' HA ' ' A' ' 771' ' ' SER . 10.8 tt -83.93 135.33 25.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 121.201 0.525 . . . . 0.0 110.826 -176.976 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 35.2 m -120.38 119.82 34.2 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.479 -179.27 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 43.1 t -95.97 125.12 48.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.322 176.311 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 34.3 t -119.29 130.27 55.32 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.322 0.582 . . . . 0.0 110.789 -176.416 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 784' ' ' LYS . . . . . 0.513 ' HD3' ' HA ' ' A' ' 737' ' ' MET . 48.0 mtmt . . . . . 0 C--N 1.32 -0.679 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 172.568 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 29.9 t60 . . . . . 0 N--CA 1.463 0.207 0 CA-C-O 121.485 0.66 . . . . 0.0 109.391 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 44.7 m-85 -75.15 -26.76 59.38 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.692 -176.874 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 23.6 ttt180 -71.22 -36.59 71.91 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 178.32 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -66.39 -42.66 87.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.177 175.763 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 12.3 mmm -62.0 -40.91 97.28 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.131 176.791 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 733' ' ' ILE . . . . . 0.449 ' O ' ' HG3' ' A' ' 737' ' ' MET . 49.3 mt -69.22 -44.11 80.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.684 -179.149 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 11.4 p -63.99 -37.01 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 C-N-CA 120.564 -0.454 . . . . 0.0 110.994 -177.136 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -74.62 -27.26 60.38 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.05 0.452 . . . . 0.0 110.472 176.571 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 736' ' ' PHE . . . . . 0.553 ' CE1' ' HB2' ' A' ' 744' ' ' LEU . 26.9 t80 -69.36 -35.89 76.31 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.531 175.135 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 737' ' ' MET . . . . . 0.449 ' HG3' ' O ' ' A' ' 733' ' ' ILE . 86.2 mtp -64.27 -39.72 94.5 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.58 178.018 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -78.97 -23.49 44.48 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.54 178.498 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 33.1 t -73.54 164.13 27.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.465 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 45.2 mtmt -78.54 -22.38 47.33 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.621 -177.023 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 56.1 mtmt -55.43 128.32 33.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.658 -175.138 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 27.0 ptm -86.66 -18.96 29.98 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.898 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 19.8 mm-40 -135.71 139.01 43.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.313 178.861 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 744' ' ' LEU . . . . . 0.553 ' HB2' ' CE1' ' A' ' 736' ' ' PHE . 37.3 tp -118.44 108.67 15.31 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 176.479 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -92.27 112.15 23.98 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.049 -178.144 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -88.34 145.15 35.14 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.568 178.044 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 747' ' ' PRO . . . . . 0.447 ' HA ' ' HD3' ' A' ' 748' ' ' PRO . 23.0 Cg_exo -65.0 152.53 82.08 Favored 'Trans proline' 0 N--CA 1.463 -0.313 0 C-N-CA 122.638 2.225 . . . . 0.0 112.037 177.944 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 748' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 747' ' ' PRO . 13.3 Cg_exo -68.68 -7.32 20.15 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 123.126 2.55 . . . . 0.0 111.462 177.493 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 5.6 m -59.61 -21.4 60.35 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.685 173.013 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.8 mp -73.34 115.4 12.65 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.865 173.062 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 10.9 p30 -82.7 -178.56 7.13 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 178.129 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 65.1 m -58.81 -29.0 66.53 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -175.33 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 54.2 t-80 -71.52 -45.04 63.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.894 0.378 . . . . 0.0 110.087 177.981 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 754' ' ' ASP . . . . . 0.411 ' O ' HG23 ' A' ' 758' ' ' VAL . 70.9 m-20 -61.49 -51.09 70.09 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.036 178.346 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 22.3 mtm180 -57.96 -43.58 86.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.806 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 51.5 tp -55.45 -41.96 73.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.466 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 19.0 mmm180 -63.77 -47.43 81.0 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.998 -0.281 . . . . 0.0 110.465 176.088 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 758' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 754' ' ' ASP . 61.9 t -56.48 -46.31 82.21 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.97 179.64 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 87.3 m-70 -56.7 -53.68 54.91 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.648 178.024 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -59.44 -40.42 86.76 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.69 -178.045 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 95.6 mt -65.29 -53.78 36.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.106 -179.639 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -62.0 -36.82 82.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.176 0.512 . . . . 0.0 110.597 -179.653 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -64.84 -31.58 72.88 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.915 177.999 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -81.86 -36.75 27.9 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.66 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 11.3 m170 -74.57 -23.01 58.7 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.215 179.436 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 95.85 31.09 7.55 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.577 -0.82 . . . . 0.0 112.52 177.264 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 66.3 mt -108.65 -176.56 3.08 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 110.267 -0.272 . . . . 0.0 110.267 -178.688 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 768' ' ' ARG . . . . . 0.433 ' HB3' ' HB3' ' A' ' 783' ' ' SER . 17.4 ttm180 -100.95 135.62 42.11 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.439 177.797 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 7.2 p80 -144.65 135.3 24.66 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.936 -178.684 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -164.54 150.09 10.24 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.48 177.444 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 771' ' ' SER . . . . . 0.427 ' HA ' ' HA ' ' A' ' 780' ' ' ILE . 3.8 m . . . . . 0 N--CA 1.446 -0.644 0 CA-C-O 120.932 0.396 . . . . 0.0 110.297 179.112 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 38.8 p90 . . . . . 0 N--CA 1.452 -0.359 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 780' ' ' ILE . . . . . 0.427 ' HA ' ' HA ' ' A' ' 771' ' ' SER . 13.3 tt -107.17 134.03 50.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-O 121.057 0.456 . . . . 0.0 111.147 -175.884 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 5.7 m -118.36 124.25 47.28 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.023 178.257 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 43.3 t -107.28 127.0 63.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.767 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 783' ' ' SER . . . . . 0.433 ' HB3' ' HB3' ' A' ' 768' ' ' ARG . 22.8 t -112.47 147.16 37.1 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 120.821 0.344 . . . . 0.0 110.493 -178.716 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 784' ' ' LYS . . . . . 0.409 ' HD3' ' HA ' ' A' ' 737' ' ' MET . 17.7 mtmm . . . . . 0 C--N 1.325 -0.472 0 CA-C-O 121.421 0.629 . . . . 0.0 110.073 173.537 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 18.1 t60 . . . . . 0 C--O 1.233 0.228 0 CA-C-O 120.727 0.298 . . . . 0.0 111.289 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -75.07 -36.85 61.76 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.462 -176.753 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 27.7 ttm-85 -61.8 -42.36 98.91 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.765 0.316 . . . . 0.0 110.383 175.811 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -60.44 -45.73 92.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.815 179.683 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 31.8 mtm -68.52 -33.32 73.92 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.236 -179.286 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 733' ' ' ILE . . . . . 0.542 ' O ' ' HG3' ' A' ' 737' ' ' MET . 58.3 mt -70.34 -49.31 54.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 N-CA-C 111.339 0.126 . . . . 0.0 111.339 178.499 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 13.0 p -62.86 -34.65 67.22 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 120.801 -0.36 . . . . 0.0 110.829 -177.68 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -70.6 -41.61 72.06 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.021 0.439 . . . . 0.0 110.142 175.474 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 736' ' ' PHE . . . . . 0.517 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 44.1 t80 -57.59 -35.47 70.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.33 177.777 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 737' ' ' MET . . . . . 0.542 ' HG3' ' O ' ' A' ' 733' ' ' ILE . 87.6 mtp -61.34 -32.89 72.78 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.824 178.92 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -96.01 -7.18 37.04 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.278 -179.457 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 64.3 m -82.78 168.47 17.14 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.082 -177.635 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 740' ' ' LYS . . . . . 0.449 ' NZ ' ' HB2' ' A' ' 740' ' ' LYS . 4.4 ttmp? -81.29 -21.85 39.04 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.435 -178.69 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -62.83 127.9 33.41 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.668 179.294 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 25.6 ptt? -88.86 -17.22 30.11 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.617 178.153 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -139.05 119.65 14.03 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.139 -178.801 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 744' ' ' LEU . . . . . 0.517 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 49.1 tp -101.03 105.24 16.43 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.334 176.334 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -89.67 115.89 27.38 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.305 -179.204 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 746' ' ' PHE . . . . . 0.488 ' HB2' HG23 ' A' ' 780' ' ' ILE . 58.5 m-85 -88.27 145.6 36.22 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.934 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -58.28 153.79 44.6 Favored 'Trans proline' 0 CA--C 1.533 0.441 0 C-N-CA 123.178 2.585 . . . . 0.0 112.771 178.314 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -69.61 -9.37 26.0 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.922 2.415 . . . . 0.0 112.936 -179.759 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 2.3 p -69.24 -24.07 63.95 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.878 -178.287 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.8 mp -55.7 117.49 3.68 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.256 175.623 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -76.68 174.73 10.08 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.873 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 13.7 t -55.35 -32.53 62.63 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.649 0.24 . . . . 0.0 111.649 -175.418 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 40.2 m80 -79.43 -31.86 42.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.456 0.17 . . . . 0.0 110.962 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -66.32 -45.37 80.52 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 174.447 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 63.3 mtt-85 -62.6 -47.42 83.88 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.733 177.456 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 62.5 tp -55.04 -40.6 70.41 Favored 'General case' 0 N--CA 1.464 0.272 0 O-C-N 123.346 0.404 . . . . 0.0 110.877 179.103 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 27.9 tpt180 -56.87 -51.0 70.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.915 176.011 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 99.1 t -60.51 -49.67 83.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.258 178.813 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 759' ' ' HIS . . . . . 0.419 ' O ' ' HB2' ' A' ' 763' ' ' GLU . 89.8 m-70 -53.79 -51.2 64.22 Favored 'General case' 0 N--CA 1.463 0.192 0 O-C-N 123.302 0.376 . . . . 0.0 110.635 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -60.59 -44.19 96.52 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -178.751 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 98.1 mt -66.3 -49.31 76.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.756 0.313 . . . . 0.0 110.963 -177.841 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -64.32 -32.74 74.47 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.945 0.402 . . . . 0.0 110.59 -179.736 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 763' ' ' GLU . . . . . 0.419 ' HB2' ' O ' ' A' ' 759' ' ' HIS . 27.3 tt0 -66.01 -37.03 84.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.407 178.612 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 13.7 tp10 -75.0 -43.26 54.88 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.676 177.705 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 10.6 m-70 -69.22 -24.89 64.08 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.434 -176.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 99.45 29.91 6.82 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.496 -0.859 . . . . 0.0 113.14 174.419 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 767' ' ' LEU . . . . . 0.423 HD11 ' HG2' ' A' ' 737' ' ' MET . 54.3 mt -107.59 170.76 7.78 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 176.879 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 30.5 ttt180 -96.55 139.89 31.97 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 119.616 -0.834 . . . . 0.0 109.745 175.143 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.5 p80 -137.19 131.71 32.87 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.428 -0.806 . . . . 0.0 109.837 -176.789 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -159.62 144.91 15.56 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.306 -179.379 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 771' ' ' SER . . . . . 0.455 ' HA ' ' HA ' ' A' ' 780' ' ' ILE . 8.8 t . . . . . 0 N--CA 1.448 -0.569 0 CA-C-O 121.45 0.643 . . . . 0.0 110.084 178.55 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 779' ' ' PHE . . . . . 0.465 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 14.3 p90 . . . . . 0 N--CA 1.452 -0.352 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 780' ' ' ILE . . . . . 0.488 HG23 ' HB2' ' A' ' 746' ' ' PHE . 6.2 tt -103.9 130.17 54.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-O 121.138 0.494 . . . . 0.0 110.107 179.079 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 27.1 m -111.13 120.36 42.04 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.449 -179.243 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 55.8 t -96.42 118.68 43.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 173.066 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 53.9 p -113.61 137.81 51.07 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.458 -177.027 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 59.0 mtpt . . . . . 0 C--N 1.321 -0.633 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 172.68 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 9.7 t60 . . . . . 0 N--CA 1.46 0.064 0 CA-C-O 121.076 0.465 . . . . 0.0 110.792 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 40.6 m-85 -75.56 -31.3 59.98 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.371 -172.912 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 40.0 ttt-85 -59.77 -45.7 91.45 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.18 174.236 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -61.12 -42.53 98.7 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.536 -179.773 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 32.8 mmm -62.54 -39.09 92.49 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.925 178.877 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 733' ' ' ILE . . . . . 0.506 ' O ' ' HB3' ' A' ' 736' ' ' PHE . 68.1 mt -77.76 -39.57 26.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -177.678 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 10.8 p -65.16 -37.69 80.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.817 -178.422 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -78.19 -29.35 48.43 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 120.811 -0.355 . . . . 0.0 110.37 176.731 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 736' ' ' PHE . . . . . 0.544 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 29.2 t80 -52.88 -44.79 67.11 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.873 175.281 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 71.1 mtm -67.13 -23.21 65.78 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.732 -179.688 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -97.09 -9.63 27.63 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.696 0.284 . . . . 0.0 111.529 -178.714 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 50.7 m -90.01 2.55 55.04 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.604 -177.135 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 740' ' ' LYS . . . . . 0.446 ' O ' ' HG2' ' A' ' 740' ' ' LYS . 61.5 tttp 65.4 9.76 6.0 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.257 0.551 . . . . 0.0 111.03 -179.923 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 62.4 mttm -68.27 129.78 40.95 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.625 179.118 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.08 -25.47 47.65 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.064 177.49 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -155.34 148.8 25.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.314 177.502 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 744' ' ' LEU . . . . . 0.544 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 59.0 tp -124.81 108.27 11.78 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.777 178.642 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -80.78 114.55 19.74 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.91 179.536 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 746' ' ' PHE . . . . . 0.464 ' HB2' HG23 ' A' ' 780' ' ' ILE . 68.1 m-85 -90.93 154.78 45.38 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.354 177.853 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 747' ' ' PRO . . . . . 0.415 ' O ' HD13 ' A' ' 750' ' ' LEU . 33.8 Cg_exo -59.17 155.36 40.31 Favored 'Trans proline' 0 CA--C 1.533 0.466 0 C-N-CA 122.666 2.244 . . . . 0.0 112.294 176.304 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -75.6 -14.46 19.87 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.653 2.236 . . . . 0.0 112.169 -179.366 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 7.8 p -71.75 -11.08 60.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.594 -175.473 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 750' ' ' LEU . . . . . 0.415 HD13 ' O ' ' A' ' 747' ' ' PRO . 11.1 mp -58.59 113.67 2.12 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 174.091 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 751' ' ' ASN . . . . . 0.578 ' O ' ' HG2' ' A' ' 755' ' ' ARG . 3.1 p30 -75.13 178.94 5.34 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 110.345 -0.243 . . . . 0.0 110.345 -175.325 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 30.2 m -51.76 -42.44 62.37 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 120.606 0.241 . . . . 0.0 111.522 -176.909 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 70.1 m80 -70.24 -36.98 74.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.106 -179.285 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 754' ' ' ASP . . . . . 0.43 ' O ' HG23 ' A' ' 758' ' ' VAL . 73.7 m-20 -64.38 -49.47 71.48 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 177.121 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 755' ' ' ARG . . . . . 0.578 ' HG2' ' O ' ' A' ' 751' ' ' ASN . 1.4 mmm-85 -54.36 -57.49 11.08 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.648 178.615 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 66.7 tp -52.29 -41.89 63.28 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 114.978 -1.01 . . . . 0.0 111.901 -178.804 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -63.09 -45.41 92.21 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 121.195 -0.202 . . . . 0.0 110.73 178.703 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 758' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 754' ' ' ASP . 93.4 t -60.69 -47.16 94.24 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.728 178.234 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -56.79 -51.48 68.79 Favored 'General case' 0 N--CA 1.462 0.139 0 O-C-N 123.339 0.399 . . . . 0.0 110.206 178.487 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -54.96 -47.62 74.28 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.671 179.419 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 97.3 mt -63.55 -55.4 23.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.119 -178.851 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -60.24 -35.13 74.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.968 0.413 . . . . 0.0 110.88 -177.928 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -66.69 -38.16 86.2 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.144 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -77.22 -36.46 54.68 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.586 0.232 . . . . 0.0 110.448 179.159 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 9.8 m-70 -65.31 -23.48 67.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.959 0.409 . . . . 0.0 110.709 176.24 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 89.25 35.75 7.91 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.108 177.914 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 62.9 mt -114.0 177.16 4.74 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.275 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 22.5 ttp180 -95.56 143.92 26.46 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 178.416 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 5.3 p80 -140.32 122.47 15.78 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.092 0.472 . . . . 0.0 110.276 -178.244 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -134.83 155.19 51.07 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.926 -174.955 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 10.0 m . . . . . 0 C--N 1.313 -0.987 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 172.123 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 11.1 p90 . . . . . 0 C--O 1.234 0.262 0 N-CA-C 109.986 -0.375 . . . . 0.0 109.986 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 780' ' ' ILE . . . . . 0.464 HG23 ' HB2' ' A' ' 746' ' ' PHE . 6.5 tt -126.32 140.26 49.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 120.906 0.384 . . . . 0.0 110.265 177.909 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 26.3 m -128.23 117.98 22.49 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.656 -179.008 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 49.5 t -86.72 127.86 40.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 174.771 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 26.2 m -127.83 139.68 52.49 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.345 0.593 . . . . 0.0 112.059 -173.681 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 784' ' ' LYS . . . . . 0.404 ' HG3' ' CE2' ' A' ' 736' ' ' PHE . 10.0 mtpm? . . . . . 0 C--N 1.326 -0.447 0 CA-C-O 121.93 0.871 . . . . 0.0 109.092 172.205 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 23.1 t60 . . . . . 0 C--O 1.234 0.25 0 CA-C-O 121.089 0.471 . . . . 0.0 111.392 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -82.41 -37.55 25.37 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.738 -174.648 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 17.1 tpt180 -55.76 -44.58 77.79 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.975 0.417 . . . . 0.0 109.96 175.721 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 731' ' ' ALA . . . . . 0.432 ' O ' ' HG3' ' A' ' 735' ' ' GLU . . . -63.43 -52.08 63.02 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.872 179.72 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 31.6 mtm -63.63 -33.49 75.74 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.757 -177.433 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 733' ' ' ILE . . . . . 0.404 HD11 HG13 ' A' ' 758' ' ' VAL . 81.2 mt -72.74 -43.13 61.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 -179.898 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 11.9 p -67.98 -36.55 75.96 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.339 -179.204 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 735' ' ' GLU . . . . . 0.432 ' HG3' ' O ' ' A' ' 731' ' ' ALA . 52.4 mt-10 -68.83 -35.84 77.47 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.077 0.465 . . . . 0.0 109.768 175.376 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 736' ' ' PHE . . . . . 0.416 ' CE2' ' HG3' ' A' ' 784' ' ' LYS . 26.8 t80 -61.69 -38.23 87.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.39 178.591 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 737' ' ' MET . . . . . 0.557 ' HA ' ' HD3' ' A' ' 784' ' ' LYS . 42.0 mtm -62.29 -40.23 95.58 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 121.077 -0.249 . . . . 0.0 111.028 179.563 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -81.49 -17.98 46.75 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.948 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 32.7 t -74.08 160.77 30.8 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.905 -178.74 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 740' ' ' LYS . . . . . 0.555 ' H ' ' HD2' ' A' ' 740' ' ' LYS . 0.0 OUTLIER -77.43 -12.2 59.93 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.819 -178.944 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -67.24 133.29 49.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.154 -0.475 . . . . 0.0 109.859 177.014 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 59.2 mtt -95.76 -20.56 18.77 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.04 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -133.31 124.53 27.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.854 179.268 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 744' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -93.34 97.53 10.65 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 176.796 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -84.3 101.35 11.87 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.166 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 746' ' ' PHE . . . . . 0.408 ' O ' ' HB2' ' A' ' 779' ' ' PHE . 65.1 m-85 -79.66 154.02 75.94 Favored Pre-proline 0 C--N 1.321 -0.645 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.58 179.29 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -75.27 160.16 39.59 Favored 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 122.759 2.306 . . . . 0.0 111.602 175.049 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -68.14 -4.35 12.46 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.796 2.331 . . . . 0.0 112.612 177.033 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 12.2 p -63.9 -27.13 68.94 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.553 179.53 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.2 mp -63.22 115.34 4.43 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.466 -0.333 . . . . 0.0 110.552 176.317 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 751' ' ' ASN . . . . . 0.411 ' O ' ' HG3' ' A' ' 755' ' ' ARG . 2.6 p-10 -91.86 -170.04 2.45 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 174.577 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 12.8 p -46.19 -61.81 1.61 Allowed 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -173.462 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -55.53 -43.74 76.05 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.412 -178.006 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -62.94 -47.35 83.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.991 -178.286 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 755' ' ' ARG . . . . . 0.411 ' HG3' ' O ' ' A' ' 751' ' ' ASN . 82.8 mtt180 -60.89 -48.22 82.8 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.798 177.345 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 65.3 tp -54.26 -40.98 68.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.059 -179.065 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 9.9 mmt180 -59.02 -48.76 80.41 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.448 175.792 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 758' ' ' VAL . . . . . 0.404 HG13 HD11 ' A' ' 733' ' ' ILE . 59.3 t -62.27 -48.42 88.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.059 -179.773 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -57.0 -49.67 75.06 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 110.442 -0.207 . . . . 0.0 110.442 179.742 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 67.0 mt-30 -56.21 -50.37 71.44 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.599 179.633 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 95.5 mt -67.32 -46.23 84.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.542 -176.349 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -62.53 -39.59 94.09 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.838 0.351 . . . . 0.0 110.421 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -65.75 -33.87 76.87 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.58 177.917 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -73.89 -35.23 64.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.513 178.742 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 11.3 m170 -79.08 -11.77 60.0 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.389 179.416 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 81.92 21.68 60.89 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.482 179.382 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 71.8 mt -95.06 172.68 7.99 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 -179.183 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 58.0 ttt180 -96.15 132.71 41.27 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.891 0.377 . . . . 0.0 110.226 178.944 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -133.6 124.62 27.16 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 121.293 0.568 . . . . 0.0 110.537 178.697 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -145.25 145.24 31.21 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.424 -177.974 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 14.3 m . . . . . 0 C--N 1.316 -0.849 0 C-N-CA 120.843 -0.343 . . . . 0.0 111.005 -176.938 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 779' ' ' PHE . . . . . 0.408 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 48.0 p90 . . . . . 0 N--CA 1.45 -0.462 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 9.3 tt -102.74 136.76 33.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.587 -177.5 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 18.6 m -120.75 116.04 24.47 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.58 -178.998 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 47.2 t -92.28 117.03 34.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.841 177.766 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 34.3 t -111.6 127.79 55.85 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.108 0.48 . . . . 0.0 110.43 -178.113 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 784' ' ' LYS . . . . . 0.557 ' HD3' ' HA ' ' A' ' 737' ' ' MET . 52.4 mtmt . . . . . 0 C--N 1.321 -0.669 0 CA-C-O 121.486 0.66 . . . . 0.0 109.222 174.481 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 728' ' ' HIS . . . . . 0.465 ' O ' ' HG2' ' A' ' 732' ' ' MET . 22.3 t60 . . . . . 0 C--O 1.227 -0.09 0 CA-C-O 120.561 0.219 . . . . 0.0 111.161 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -70.75 -39.63 73.15 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.101 -174.891 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 26.8 ttt180 -55.71 -40.45 72.43 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.215 0.531 . . . . 0.0 110.059 176.188 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 731' ' ' ALA . . . . . 0.482 ' O ' HG12 ' A' ' 734' ' ' VAL . . . -71.82 -42.57 66.86 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.96 179.05 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 732' ' ' MET . . . . . 0.465 ' HG2' ' O ' ' A' ' 728' ' ' HIS . 44.8 mmm -60.65 -37.49 81.69 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.767 0.318 . . . . 0.0 110.895 178.638 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 70.8 mt -71.02 -41.0 76.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.528 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 734' ' ' VAL . . . . . 0.482 HG12 ' O ' ' A' ' 731' ' ' ALA . 10.0 p -67.66 -34.32 67.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.664 -179.167 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 735' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 731' ' ' ALA . 51.9 mt-10 -63.08 -45.56 91.57 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-O 121.349 0.595 . . . . 0.0 109.543 173.436 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 736' ' ' PHE . . . . . 0.422 ' HB2' HD12 ' A' ' 744' ' ' LEU . 41.6 t80 -57.41 -44.52 84.67 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.849 -1.069 . . . . 0.0 111.535 -179.383 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 737' ' ' MET . . . . . 0.412 ' HA ' ' HE2' ' A' ' 784' ' ' LYS . 45.8 mtm -69.15 -34.34 74.85 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.035 -179.345 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -78.04 -28.64 49.07 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.902 0.382 . . . . 0.0 111.224 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 25.2 t -80.69 -172.04 3.43 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.496 -179.225 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 740' ' ' LYS . . . . . 0.653 ' H ' ' HD2' ' A' ' 740' ' ' LYS . 0.0 OUTLIER -110.53 12.46 22.83 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.154 0.502 . . . . 0.0 110.848 -175.094 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -71.75 142.09 49.76 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.368 -0.605 . . . . 0.0 109.368 172.12 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 742' ' ' MET . . . . . 0.498 ' O ' ' HA ' ' A' ' 783' ' ' SER . 17.6 ptp -104.12 -14.91 15.71 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.468 177.454 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -140.7 116.34 10.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.662 179.122 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 744' ' ' LEU . . . . . 0.422 HD12 ' HB2' ' A' ' 736' ' ' PHE . 1.4 tt -89.63 103.55 16.18 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 177.646 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -88.27 99.07 11.95 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.646 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -77.03 153.35 82.64 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.352 178.674 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_exo -66.23 156.32 65.51 Favored 'Trans proline' 0 CA--C 1.532 0.422 0 C-N-CA 122.8 2.333 . . . . 0.0 112.13 176.045 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -71.41 -5.24 16.61 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.928 2.419 . . . . 0.0 112.665 177.917 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 23.6 p -65.01 -25.23 67.77 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.156 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.9 mp -60.17 118.12 5.97 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.577 177.441 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -90.12 -176.53 4.89 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.075 176.663 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 17.4 m -48.29 -53.99 15.31 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 113.237 0.828 . . . . 0.0 113.237 -171.006 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -68.0 -37.86 81.97 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.693 0.282 . . . . 0.0 110.956 -175.866 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -65.16 -45.58 84.37 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.781 0.324 . . . . 0.0 110.405 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 78.2 mtt180 -58.53 -48.62 80.24 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 174.532 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 56.9 tp -53.68 -43.32 68.81 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.61 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -60.53 -41.73 95.02 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.293 -0.412 . . . . 0.0 109.963 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 91.7 t -64.18 -48.27 86.38 Favored 'Isoleucine or valine' 0 C--O 1.232 0.175 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.067 176.753 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -55.08 -48.35 73.64 Favored 'General case' 0 N--CA 1.464 0.236 0 O-C-N 123.255 0.347 . . . . 0.0 111.056 -179.737 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -58.98 -48.58 81.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.692 -179.622 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 98.5 mt -65.65 -49.17 79.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.987 -177.61 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -60.96 -41.41 96.27 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 120.912 0.387 . . . . 0.0 110.841 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -63.28 -39.68 95.27 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.033 -179.602 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -74.62 -36.79 62.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.807 0.337 . . . . 0.0 110.765 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 11.8 m170 -65.79 -25.06 67.08 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.908 177.968 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 100.15 14.62 32.94 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.384 177.408 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 39.7 mt -94.52 169.61 10.07 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 -179.48 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 59.8 ttt180 -100.73 152.3 20.64 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 179.228 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 5.8 p80 -153.14 142.82 21.94 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.736 0.303 . . . . 0.0 110.803 -176.172 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -142.21 160.9 39.33 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.204 178.136 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 4.4 m . . . . . 0 C--N 1.317 -0.814 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.601 176.96 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 43.8 p90 . . . . . 0 N--CA 1.451 -0.385 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 8.3 tt -122.7 141.22 43.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-O 120.928 0.394 . . . . 0.0 110.594 179.815 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 781' ' ' THR . . . . . 0.408 ' HA ' ' O ' ' A' ' 744' ' ' LEU . 25.7 m -127.14 127.63 44.88 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.468 -179.648 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 35.4 t -106.19 124.44 61.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.653 178.517 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 783' ' ' SER . . . . . 0.498 ' HA ' ' O ' ' A' ' 742' ' ' MET . 55.6 p -112.36 139.55 47.83 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.072 0.463 . . . . 0.0 111.259 -177.114 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 784' ' ' LYS . . . . . 0.412 ' HE2' ' HA ' ' A' ' 737' ' ' MET . 89.6 mttt . . . . . 0 C--N 1.329 -0.301 0 CA-C-O 121.408 0.623 . . . . 0.0 110.326 175.268 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 31.8 t60 . . . . . 0 N--CA 1.461 0.12 0 CA-C-O 121.212 0.529 . . . . 0.0 109.602 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 36.2 m-85 -70.24 -24.24 63.05 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.45 -178.494 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 12.0 ttm180 -70.34 -39.76 74.52 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 178.984 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -63.96 -41.73 97.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.133 175.653 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 35.0 mmm -59.83 -43.36 94.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.549 178.004 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 733' ' ' ILE . . . . . 0.453 ' O ' ' HG3' ' A' ' 737' ' ' MET . 48.7 mt -70.03 -45.15 77.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.871 -0.604 . . . . 0.0 112.101 -178.304 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 10.9 p -63.47 -37.12 78.71 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 120.968 -0.293 . . . . 0.0 111.166 -176.075 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -74.02 -36.01 64.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.06 0.457 . . . . 0.0 110.186 176.529 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 736' ' ' PHE . . . . . 0.465 ' CE1' ' HB2' ' A' ' 744' ' ' LEU . 19.3 t80 -60.76 -37.02 80.41 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.819 175.838 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 737' ' ' MET . . . . . 0.453 ' HG3' ' O ' ' A' ' 733' ' ' ILE . 87.6 mtp -63.23 -36.24 82.98 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.093 178.863 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -86.28 -16.14 38.5 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.383 -178.862 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 58.9 m -84.53 169.41 14.48 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.874 0.369 . . . . 0.0 111.316 -177.905 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -73.36 -16.38 61.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.936 -0.575 . . . . 0.0 112.061 -176.304 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -60.16 134.59 57.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.127 0.489 . . . . 0.0 111.051 -177.338 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 56.6 mtm -92.47 -26.96 17.74 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.935 177.737 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 29.1 pt20 -137.35 135.68 37.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.311 -179.157 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 744' ' ' LEU . . . . . 0.465 ' HB2' ' CE1' ' A' ' 736' ' ' PHE . 30.4 tp -112.94 105.37 13.43 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 176.848 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -91.37 112.65 24.65 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.243 -178.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 746' ' ' PHE . . . . . 0.531 ' O ' ' HB2' ' A' ' 779' ' ' PHE . 87.4 m-85 -85.51 150.07 53.19 Favored Pre-proline 0 C--N 1.321 -0.661 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.154 178.023 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 747' ' ' PRO . . . . . 0.408 ' O ' HD13 ' A' ' 750' ' ' LEU . 11.9 Cg_exo -67.41 158.81 55.29 Favored 'Trans proline' 0 N--CA 1.461 -0.391 0 C-N-CA 122.407 2.071 . . . . 0.0 112.008 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -66.09 -5.64 12.74 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.787 2.324 . . . . 0.0 112.532 176.683 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 3.4 m -63.4 -20.74 65.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.476 -0.783 . . . . 0.0 111.42 178.648 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 750' ' ' LEU . . . . . 0.408 HD13 ' O ' ' A' ' 747' ' ' PRO . 10.5 mp -69.06 113.85 6.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.372 177.75 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 27.2 p30 -84.86 -167.36 1.79 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 110.247 -0.279 . . . . 0.0 110.247 179.061 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 6.2 m -52.25 -52.09 54.56 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 111.664 0.246 . . . . 0.0 111.664 -177.059 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 753' ' ' HIS . . . . . 0.451 ' O ' ' HG2' ' A' ' 757' ' ' ARG . 32.0 t-80 -59.54 -49.71 76.7 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.625 -0.261 . . . . 0.0 111.347 179.097 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -56.63 -55.73 30.34 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.168 -176.926 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 77.1 mtt85 -56.55 -49.69 74.06 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.35 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -53.08 -46.25 68.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.218 -178.07 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 757' ' ' ARG . . . . . 0.451 ' HG2' ' O ' ' A' ' 753' ' ' HIS . 31.9 mmm180 -60.35 -45.86 91.96 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.355 178.48 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 91.9 t -60.45 -47.39 92.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.648 -0.251 . . . . 0.0 110.943 179.067 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 87.8 m-70 -52.33 -56.73 12.95 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.711 178.431 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -60.79 -41.95 96.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.041 -0.527 . . . . 0.0 112.099 -178.377 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.59 -50.5 79.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.749 0.309 . . . . 0.0 110.845 179.257 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -64.39 -36.73 85.1 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.889 0.376 . . . . 0.0 110.58 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -65.32 -40.25 93.49 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.573 178.919 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.21 -43.37 78.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.053 -0.522 . . . . 0.0 109.852 177.686 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 10.5 m170 -69.09 -17.0 63.81 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.431 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 84.38 34.99 15.3 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.457 177.918 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 80.1 mt -110.4 172.95 6.56 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.03 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 73.3 ttt180 -92.71 143.75 25.99 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 177.841 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 5.5 p80 -146.06 121.49 10.32 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.222 0.534 . . . . 0.0 110.638 179.498 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -129.32 138.07 51.37 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.7 -176.368 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 5.1 m . . . . . 0 C--N 1.318 -0.785 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 174.637 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 779' ' ' PHE . . . . . 0.531 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 45.8 p90 . . . . . 0 N--CA 1.451 -0.408 0 CA-C-O 120.713 0.292 . . . . 0.0 110.274 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 6.7 tt -116.41 135.5 56.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-O 121.278 0.561 . . . . 0.0 110.775 -178.028 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 55.9 m -119.91 120.24 35.83 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.733 -179.496 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 46.5 t -94.14 122.53 45.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.51 176.109 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 45.5 t -114.22 134.05 55.19 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-O 121.072 0.463 . . . . 0.0 110.835 -176.018 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 50.9 mtpt . . . . . 0 C--N 1.327 -0.404 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.771 179.268 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 44.2 t60 . . . . . 0 N--CA 1.464 0.231 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -64.22 -23.03 67.16 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.187 -176.349 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 730' ' ' ARG . . . . . 0.404 ' HA ' HD13 ' A' ' 761' ' ' ILE . 1.8 ttm180 -69.2 -47.69 64.17 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 178.284 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -63.5 -42.43 98.52 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.668 178.724 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 37.9 mmm -60.63 -38.15 83.83 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.381 179.542 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 48.8 mt -72.9 -45.99 53.88 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.661 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 11.1 p -64.9 -35.1 74.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 C-N-CA 120.861 -0.335 . . . . 0.0 110.94 -176.665 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -74.73 -33.34 62.34 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 121.023 0.439 . . . . 0.0 110.208 176.874 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 736' ' ' PHE . . . . . 0.479 ' CE2' ' HG3' ' A' ' 784' ' ' LYS . 32.2 t80 -61.79 -36.26 80.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.913 174.347 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 80.8 mtp -74.14 -26.05 60.1 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.15 177.464 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -87.77 -24.97 23.62 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.859 0.362 . . . . 0.0 110.609 -176.46 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 77.3 p -89.9 -173.81 4.03 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.45 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -100.92 16.47 25.13 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.436 -176.13 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 741' ' ' LYS . . . . . 0.463 ' O ' ' HD3' ' A' ' 784' ' ' LYS . 58.3 mttp -72.78 132.23 43.33 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 177.049 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 25.7 mmt -88.97 -28.51 20.2 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.727 0.299 . . . . 0.0 110.583 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -141.19 136.76 32.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.321 -177.731 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 744' ' ' LEU . . . . . 0.444 HD13 ' CZ ' ' A' ' 746' ' ' PHE . 0.7 OUTLIER -107.78 103.79 13.14 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 179.059 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -86.52 103.29 14.9 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.981 0.42 . . . . 0.0 110.554 177.718 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 746' ' ' PHE . . . . . 0.444 ' CZ ' HD13 ' A' ' 744' ' ' LEU . 72.2 m-85 -81.83 151.9 68.27 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.474 176.82 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 747' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 746' ' ' PHE . 22.4 Cg_exo -65.45 153.6 77.48 Favored 'Trans proline' 0 CA--C 1.531 0.367 0 C-N-CA 122.706 2.27 . . . . 0.0 112.47 178.431 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -67.15 -5.68 14.28 Favored 'Trans proline' 0 N--CA 1.474 0.352 0 C-N-CA 123.218 2.612 . . . . 0.0 113.051 179.235 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 23.2 t -71.5 -13.95 61.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.786 179.32 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.9 mp -71.51 112.59 7.75 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 175.281 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 31.1 p30 -85.3 -170.59 3.19 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.425 -179.326 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 19.5 m -57.63 -38.43 74.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.509 0.195 . . . . 0.0 111.366 -176.855 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 38.2 t-80 -69.64 -48.67 59.13 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.834 178.515 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -59.39 -50.6 73.32 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 121.217 0.532 . . . . 0.0 110.5 -179.178 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 22.9 mtm180 -60.9 -40.59 93.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.339 179.645 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 54.5 tp -55.54 -44.03 76.36 Favored 'General case' 0 C--N 1.332 -0.194 0 O-C-N 123.287 0.367 . . . . 0.0 110.819 178.399 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 19.2 tpt180 -59.74 -43.1 94.39 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 121.033 0.444 . . . . 0.0 110.07 179.138 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 48.6 t -64.83 -48.35 84.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.937 178.418 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -57.2 -47.25 81.74 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 110.324 -0.25 . . . . 0.0 110.324 178.407 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -52.03 -53.62 39.79 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.687 177.583 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 761' ' ' ILE . . . . . 0.404 HD13 ' HA ' ' A' ' 730' ' ' ARG . 74.8 mt -65.82 -43.57 93.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.398 -175.775 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -64.8 -37.0 86.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.987 0.422 . . . . 0.0 110.679 179.853 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -69.65 -36.92 76.5 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.378 178.478 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -64.51 -49.33 71.76 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.412 175.75 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 13.1 m170 -69.44 -31.41 69.71 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.365 -176.836 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 98.77 38.41 3.9 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.203 179.031 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 78.6 mt -111.26 174.39 5.89 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 178.742 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 768' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' A' ' 768' ' ' ARG . 21.5 ttt180 -93.52 136.6 33.63 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 178.892 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.7 p80 -142.35 134.24 27.12 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 120.648 0.261 . . . . 0.0 110.805 -177.268 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -146.56 142.91 28.48 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.345 179.829 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 3.3 p . . . . . 0 C--N 1.318 -0.786 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.276 176.419 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 50.7 p90 . . . . . 0 N--CA 1.447 -0.619 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 15.2 tt -107.85 133.41 52.78 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-O 121.387 0.613 . . . . 0.0 110.733 -179.258 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 781' ' ' THR . . . . . 0.44 ' HA ' ' O ' ' A' ' 744' ' ' LEU . 26.7 m -116.05 115.75 26.66 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.048 177.686 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 33.5 t -91.04 134.18 30.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 176.112 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 33.7 t -125.26 137.12 54.09 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.126 0.489 . . . . 0.0 110.731 -175.246 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 784' ' ' LYS . . . . . 0.479 ' HG3' ' CE2' ' A' ' 736' ' ' PHE . 60.1 mtpt . . . . . 0 C--N 1.323 -0.584 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.411 178.775 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 26.1 t60 . . . . . 0 C--O 1.233 0.236 0 CA-C-O 120.982 0.42 . . . . 0.0 111.252 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 24.7 m-85 -74.46 -35.54 63.31 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.672 -174.873 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 730' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 730' ' ' ARG . 17.1 ttp85 -64.34 -39.65 94.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.744 0.307 . . . . 0.0 110.351 178.947 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -64.06 -48.14 77.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.704 178.452 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 11.9 mtm -61.96 -35.42 78.42 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.145 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 733' ' ' ILE . . . . . 0.508 ' O ' ' HG3' ' A' ' 737' ' ' MET . 66.4 mt -71.72 -49.86 42.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.706 -0.224 . . . . 0.0 111.6 179.316 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 11.2 p -63.58 -34.6 68.63 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 120.988 -0.285 . . . . 0.0 111.39 -175.639 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -77.49 -31.18 53.46 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.95 0.405 . . . . 0.0 110.356 177.849 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 736' ' ' PHE . . . . . 0.513 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 0.7 OUTLIER -66.22 -37.01 84.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.447 174.489 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 737' ' ' MET . . . . . 0.508 ' HG3' ' O ' ' A' ' 733' ' ' ILE . 88.7 mtp -61.74 -28.65 69.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.013 179.408 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -102.85 9.55 38.85 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.005 -179.773 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 7.6 t -96.54 -164.54 1.16 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.028 -179.033 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -108.19 10.66 27.86 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.731 0.301 . . . . 0.0 111.628 -176.267 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 56.5 mttp -91.7 136.97 32.74 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.827 0.346 . . . . 0.0 110.541 177.679 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.86 -24.63 35.67 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.534 179.501 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -152.87 138.12 17.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.11 0.481 . . . . 0.0 111.092 177.694 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 744' ' ' LEU . . . . . 0.513 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 59.7 tp -102.67 105.75 16.27 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.607 -179.61 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -87.36 114.16 23.72 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.278 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 746' ' ' PHE . . . . . 0.417 ' HA ' ' HD3' ' A' ' 747' ' ' PRO . 80.9 m-85 -84.77 151.33 57.9 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.501 179.52 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 747' ' ' PRO . . . . . 0.441 ' HB2' ' OG ' ' A' ' 749' ' ' SER . 13.8 Cg_exo -68.33 155.71 68.28 Favored 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 122.606 2.204 . . . . 0.0 112.184 177.456 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -67.94 -3.01 9.73 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 122.995 2.463 . . . . 0.0 112.821 178.413 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 749' ' ' SER . . . . . 0.441 ' OG ' ' HB2' ' A' ' 747' ' ' PRO . 5.3 p -68.62 -23.18 64.42 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.251 178.648 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.7 mp -63.14 115.65 4.68 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.01 175.166 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -84.62 -171.38 3.59 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.186 -179.747 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 2.8 m -48.19 -54.25 14.07 Favored 'General case' 0 C--N 1.328 -0.349 0 O-C-N 123.59 0.556 . . . . 0.0 111.914 -178.387 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 34.9 m80 -73.31 -31.16 63.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.462 -175.258 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -64.47 -47.4 79.11 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 176.608 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 23.3 mtm180 -61.87 -45.98 91.39 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.041 177.353 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 57.8 tp -52.69 -41.82 64.23 Favored 'General case' 0 C--N 1.332 -0.168 0 O-C-N 123.432 0.457 . . . . 0.0 110.848 178.543 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 26.2 tpt180 -61.47 -45.91 92.26 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.952 179.357 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 99.6 t -64.83 -47.42 88.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.188 179.306 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -55.23 -48.6 73.69 Favored 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 178.984 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 63.8 mt-30 -52.74 -51.79 59.05 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.516 177.489 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 77.3 mt -66.36 -47.65 83.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.505 -175.341 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -64.22 -39.03 93.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.834 0.349 . . . . 0.0 110.463 -179.113 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -65.86 -40.79 92.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.216 178.656 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -66.95 -45.52 77.55 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.741 178.276 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 10.7 m170 -70.38 -27.76 64.56 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.445 -177.177 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 98.24 30.69 6.87 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.527 -0.844 . . . . 0.0 112.544 177.592 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 53.1 mt -107.05 162.78 13.55 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 177.677 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 26.0 ttp180 -84.43 132.39 34.57 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.654 -0.418 . . . . 0.0 109.893 178.698 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 4.4 p80 -130.71 123.68 29.83 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-O 121.111 0.482 . . . . 0.0 110.254 178.868 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -136.83 155.76 49.38 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.944 -179.002 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 9.4 t . . . . . 0 C--N 1.32 -0.687 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 178.307 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 45.3 p90 . . . . . 0 N--CA 1.453 -0.311 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 8.9 tt -127.07 143.49 40.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-O 121.025 0.44 . . . . 0.0 111.166 -175.549 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 57.3 m -124.6 125.83 44.78 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.678 179.036 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 47.5 t -102.94 114.29 42.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 176.125 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 11.2 t -110.78 140.0 45.59 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.087 0.47 . . . . 0.0 110.726 -175.194 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt . . . . . 0 C--N 1.324 -0.506 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.955 176.138 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 728' ' ' HIS . . . . . 0.468 ' O ' ' HG3' ' A' ' 732' ' ' MET . 46.5 t-80 . . . . . 0 C--O 1.232 0.167 0 CA-C-O 121.052 0.453 . . . . 0.0 110.452 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -77.03 -31.38 56.28 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.007 -175.229 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 -57.75 -43.23 85.27 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 174.589 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -64.8 -48.22 75.22 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.665 177.589 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 732' ' ' MET . . . . . 0.468 ' HG3' ' O ' ' A' ' 728' ' ' HIS . 92.2 mtp -57.37 -45.76 84.08 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.933 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 733' ' ' ILE . . . . . 0.462 ' O ' ' HG3' ' A' ' 737' ' ' MET . 72.9 mt -67.17 -45.57 86.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.912 -178.236 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 11.3 p -66.98 -38.42 81.33 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 120.594 -0.442 . . . . 0.0 111.065 -176.491 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 735' ' ' GLU . . . . . 0.463 ' O ' ' HB2' ' A' ' 739' ' ' SER . 42.8 mt-10 -72.09 -33.35 67.82 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-O 120.842 0.353 . . . . 0.0 110.114 177.33 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 736' ' ' PHE . . . . . 0.626 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 7.0 t80 -60.12 -42.66 95.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.354 177.31 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 737' ' ' MET . . . . . 0.476 ' SD ' HD11 ' A' ' 767' ' ' LEU . 46.4 mtm -62.4 -25.8 68.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.59 -176.592 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -112.61 12.89 19.9 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.907 0.384 . . . . 0.0 111.152 -178.446 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 739' ' ' SER . . . . . 0.463 ' HB2' ' O ' ' A' ' 735' ' ' GLU . 7.7 t -94.98 7.09 47.18 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.407 -176.937 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? 65.27 16.81 10.74 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.201 -177.772 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -97.32 125.04 41.66 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 176.497 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.0 -20.11 33.36 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.147 -177.972 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -147.06 129.15 15.55 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.145 -174.528 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 744' ' ' LEU . . . . . 0.626 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 42.6 tp -118.61 102.29 8.76 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 110.067 -0.345 . . . . 0.0 110.067 179.805 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 11.3 mp0 -85.72 108.16 17.93 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.214 -0.448 . . . . 0.0 109.946 177.052 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -75.23 152.02 85.94 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.647 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -64.89 149.59 89.33 Favored 'Trans proline' 0 CA--C 1.53 0.316 0 C-N-CA 122.774 2.316 . . . . 0.0 112.06 177.011 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -67.31 -2.44 8.17 Favored 'Trans proline' 0 N--CA 1.474 0.346 0 C-N-CA 123.239 2.626 . . . . 0.0 113.145 -179.454 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 13.0 t -74.02 -18.1 60.89 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.93 179.351 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.8 mp -64.38 113.76 3.84 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.155 176.409 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 751' ' ' ASN . . . . . 0.461 ' O ' ' HG3' ' A' ' 755' ' ' ARG . 4.5 p30 -81.25 -176.69 6.11 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 -179.019 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 44.3 t -49.44 -49.11 46.59 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.515 -179.065 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 753' ' ' HIS . . . . . 0.401 ' O ' ' HG2' ' A' ' 757' ' ' ARG . 41.1 m80 -67.87 -37.54 81.94 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.524 -178.262 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -64.0 -49.68 71.53 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.142 0.496 . . . . 0.0 110.218 179.176 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 755' ' ' ARG . . . . . 0.461 ' HG3' ' O ' ' A' ' 751' ' ' ASN . 23.5 mtm180 -63.83 -38.46 91.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.208 -179.718 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 62.1 tp -54.41 -44.71 72.62 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 123.393 0.433 . . . . 0.0 110.779 177.789 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 757' ' ' ARG . . . . . 0.401 ' HG2' ' O ' ' A' ' 753' ' ' HIS . 31.2 mmm180 -58.9 -47.02 86.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.974 177.775 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 59.0 t -59.24 -48.47 86.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.976 178.662 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -57.38 -55.02 40.22 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.638 -0.255 . . . . 0.0 110.841 179.498 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -53.45 -46.3 69.84 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 121.097 0.475 . . . . 0.0 111.416 -178.532 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 96.4 mt -68.56 -47.52 76.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.294 -176.831 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -65.37 -34.1 77.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.937 0.399 . . . . 0.0 110.532 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -64.0 -35.15 79.76 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.39 178.179 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -74.81 -42.64 57.69 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 120.975 0.417 . . . . 0.0 110.848 176.66 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 11.4 m170 -65.28 -26.23 67.99 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.401 -179.127 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 93.29 20.68 31.9 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.928 -0.653 . . . . 0.0 111.838 -179.409 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 767' ' ' LEU . . . . . 0.476 HD11 ' SD ' ' A' ' 737' ' ' MET . 32.6 mt -97.62 166.49 11.48 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 -177.251 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 28.7 ttt180 -85.68 125.18 32.98 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.057 175.932 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 3.3 p80 -121.2 116.63 25.29 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.113 174.77 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 41.2 t0 -141.83 156.9 45.53 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.802 -172.742 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 6.1 p . . . . . 0 C--N 1.319 -0.745 0 CA-C-O 120.982 0.42 . . . . 0.0 111.305 -175.987 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 50.4 p90 . . . . . 0 N--CA 1.449 -0.488 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 12.7 tt -116.06 143.0 27.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-O 121.1 0.476 . . . . 0.0 110.519 -179.231 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 49.5 m -129.72 130.15 45.09 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.639 179.342 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 98.7 t -106.85 132.27 54.6 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.722 178.223 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 16.4 m -124.88 139.41 53.86 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.208 -179.657 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 784' ' ' LYS . . . . . 0.429 ' HA ' HD22 ' A' ' 767' ' ' LEU . 27.4 mtpp . . . . . 0 C--N 1.326 -0.445 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.49 -177.287 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo . . . . . 0 N--CA 1.474 0.378 0 N-CA-C 110.335 -0.679 . . . . 0.0 110.335 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -155.49 136.77 13.95 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.03 0.443 . . . . 0.0 110.608 -175.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . 146.78 -157.23 27.34 Favored Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.99 -0.624 . . . . 0.0 111.79 -179.626 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 17.2 m -113.49 126.14 70.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.256 0.55 . . . . 0.0 110.25 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -106.41 -30.21 9.25 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.636 -179.101 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 51.0 m -77.64 72.47 4.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.488 0.661 . . . . 0.0 110.013 177.238 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 54.1 mt-30 -83.73 141.17 31.64 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.891 -176.335 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -88.29 4.18 46.91 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.5 175.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . 82.37 -83.99 1.54 Allowed Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 110.259 -1.136 . . . . 0.0 110.259 -174.245 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 47.0 t -138.68 112.34 7.29 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.845 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 175.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 727' ' ' ASP . . . . . 0.425 ' HB3' ' HB3' ' A' ' 730' ' ' ARG . 14.5 t70 -121.42 134.44 55.1 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.893 -178.571 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 728' ' ' HIS . . . . . 0.478 ' O ' ' HG2' ' A' ' 732' ' ' MET . 51.1 t60 -54.13 -56.43 18.25 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 123.312 0.382 . . . . 0.0 110.885 -178.75 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 729' ' ' PHE . . . . . 0.419 ' CZ ' ' HB3' ' A' ' 754' ' ' ASP . 66.1 m-85 -71.96 -32.48 67.33 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.314 -173.804 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 730' ' ' ARG . . . . . 0.425 ' HB3' ' HB3' ' A' ' 727' ' ' ASP . 17.2 ttt180 -67.99 -35.13 77.81 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.152 177.259 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -67.17 -39.84 86.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.324 176.015 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 732' ' ' MET . . . . . 0.478 ' HG2' ' O ' ' A' ' 728' ' ' HIS . 38.7 mmm -61.86 -40.46 95.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.681 177.729 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 733' ' ' ILE . . . . . 0.413 ' O ' ' HG3' ' A' ' 737' ' ' MET . 64.5 mt -71.53 -42.99 72.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.898 -178.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 8.0 p -64.7 -35.37 74.71 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 C-N-CA 120.738 -0.385 . . . . 0.0 110.763 -177.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -66.33 -47.35 73.79 Favored 'General case' 0 CA--C 1.522 -0.124 0 CA-C-O 121.25 0.547 . . . . 0.0 109.577 173.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 736' ' ' PHE . . . . . 0.599 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 45.2 t80 -52.96 -42.73 65.78 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.015 -0.993 . . . . 0.0 111.676 179.014 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 737' ' ' MET . . . . . 0.413 ' HG3' ' O ' ' A' ' 733' ' ' ILE . 83.6 mtp -61.08 -32.68 72.33 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.673 -177.594 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -101.02 2.38 40.49 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.488 -177.224 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 60.7 m -98.44 174.45 6.46 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.18 0.514 . . . . 0.0 112.049 -175.57 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 16.5 ptmt -74.43 -18.26 60.67 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.726 177.023 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 29.9 mttm -57.93 111.18 1.08 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.101 -178.489 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 26.6 ptt? -78.1 -22.21 49.27 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.219 0.533 . . . . 0.0 109.717 175.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 28.6 pt20 -143.19 135.99 27.7 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.329 -0.851 . . . . 0.0 109.698 178.152 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 744' ' ' LEU . . . . . 0.599 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 36.4 tp -105.69 105.77 15.96 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 179.095 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -86.47 115.41 23.95 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.146 -0.933 . . . . 0.0 110.208 178.613 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 746' ' ' PHE . . . . . 0.409 ' HA ' ' HD3' ' A' ' 747' ' ' PRO . 68.3 m-85 -90.34 149.73 41.68 Favored Pre-proline 0 C--N 1.319 -0.737 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.756 177.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 747' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 746' ' ' PHE . 11.3 Cg_exo -69.32 156.04 65.62 Favored 'Trans proline' 0 N--CA 1.462 -0.358 0 C-N-CA 122.758 2.305 . . . . 0.0 111.953 177.057 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -66.15 -4.13 9.82 Favored 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 122.73 2.286 . . . . 0.0 112.771 176.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 32.9 t -67.04 -16.52 64.41 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.516 179.225 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.8 mp -71.97 128.63 36.33 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.699 0.285 . . . . 0.0 110.391 177.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 751' ' ' ASN . . . . . 0.489 ' O ' ' HG3' ' A' ' 755' ' ' ARG . 4.7 p30 -93.97 -176.89 4.15 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 175.469 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 20.7 t -54.13 -41.81 68.8 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 122.971 0.169 . . . . 0.0 111.303 -177.314 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 49.1 t-80 -65.06 -45.47 85.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.68 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 754' ' ' ASP . . . . . 0.419 ' HB3' ' CZ ' ' A' ' 729' ' ' PHE . 45.2 m-20 -62.03 -43.17 99.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.222 0.534 . . . . 0.0 110.057 -177.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 755' ' ' ARG . . . . . 0.489 ' HG3' ' O ' ' A' ' 751' ' ' ASN . 70.9 mtt-85 -65.21 -46.56 80.21 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.964 177.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 756' ' ' LEU . . . . . 0.582 ' HB2' " H4'" ' A' ' 801' ' ' DGP . 56.1 tp -52.78 -40.87 63.57 Favored 'General case' 0 N--CA 1.463 0.223 0 O-C-N 123.443 0.465 . . . . 0.0 110.533 177.856 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 757' ' ' ARG . . . . . 0.565 ' HE ' ' HA ' ' A' ' 757' ' ' ARG . 1.6 tpm_? -57.65 -50.81 71.94 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.248 176.545 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 61.2 t -63.15 -48.08 89.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.297 -179.095 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -55.74 -46.72 77.75 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.425 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 64.4 mt-30 -56.89 -52.96 63.11 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.949 0.404 . . . . 0.0 111.607 178.463 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 76.1 mt -65.55 -47.12 87.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.356 -175.201 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -63.74 -36.55 84.23 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.744 0.307 . . . . 0.0 110.876 -178.833 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -65.98 -39.16 90.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.719 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -73.99 -39.66 63.5 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.124 178.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 10.5 m170 -70.43 -34.97 73.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.086 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 107.4 31.41 3.77 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.414 -0.898 . . . . 0.0 112.925 176.46 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 29.3 mt -111.14 164.75 12.52 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 179.354 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 70.8 ttt-85 -88.5 132.99 34.27 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 -179.398 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.0 p80 -134.34 130.85 37.57 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.566 -177.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -155.43 146.22 22.29 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.831 -177.629 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 771' ' ' SER . . . . . 0.409 ' HA ' ' HA ' ' A' ' 780' ' ' ILE . 4.3 m -104.85 126.72 52.21 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-O 121.227 0.537 . . . . 0.0 109.823 176.824 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 22.3 m -114.52 162.74 16.32 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.077 -176.273 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 98.79 -135.63 12.25 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.087 -179.016 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 774' ' ' GLU . . . . . 0.506 ' O ' ' HB2' ' A' ' 778' ' ' ARG . 30.0 mt-10 -134.22 -100.58 0.24 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.099 0.476 . . . . 0.0 110.313 -177.162 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . -127.95 -57.57 0.12 Allowed Glycine 0 N--CA 1.445 -0.737 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 170.452 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.97 -14.39 62.68 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 121.034 0.445 . . . . 0.0 110.609 173.399 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 80.5 mtt180 -119.08 17.52 13.23 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.565 175.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 778' ' ' ARG . . . . . 0.506 ' HB2' ' O ' ' A' ' 774' ' ' GLU . 18.0 ttt85 -86.14 120.07 27.12 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.384 0.611 . . . . 0.0 111.432 -176.029 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 37.0 p90 -135.73 162.06 33.81 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 176.722 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 780' ' ' ILE . . . . . 0.409 ' HA ' ' HA ' ' A' ' 771' ' ' SER . 8.0 tt -116.22 133.54 62.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-O 121.12 0.486 . . . . 0.0 110.904 -177.827 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 4.0 m -115.17 124.73 52.2 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.365 -178.442 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 60.0 t -104.89 129.71 57.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 174.65 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 41.5 t -118.93 143.74 46.84 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.136 0.493 . . . . 0.0 110.979 -177.294 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 784' ' ' LYS . . . . . 0.56 ' HG3' ' CZ ' ' A' ' 736' ' ' PHE . 62.6 mtpt -74.32 -21.28 59.79 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.973 -179.449 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 785' ' ' ARG . . . . . 0.476 ' HA ' ' CZ ' ' A' ' 785' ' ' ARG . 0.5 OUTLIER -88.35 94.91 10.0 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.657 -178.607 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.984 0 CA-C-O 118.608 -0.71 . . . . 0.0 109.843 173.278 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 801' ' ' DGP . . . . . 0.582 " H4'" ' HB2' ' A' ' 756' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo . . . . . 0 N--CA 1.478 0.57 0 N-CA-C 111.535 -0.217 . . . . 0.0 111.535 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -104.5 125.9 51.1 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 178.082 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . 95.04 45.15 3.14 Favored Glycine 0 N--CA 1.445 -0.732 0 C-N-CA 120.627 -0.797 . . . . 0.0 111.203 -175.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 59.9 t -76.48 91.69 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.152 0.501 . . . . 0.0 110.309 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -109.86 110.31 21.24 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.387 0.613 . . . . 0.0 110.585 178.527 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 17.8 m -132.12 99.85 4.85 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.381 177.308 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 17.0 tt0 -82.99 -3.36 57.12 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.214 0.53 . . . . 0.0 110.25 -175.472 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -72.49 105.24 4.09 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 174.722 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . -64.43 -55.04 25.56 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.081 -176.092 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 3.1 p -110.08 111.11 34.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-O 121.395 0.616 . . . . 0.0 109.719 175.11 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 727' ' ' ASP . . . . . 0.459 ' HB3' ' HB3' ' A' ' 730' ' ' ARG . 19.7 t70 -108.63 128.1 54.55 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.37 -177.744 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 13.5 t60 -62.42 -50.46 71.42 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.638 -176.387 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -77.53 -36.93 51.92 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.398 -172.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 730' ' ' ARG . . . . . 0.459 ' HB3' ' HB3' ' A' ' 727' ' ' ASP . 53.2 ttp180 -59.92 -41.02 90.85 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 175.659 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -65.76 -45.59 81.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.714 178.045 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 19.3 mmm -58.24 -45.02 88.49 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.93 178.089 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 74.9 mt -70.71 -43.39 77.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.827 -177.461 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 8.5 p -66.28 -35.5 75.12 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.14 -177.5 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -77.15 -27.6 53.9 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-O 120.789 0.328 . . . . 0.0 110.449 176.418 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 736' ' ' PHE . . . . . 0.507 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 25.7 t80 -65.34 -41.1 94.28 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.299 178.015 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 65.6 mtm -63.58 -29.71 70.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.071 0.463 . . . . 0.0 110.518 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -96.45 8.45 44.03 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.026 -0.533 . . . . 0.0 111.097 179.252 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 44.2 t -93.68 165.88 12.5 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.363 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -84.91 -1.65 56.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.292 -179.02 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -73.79 160.47 31.44 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.719 179.224 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 4.4 mpp? -108.89 -28.56 9.09 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.217 175.102 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 26.9 pt20 -142.92 127.68 18.18 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.211 0.529 . . . . 0.0 111.145 178.846 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 744' ' ' LEU . . . . . 0.507 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 52.7 tp -96.73 106.13 18.37 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.312 179.057 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -90.94 106.07 18.26 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.089 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -75.14 157.18 85.44 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.19 -177.407 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 747' ' ' PRO . . . . . 0.411 ' HA ' ' HD3' ' A' ' 748' ' ' PRO . 19.6 Cg_exo -68.33 161.8 43.2 Favored 'Trans proline' 0 CA--C 1.535 0.539 0 C-N-CA 122.641 2.228 . . . . 0.0 112.057 175.125 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 748' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 747' ' ' PRO . 5.5 Cg_exo -76.39 -9.75 18.89 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.505 2.137 . . . . 0.0 111.753 178.742 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 20.1 t -64.07 -21.44 66.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.427 -179.139 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 11.2 mp -61.5 121.24 12.21 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.655 -0.248 . . . . 0.0 110.74 178.578 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 751' ' ' ASN . . . . . 0.489 ' O ' ' HG2' ' A' ' 755' ' ' ARG . 3.4 p-10 -90.72 -176.65 4.77 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 177.661 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 15.1 m -50.11 -49.83 50.42 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -173.418 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 38.7 t-80 -54.04 -47.9 71.11 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.977 177.368 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 754' ' ' ASP . . . . . 0.491 ' O ' HG23 ' A' ' 758' ' ' VAL . 57.9 m-20 -62.75 -45.43 92.76 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.629 -176.86 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 755' ' ' ARG . . . . . 0.489 ' HG2' ' O ' ' A' ' 751' ' ' ASN . 23.7 mmt180 -52.99 -60.59 3.09 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.835 176.263 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 756' ' ' LEU . . . . . 0.41 HD23 " H1'" ' A' ' 801' ' ' DGP . 2.3 tm? -52.62 -45.04 66.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 114.654 -1.157 . . . . 0.0 111.269 -177.298 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 10.2 mmt85 -55.48 -49.04 73.56 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.991 178.366 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 758' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 754' ' ' ASP . 63.1 t -62.71 -45.34 99.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.738 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -55.69 -54.33 45.61 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.824 179.588 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 99.3 mt-30 -54.69 -52.04 63.65 Favored 'General case' 0 C--O 1.232 0.183 0 O-C-N 123.25 0.344 . . . . 0.0 111.528 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 94.3 mt -62.77 -50.42 79.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.228 -176.578 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -64.1 -38.78 92.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.842 0.353 . . . . 0.0 111.166 -178.078 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 763' ' ' GLU . . . . . 0.458 ' CD ' HN21 ' A' ' 801' ' ' DGP . 42.0 tt0 -66.25 -35.83 81.43 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.035 -178.8 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -85.19 -29.55 24.63 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.757 0.313 . . . . 0.0 110.942 -178.65 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 6.7 m170 -70.08 -24.44 63.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.835 0.35 . . . . 0.0 110.598 174.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 96.2 28.82 8.88 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.871 -0.681 . . . . 0.0 112.366 177.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 56.0 mt -105.08 170.89 7.61 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 768' ' ' ARG . . . . . 0.566 ' HB3' ' OG ' ' A' ' 783' ' ' SER . 30.4 ttt180 -98.89 140.12 33.53 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 -178.06 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -150.92 134.05 16.04 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.28 0.562 . . . . 0.0 111.782 -176.688 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -155.47 168.23 27.79 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.493 175.291 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 7.2 m -101.22 140.12 35.95 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.12 0.486 . . . . 0.0 110.694 -176.76 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 9.6 m -120.66 132.74 55.26 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.859 -0.609 . . . . 0.0 109.81 -178.13 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 102.41 175.12 27.35 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.889 -0.672 . . . . 0.0 111.493 -175.776 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -115.83 -61.75 1.69 Allowed 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 -175.179 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . -108.72 -111.6 3.48 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.579 -0.819 . . . . 0.0 113.058 -175.055 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -67.54 -23.66 65.45 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.876 0.37 . . . . 0.0 111.055 -176.127 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 74.1 mtp180 -91.44 1.65 56.97 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.91 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 778' ' ' ARG . . . . . . . . . . . . . 41.1 ttt85 -72.56 131.26 42.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.422 0.63 . . . . 0.0 110.922 179.289 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 49.0 p90 -140.44 -175.16 4.17 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.585 177.576 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 6.2 tt -121.13 135.64 60.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.85 0.357 . . . . 0.0 110.68 -178.152 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 29.5 m -116.97 124.86 50.39 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.697 -177.403 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 47.5 t -108.53 124.06 64.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.095 176.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 783' ' ' SER . . . . . 0.566 ' OG ' ' HB3' ' A' ' 768' ' ' ARG . 4.6 p -113.37 140.78 47.75 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 121.311 0.577 . . . . 0.0 111.099 -179.59 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 784' ' ' LYS . . . . . 0.481 ' HG3' ' CZ ' ' A' ' 736' ' ' PHE . 62.7 mtpt -75.13 -21.57 58.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.084 179.231 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 11.6 mmm180 -80.53 94.22 6.21 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.102 -0.954 . . . . 0.0 111.187 178.253 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.168 0 CA-C-O 118.819 -0.61 . . . . 0.0 110.292 178.173 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 801' ' ' DGP . . . . . 0.458 HN21 ' CD ' ' A' ' 763' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo . . . . . 0 N--CA 1.476 0.446 0 N-CA-C 110.574 -0.587 . . . . 0.0 110.574 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -136.77 101.83 4.72 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.303 0.573 . . . . 0.0 110.66 -178.759 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . -138.56 61.18 0.58 Allowed Glycine 0 N--CA 1.446 -0.695 0 N-CA-C 110.741 -0.944 . . . . 0.0 110.741 176.497 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 50.7 t -95.73 111.82 26.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 120.875 0.369 . . . . 0.0 110.581 -175.132 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -97.98 -41.01 8.18 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.184 0.516 . . . . 0.0 110.186 174.704 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 17.9 t -144.93 143.92 30.8 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.745 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 25.8 mp0 -71.23 -34.77 71.1 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.985 0.421 . . . . 0.0 109.926 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 40.0 m-20 -93.99 43.93 1.11 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.906 177.102 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . -75.96 68.69 2.24 Favored Glycine 0 N--CA 1.449 -0.454 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.932 179.219 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 2.8 p -141.73 109.13 2.16 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.705 0 CA-C-O 121.668 0.747 . . . . 0.0 110.648 179.458 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 727' ' ' ASP . . . . . 0.551 ' HB3' ' HB3' ' A' ' 730' ' ' ARG . 8.9 t70 -148.07 120.41 8.42 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 114.809 -1.087 . . . . 0.0 108.286 175.48 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -54.06 -63.31 1.19 Allowed 'General case' 0 C--N 1.327 -0.394 0 O-C-N 123.465 0.478 . . . . 0.0 111.202 -172.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -69.38 -32.96 72.33 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.832 -174.294 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 730' ' ' ARG . . . . . 0.551 ' HB3' ' HB3' ' A' ' 727' ' ' ASP . 57.8 ttm-85 -64.2 -45.78 86.82 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.227 177.868 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 731' ' ' ALA . . . . . 0.438 ' HA ' HG12 ' A' ' 734' ' ' VAL . . . -62.24 -42.68 99.53 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.727 179.619 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 26.8 mmm -59.3 -44.71 92.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.687 177.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 733' ' ' ILE . . . . . 0.422 HD11 HG13 ' A' ' 758' ' ' VAL . 66.7 mt -74.01 -43.04 52.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.146 -0.479 . . . . 0.0 112.174 -176.724 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 734' ' ' VAL . . . . . 0.438 HG12 ' HA ' ' A' ' 731' ' ' ALA . 12.1 p -64.62 -40.3 88.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.19 -176.67 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -77.45 -26.38 51.45 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.367 178.231 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 736' ' ' PHE . . . . . 0.47 ' CZ ' ' HG3' ' A' ' 784' ' ' LYS . 23.8 t80 -60.52 -39.97 89.75 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.756 174.432 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 67.7 mtm -63.54 -25.38 68.22 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.02 0.438 . . . . 0.0 110.698 177.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -96.96 3.07 52.22 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.26 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 67.0 m -101.52 170.99 7.84 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.801 0.334 . . . . 0.0 110.992 -178.59 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -85.43 -11.27 54.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.389 -176.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -63.98 128.53 36.24 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.473 176.612 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 742' ' ' MET . . . . . 0.401 ' HG3' ' HG3' ' A' ' 743' ' ' GLN . 14.5 ptp -83.57 -24.71 31.44 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.838 0.351 . . . . 0.0 110.407 175.846 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 743' ' ' GLN . . . . . 0.401 ' HG3' ' HG3' ' A' ' 742' ' ' MET . 52.0 mt-30 -134.63 131.83 38.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.286 -178.266 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 744' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -94.71 98.63 10.91 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 175.211 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -83.29 101.3 11.19 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.386 -178.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 746' ' ' PHE . . . . . 0.426 ' HA ' ' HD3' ' A' ' 747' ' ' PRO . 68.1 m-85 -85.56 148.29 48.82 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.734 179.586 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 747' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 746' ' ' PHE . 14.8 Cg_exo -68.29 155.0 70.87 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 122.68 2.253 . . . . 0.0 112.028 176.693 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -68.02 -8.71 23.48 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.729 2.286 . . . . 0.0 112.46 178.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 32.1 t -63.14 -22.67 67.02 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.284 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 11.2 mp -59.29 118.54 6.06 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 175.724 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 751' ' ' ASN . . . . . 0.408 HD21 ' HB2' ' A' ' 753' ' ' HIS . 1.0 OUTLIER -81.02 -178.2 6.78 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 179.494 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 14.0 p -54.63 -42.6 71.4 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.688 0.28 . . . . 0.0 111.201 -178.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 753' ' ' HIS . . . . . 0.408 ' HB2' HD21 ' A' ' 751' ' ' ASN . 75.6 m80 -68.99 -40.0 79.03 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.886 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 41.5 m-20 -59.8 -51.0 71.62 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 121.07 0.462 . . . . 0.0 110.261 178.634 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 43.8 mtt180 -64.96 -43.72 91.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.519 -178.181 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 756' ' ' LEU . . . . . 0.519 ' HB2' " H4'" ' A' ' 801' ' ' DGP . 55.7 tp -54.26 -41.47 68.84 Favored 'General case' 0 C--N 1.33 -0.242 0 O-C-N 123.367 0.417 . . . . 0.0 110.292 177.518 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 757' ' ' ARG . . . . . 0.616 ' HE ' ' HA ' ' A' ' 757' ' ' ARG . 0.7 OUTLIER -60.39 -48.22 82.68 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.065 176.886 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 758' ' ' VAL . . . . . 0.422 HG13 HD11 ' A' ' 733' ' ' ILE . 58.7 t -59.75 -50.18 81.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.022 178.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -55.26 -50.18 70.15 Favored 'General case' 0 C--O 1.226 -0.156 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.557 179.148 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -63.93 -37.72 88.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.829 -177.624 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 96.3 mt -69.54 -44.11 80.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 120.8 0.333 . . . . 0.0 110.65 178.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -66.01 -34.98 79.34 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.201 0.525 . . . . 0.0 110.182 177.35 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 763' ' ' GLU . . . . . 0.483 ' CD ' HN21 ' A' ' 801' ' ' DGP . 38.5 tt0 -66.53 -38.32 86.92 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.41 175.79 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -69.77 -42.81 73.33 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.906 177.771 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 11.7 m170 -75.24 -29.33 60.19 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.88 -178.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 92.99 43.49 4.1 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.117 178.51 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 82.8 mt -110.35 -170.16 1.59 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.923 0.392 . . . . 0.0 110.544 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 768' ' ' ARG . . . . . 0.435 ' HD3' ' HB2' ' A' ' 783' ' ' SER . 60.3 ttt-85 -106.67 126.63 52.52 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.822 -179.226 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -139.77 132.44 28.92 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.066 0.46 . . . . 0.0 111.243 -177.018 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -156.36 138.87 14.94 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.668 -176.615 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 771' ' ' SER . . . . . 0.424 ' HA ' ' HA ' ' A' ' 780' ' ' ILE . 19.2 m -85.31 135.81 33.75 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.047 0.451 . . . . 0.0 110.191 178.172 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 3.9 m -116.0 124.42 50.45 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.79 -173.722 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 89.46 175.39 46.07 Favored Glycine 0 N--CA 1.453 -0.212 0 CA-C-N 115.838 -0.619 . . . . 0.0 112.727 178.359 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 774' ' ' GLU . . . . . 0.44 ' OE1' ' HD2' ' A' ' 778' ' ' ARG . 4.1 mm-40 -135.42 -167.2 1.97 Allowed 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 122.66 0.384 . . . . 0.0 110.117 178.774 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . 65.48 -132.11 35.24 Favored Glycine 0 N--CA 1.447 -0.597 0 C-N-CA 120.644 -0.789 . . . . 0.0 111.18 -177.225 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 16.0 pttp -107.36 6.36 28.3 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.133 0.492 . . . . 0.0 110.06 176.138 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -93.63 -11.04 32.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.657 177.499 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 778' ' ' ARG . . . . . 0.44 ' HD2' ' OE1' ' A' ' 774' ' ' GLU . 35.1 ttt180 -58.2 122.28 12.77 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.948 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 779' ' ' PHE . . . . . 0.413 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 28.4 p90 -131.46 -171.99 2.74 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 176.657 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 780' ' ' ILE . . . . . 0.424 ' HA ' ' HA ' ' A' ' 771' ' ' SER . 9.8 tt -127.96 131.82 69.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 121.198 0.523 . . . . 0.0 111.238 -177.779 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 13.4 m -113.71 119.22 36.66 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.345 -178.247 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 43.3 t -102.09 121.15 52.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.007 177.2 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 783' ' ' SER . . . . . 0.435 ' HB2' ' HD3' ' A' ' 768' ' ' ARG . 4.2 m -109.3 138.96 44.85 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-O 120.738 0.304 . . . . 0.0 110.322 -179.128 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 784' ' ' LYS . . . . . 0.47 ' HG3' ' CZ ' ' A' ' 736' ' ' PHE . 61.4 mtpt -66.95 -51.97 48.65 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.663 178.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 58.7 mmt-85 -118.91 -76.98 0.57 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.357 176.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.288 -0.863 . . . . 0.0 110.064 179.209 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 801' ' ' DGP . . . . . 0.519 " H4'" ' HB2' ' A' ' 756' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo . . . . . 0 N--CA 1.477 0.507 0 N-CA-C 110.293 -0.695 . . . . 0.0 110.293 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 718' ' ' GLU . . . . . 0.451 ' HB3' HG22 ' A' ' 720' ' ' VAL . 5.2 mp0 -105.39 -75.78 0.62 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.49 -175.359 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . 107.28 -12.32 40.15 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.641 -0.79 . . . . 0.0 111.995 179.659 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 720' ' ' VAL . . . . . 0.451 HG22 ' HB3' ' A' ' 718' ' ' GLU . 22.0 m -90.7 20.7 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.504 -0.348 . . . . 0.0 111.191 -176.867 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -54.16 -34.34 60.2 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.522 177.669 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 53.7 m -147.4 93.72 2.28 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.105 175.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -73.77 -72.17 0.28 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.285 178.559 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -82.53 -86.89 0.1 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.856 176.765 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . 51.27 45.74 52.17 Favored Glycine 0 C--N 1.333 0.394 0 O-C-N 123.608 0.567 . . . . 0.0 113.259 175.507 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 6.7 p -108.58 112.63 41.2 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.684 0 CA-C-O 121.809 0.814 . . . . 0.0 109.933 -179.034 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 727' ' ' ASP . . . . . 0.443 ' HB3' ' HB3' ' A' ' 730' ' ' ARG . 3.3 t70 -138.4 154.95 48.9 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 114.777 -1.101 . . . . 0.0 108.606 178.87 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 15.6 t60 -54.24 -61.42 2.31 Favored 'General case' 0 C--N 1.331 -0.198 0 O-C-N 123.203 0.314 . . . . 0.0 110.63 -177.745 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -71.21 -33.01 69.52 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.466 -0.333 . . . . 0.0 110.755 -175.083 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 730' ' ' ARG . . . . . 0.443 ' HB3' ' HB3' ' A' ' 727' ' ' ASP . 10.4 tpt180 -55.31 -47.74 75.16 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.938 0.399 . . . . 0.0 110.355 173.054 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 731' ' ' ALA . . . . . 0.408 ' HA ' HG12 ' A' ' 734' ' ' VAL . . . -64.89 -42.34 94.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.43 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 35.6 mmm -60.62 -39.6 88.81 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.011 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 733' ' ' ILE . . . . . 0.435 HD11 HG13 ' A' ' 758' ' ' VAL . 74.3 mt -74.93 -45.45 43.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.781 -178.412 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 734' ' ' VAL . . . . . 0.408 HG12 ' HA ' ' A' ' 731' ' ' ALA . 11.3 p -66.33 -37.42 79.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 C-N-CA 120.648 -0.421 . . . . 0.0 110.911 -177.577 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -80.59 -21.6 41.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.752 0.311 . . . . 0.0 110.374 178.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 736' ' ' PHE . . . . . 0.599 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 15.8 t80 -61.16 -46.08 91.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.532 174.015 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 64.7 mtm -60.66 -34.53 74.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.546 178.036 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -78.86 -29.63 44.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.182 -179.144 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 68.6 m -73.55 -17.64 61.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.064 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 58.5 mttp 69.99 17.25 7.46 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 173.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 741' ' ' LYS . . . . . 0.474 ' HE2' ' O ' ' A' ' 743' ' ' GLN . 46.1 mtpt -69.7 139.01 53.38 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 172.13 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -73.31 -31.14 63.84 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.854 0.359 . . . . 0.0 110.675 -178.666 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 743' ' ' GLN . . . . . 0.474 ' O ' ' HE2' ' A' ' 741' ' ' LYS . 54.9 mt-30 -143.73 136.94 27.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.943 -0.572 . . . . 0.0 109.726 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 744' ' ' LEU . . . . . 0.599 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 52.9 tp -112.24 110.74 21.16 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 176.235 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 745' ' ' GLU . . . . . 0.411 ' H ' ' CD ' ' A' ' 745' ' ' GLU . 0.7 OUTLIER -86.07 108.02 18.08 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.741 178.616 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . 60.6 m-85 -78.97 154.33 77.73 Favored Pre-proline 0 C--N 1.322 -0.623 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.401 177.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 747' ' ' PRO . . . . . 0.46 ' O ' HD13 ' A' ' 750' ' ' LEU . 31.5 Cg_exo -60.4 147.78 92.83 Favored 'Trans proline' 0 CA--C 1.529 0.269 0 C-N-CA 122.689 2.259 . . . . 0.0 112.233 178.029 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -70.73 -7.45 21.37 Favored 'Trans proline' 0 CA--C 1.528 0.187 0 C-N-CA 122.704 2.269 . . . . 0.0 112.689 179.648 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 24.6 m -71.11 -16.88 62.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.377 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 750' ' ' LEU . . . . . 0.46 HD13 ' O ' ' A' ' 747' ' ' PRO . 10.9 mp -59.97 118.91 6.82 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.096 174.429 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -88.11 -178.69 6.02 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 177.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 19.7 m -53.19 -31.41 42.69 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -176.675 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -79.42 -37.72 36.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.457 0.17 . . . . 0.0 111.124 -179.194 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 754' ' ' ASP . . . . . 0.428 ' HB3' ' HG ' ' A' ' 750' ' ' LEU . 67.6 m-20 -66.43 -44.39 83.02 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.222 0.534 . . . . 0.0 109.758 177.77 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 755' ' ' ARG . . . . . 0.415 ' CB ' " H5'" ' A' ' 801' ' ' DGP . 74.8 mtt180 -60.6 -50.28 74.16 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.179 177.309 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 756' ' ' LEU . . . . . 0.568 ' HB2' " H4'" ' A' ' 801' ' ' DGP . 55.8 tp -54.54 -39.69 67.93 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.702 179.629 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 757' ' ' ARG . . . . . 0.416 ' HB3' ' O ' ' A' ' 754' ' ' ASP . 3.8 tpt180 -55.98 -51.78 66.52 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.202 175.305 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 758' ' ' VAL . . . . . 0.435 HG13 HD11 ' A' ' 733' ' ' ILE . 85.5 t -61.33 -49.22 85.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.974 179.356 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 89.6 m-70 -53.59 -56.28 18.5 Favored 'General case' 0 N--CA 1.463 0.217 0 O-C-N 123.419 0.449 . . . . 0.0 110.838 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -55.97 -45.24 78.98 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.057 0.392 . . . . 0.0 112.057 -179.173 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 98.5 mt -66.69 -48.55 79.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.574 0.226 . . . . 0.0 111.069 -178.385 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -65.44 -32.13 73.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.916 0.389 . . . . 0.0 110.68 -179.029 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 763' ' ' GLU . . . . . 0.409 ' CD ' HN21 ' A' ' 801' ' ' DGP . 24.7 tt0 -69.74 -33.45 72.47 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.347 178.56 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -73.46 -35.85 65.77 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.018 176.687 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 -67.19 -35.98 80.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.682 175.744 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 102.01 19.02 15.81 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.18 -179.251 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 71.2 mt -92.35 178.48 5.82 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 18.4 ttt180 -96.43 140.04 31.67 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 174.494 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.1 p80 -145.63 123.31 11.85 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.22 -179.552 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -151.07 167.52 27.43 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.07 -179.135 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 15.1 m -108.53 141.67 40.08 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 121.029 0.443 . . . . 0.0 110.745 -177.671 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 23.8 t -131.28 146.13 52.18 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.855 -178.058 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 80.68 165.34 33.02 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.727 -0.749 . . . . 0.0 111.798 -176.124 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -128.9 166.1 19.77 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.823 0.311 . . . . 0.0 110.414 179.25 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . 68.08 -133.79 29.06 Favored Glycine 0 N--CA 1.445 -0.715 0 C-N-CA 121.085 -0.579 . . . . 0.0 112.047 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp -91.35 8.38 36.39 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.125 0.488 . . . . 0.0 110.475 178.554 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 58.9 mtm180 -104.81 3.36 31.05 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.266 170.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 778' ' ' ARG . . . . . . . . . . . . . 19.8 ttt180 -80.73 115.45 20.23 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.598 178.29 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 45.7 p90 -133.8 166.69 22.07 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.406 -0.815 . . . . 0.0 109.794 -177.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 12.2 tt -102.49 132.59 48.24 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-O 121.155 0.503 . . . . 0.0 110.489 -179.495 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 6.1 m -113.6 118.75 35.27 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.047 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 50.4 t -98.57 130.23 47.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 177.628 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 8.5 t -122.26 142.26 50.64 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.063 0.459 . . . . 0.0 110.249 -177.856 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 9.6 mtpm? -78.69 143.41 36.29 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.751 -178.638 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 16.5 mtm180 -103.83 -4.57 23.39 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.472 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.16 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.164 175.244 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 801' ' ' DGP . . . . . 0.568 " H4'" ' HB2' ' A' ' 756' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_exo . . . . . 0 N--CA 1.479 0.65 0 N-CA-C 110.765 -0.513 . . . . 0.0 110.765 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 62.83 95.63 0.04 OUTLIER 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.472 0.653 . . . . 0.0 111.02 177.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . 105.61 56.75 0.67 Allowed Glycine 0 N--CA 1.444 -0.827 0 N-CA-C 111.12 -0.792 . . . . 0.0 111.12 -175.672 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 5.3 p -77.51 108.33 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 CA-C-O 121.715 0.769 . . . . 0.0 110.242 -178.737 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -76.84 93.23 3.7 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.141 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 23.1 t -147.9 120.49 8.56 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.493 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -68.17 -64.44 0.86 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.259 -176.313 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -71.35 -35.47 71.17 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-O 121.259 0.552 . . . . 0.0 110.124 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . 121.04 -50.38 0.83 Allowed Glycine 0 N--CA 1.444 -0.81 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.586 -179.14 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 11.2 p -135.62 136.59 50.38 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 CA-C-O 120.975 0.417 . . . . 0.0 110.664 -176.672 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 727' ' ' ASP . . . . . 0.509 ' HB3' ' HB2' ' A' ' 730' ' ' ARG . 4.5 t70 -64.14 140.37 58.86 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.899 175.553 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 14.3 t60 -61.22 -57.77 11.07 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.621 -172.103 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -72.35 -22.6 61.13 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.903 -175.283 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 730' ' ' ARG . . . . . 0.509 ' HB2' ' HB3' ' A' ' 727' ' ' ASP . 0.4 OUTLIER -60.7 -49.59 76.9 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 172.658 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 731' ' ' ALA . . . . . 0.512 ' HA ' HG12 ' A' ' 734' ' ' VAL . . . -59.81 -46.15 90.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.548 178.517 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 35.5 mmm -55.48 -44.55 76.58 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.011 178.222 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 59.1 mt -77.38 -38.22 26.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.188 -0.46 . . . . 0.0 112.003 -176.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 734' ' ' VAL . . . . . 0.512 HG12 ' HA ' ' A' ' 731' ' ' ALA . 8.8 p -68.01 -36.69 76.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 O-C-N 122.036 -0.415 . . . . 0.0 110.666 -178.724 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -73.47 -31.77 63.96 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 121.153 0.501 . . . . 0.0 109.804 175.55 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 736' ' ' PHE . . . . . 0.535 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 22.1 t80 -63.46 -40.82 98.15 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.824 175.293 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 737' ' ' MET . . . . . 0.437 ' SD ' HD11 ' A' ' 767' ' ' LEU . 73.2 mtm -72.99 -6.86 48.26 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.998 0.428 . . . . 0.0 110.833 177.237 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -103.24 0.46 31.63 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.857 174.099 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 32.8 t -102.67 169.77 8.43 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.28 -178.168 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 2.6 ptmt -90.9 -6.54 54.01 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.063 -177.017 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 741' ' ' LYS . . . . . 0.542 ' O ' ' HE2' ' A' ' 784' ' ' LYS . 27.6 mtpp -64.47 126.25 27.23 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.586 177.668 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 3.2 mpp? -67.73 -30.32 69.77 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.439 176.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -149.17 155.0 39.99 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 120.904 0.383 . . . . 0.0 111.372 176.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 744' ' ' LEU . . . . . 0.535 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 69.0 tp -115.17 111.31 20.8 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.277 -176.841 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -82.72 105.74 13.99 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.417 178.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 746' ' ' PHE . . . . . 0.467 ' O ' ' HB2' ' A' ' 779' ' ' PHE . 71.8 m-85 -79.01 154.81 77.71 Favored Pre-proline 0 C--N 1.325 -0.489 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 176.254 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 747' ' ' PRO . . . . . 0.445 ' O ' HD13 ' A' ' 750' ' ' LEU . 59.6 Cg_endo -76.4 156.39 36.84 Favored 'Trans proline' 0 CA--C 1.533 0.452 0 C-N-CA 122.453 2.102 . . . . 0.0 112.24 178.295 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -68.75 -5.12 14.68 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.959 2.44 . . . . 0.0 113.203 -179.632 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 4.4 p -69.23 -16.93 63.71 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.86 -178.827 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 750' ' ' LEU . . . . . 0.445 HD13 ' O ' ' A' ' 747' ' ' PRO . 11.2 mp -63.55 117.98 7.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.337 176.057 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -78.8 -176.95 5.22 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 20.0 t -54.47 -39.51 67.53 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 120.768 0.318 . . . . 0.0 110.871 -177.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 40.1 m80 -73.25 -38.83 65.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.304 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 754' ' ' ASP . . . . . 0.423 ' HB3' ' HG ' ' A' ' 750' ' ' LEU . 66.2 m-20 -63.37 -48.1 79.31 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.928 0.394 . . . . 0.0 110.259 179.287 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 755' ' ' ARG . . . . . 0.563 ' HB2' H5'' ' A' ' 801' ' ' DGP . 74.0 mtt180 -60.62 -46.77 89.02 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.985 177.518 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 60.9 tp -55.2 -44.38 75.28 Favored 'General case' 0 CA--C 1.523 -0.066 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.727 179.353 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 757' ' ' ARG . . . . . 0.457 ' HE ' ' HA ' ' A' ' 757' ' ' ARG . 2.6 mmp_? -51.5 -54.82 23.19 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.474 174.598 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 90.6 t -60.21 -46.79 94.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.495 -178.136 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -56.93 -52.22 66.04 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 110.314 -0.254 . . . . 0.0 110.314 178.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 99.3 mt-30 -56.71 -43.68 80.82 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.462 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 95.4 mt -67.08 -50.06 67.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.257 -178.269 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -62.14 -38.66 89.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.045 0.45 . . . . 0.0 110.523 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -68.03 -30.68 69.97 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.554 178.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -76.49 -42.42 43.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.502 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 38.0 m-70 -75.41 -28.34 59.37 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.956 -179.523 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 103.67 24.42 7.79 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.657 177.411 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 767' ' ' LEU . . . . . 0.437 HD11 ' SD ' ' A' ' 737' ' ' MET . 79.2 mt -96.16 164.34 12.72 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.878 -0.415 . . . . 0.0 109.878 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 37.9 ttp180 -93.63 112.92 24.9 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.953 0.406 . . . . 0.0 110.151 -178.832 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 769' ' ' HIS . . . . . 0.442 ' H ' ' CD2' ' A' ' 769' ' ' HIS . 2.9 p80 -108.54 124.25 50.17 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.625 -178.229 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -137.7 130.27 29.7 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.298 -179.584 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 771' ' ' SER . . . . . 0.448 ' HA ' ' HA ' ' A' ' 780' ' ' ILE . 12.5 p -96.07 139.62 31.98 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.794 179.054 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 19.2 m -129.45 141.11 51.1 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.178 -177.41 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 110.67 176.29 20.61 Favored Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.647 -0.787 . . . . 0.0 111.49 -179.182 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -124.11 108.97 12.9 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.79 0.295 . . . . 0.0 111.424 -175.544 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . 54.66 -99.34 0.06 OUTLIER Glycine 0 C--N 1.332 0.347 0 CA-C-N 115.673 -0.694 . . . . 0.0 114.043 174.769 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 58.7 tptt -60.18 -34.48 73.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.097 0.475 . . . . 0.0 111.151 -178.163 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 68.4 mtp180 -106.48 20.01 19.64 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.752 -177.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 778' ' ' ARG . . . . . 0.404 ' HE ' ' HB2' ' A' ' 771' ' ' SER . 78.9 ttt180 -87.61 122.42 31.27 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.912 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 779' ' ' PHE . . . . . 0.467 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 48.1 p90 -121.77 171.96 8.5 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.157 175.718 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 780' ' ' ILE . . . . . 0.448 ' HA ' ' HA ' ' A' ' 771' ' ' SER . 12.3 tt -120.68 138.39 51.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 121.063 0.459 . . . . 0.0 110.79 -178.696 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 8.8 m -121.86 120.91 35.92 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.374 -179.674 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 50.1 t -99.8 115.6 41.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 177.363 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 29.2 t -110.92 136.18 50.34 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 121.266 0.555 . . . . 0.0 110.553 -178.304 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 784' ' ' LYS . . . . . 0.542 ' HE2' ' O ' ' A' ' 741' ' ' LYS . 52.8 mtmt -80.28 -22.67 41.37 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.136 178.509 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -91.73 109.41 20.73 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.585 -177.828 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.958 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.083 172.912 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 801' ' ' DGP . . . . . 0.563 H5'' ' HB2' ' A' ' 755' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_exo . . . . . 0 N--CA 1.481 0.749 0 N-CA-C 110.48 -0.623 . . . . 0.0 110.48 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -69.36 -39.01 78.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.156 0.503 . . . . 0.0 109.843 178.001 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . -176.19 144.52 7.06 Favored Glycine 0 N--CA 1.444 -0.784 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.727 177.109 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 40.7 t -94.54 96.25 5.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 175.773 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -75.67 125.86 29.88 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.578 -172.841 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 22.8 t -88.02 89.22 7.91 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 172.314 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -73.72 -64.51 0.98 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.127 -177.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -97.86 105.07 17.15 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 174.507 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . -116.74 39.91 2.54 Favored Glycine 0 N--CA 1.444 -0.797 0 C-N-CA 120.481 -0.866 . . . . 0.0 112.242 -176.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 3.7 p -119.24 89.87 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.666 0 CA-C-O 122.674 1.225 . . . . 0.0 110.523 -179.03 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 727' ' ' ASP . . . . . 0.428 ' HB3' ' HB3' ' A' ' 730' ' ' ARG . 17.2 t70 -140.94 133.46 28.53 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 113.76 -1.564 . . . . 0.0 108.428 174.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 13.4 t60 -61.1 -49.2 78.24 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 123.344 0.403 . . . . 0.0 110.793 -173.244 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -71.97 -38.27 69.76 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.994 -176.459 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 730' ' ' ARG . . . . . 0.428 ' HB3' ' HB3' ' A' ' 727' ' ' ASP . 42.1 ttt85 -62.54 -38.84 91.58 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.184 176.823 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -64.65 -45.56 86.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.241 176.639 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 32.9 mmm -58.01 -42.74 85.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.886 177.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 733' ' ' ILE . . . . . 0.43 HD11 HG13 ' A' ' 758' ' ' VAL . 72.8 mt -72.25 -42.92 66.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 N-CA-C 111.908 0.336 . . . . 0.0 111.908 -177.889 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 8.2 p -65.97 -36.99 78.82 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.576 -178.124 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -78.21 -24.44 47.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.073 0.463 . . . . 0.0 110.405 177.132 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 736' ' ' PHE . . . . . 0.551 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 34.9 t80 -64.43 -41.59 96.49 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.537 175.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 59.7 mtm -64.02 -28.81 70.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.844 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -85.81 -15.29 42.45 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.229 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 61.6 m -81.33 166.87 20.09 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.45 -179.271 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.98 7.22 44.94 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.924 0.392 . . . . 0.0 111.466 -179.579 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 73.5 mttt -85.22 126.92 34.06 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.024 173.638 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 95.5 mmm -81.6 -17.88 46.71 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.886 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -138.76 136.21 35.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.684 -178.178 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 744' ' ' LEU . . . . . 0.551 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 44.3 tp -120.17 109.97 16.06 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.096 178.62 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -90.09 113.08 24.75 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.457 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 746' ' ' PHE . . . . . 0.484 ' O ' ' HB2' ' A' ' 779' ' ' PHE . 84.1 m-85 -83.08 153.47 66.59 Favored Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.964 176.338 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 747' ' ' PRO . . . . . 0.438 ' O ' HD13 ' A' ' 750' ' ' LEU . 16.8 Cg_exo -67.18 155.79 69.1 Favored 'Trans proline' 0 CA--C 1.532 0.394 0 C-N-CA 122.508 2.139 . . . . 0.0 112.44 178.445 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -68.19 -7.71 20.73 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.838 2.359 . . . . 0.0 112.394 177.216 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 7.3 m -63.89 -20.25 65.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.552 179.403 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 750' ' ' LEU . . . . . 0.438 HD13 ' O ' ' A' ' 747' ' ' PRO . 11.2 mp -63.34 122.74 16.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.352 176.445 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 1.6 p30 -84.42 -178.61 6.96 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.341 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 15.2 m -48.55 -46.57 39.11 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 123.166 0.291 . . . . 0.0 111.381 179.726 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 50.9 m80 -72.03 -36.9 69.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.636 -178.212 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 -60.36 -50.67 72.69 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.133 0.492 . . . . 0.0 109.801 178.455 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 62.8 mtt85 -61.0 -45.15 95.98 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.181 178.334 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 756' ' ' LEU . . . . . 0.522 ' HB2' " H4'" ' A' ' 801' ' ' DGP . 53.4 tp -52.98 -42.81 65.89 Favored 'General case' 0 C--O 1.235 0.334 0 O-C-N 123.535 0.522 . . . . 0.0 111.03 -179.685 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 11.0 mmm180 -58.83 -53.69 55.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.017 176.168 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 758' ' ' VAL . . . . . 0.43 HG13 HD11 ' A' ' 733' ' ' ILE . 60.9 t -56.79 -48.68 80.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.401 -179.378 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -55.28 -55.3 33.01 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.596 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 760' ' ' GLN . . . . . 0.424 HE21 HD11 ' A' ' 756' ' ' LEU . 70.3 mt-30 -64.47 -33.37 75.73 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 -176.776 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 96.9 mt -70.14 -48.64 60.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 C-N-CA 120.894 -0.323 . . . . 0.0 110.464 178.057 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -63.49 -34.6 78.13 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.167 0.508 . . . . 0.0 110.28 177.67 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 763' ' ' GLU . . . . . 0.478 ' CD ' HN21 ' A' ' 801' ' ' DGP . 38.2 tt0 -64.28 -36.7 84.94 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.652 176.838 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -70.02 -46.54 64.85 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.189 176.02 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 11.2 m-70 -65.15 -30.12 71.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.108 -178.139 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 95.01 25.18 15.03 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.767 -0.73 . . . . 0.0 111.825 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 68.1 mt -99.3 176.93 5.36 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 22.6 ttp180 -99.66 135.29 41.29 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -132.69 127.69 35.33 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.189 0.518 . . . . 0.0 110.691 -178.653 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -133.85 143.12 48.12 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.98 -177.268 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 771' ' ' SER . . . . . 0.404 ' HB2' ' HE ' ' A' ' 778' ' ' ARG . 12.7 p -114.29 127.88 56.09 Favored 'General case' 0 C--N 1.317 -0.848 0 CA-C-O 121.275 0.56 . . . . 0.0 110.296 175.962 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -152.32 157.87 41.96 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.113 -174.204 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 773' ' ' GLY . . . . . 0.4 ' HA3' ' HA ' ' A' ' 778' ' ' ARG . . . 128.85 159.9 10.11 Favored Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 111.382 -0.687 . . . . 0.0 111.382 -177.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -81.31 92.0 6.31 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -175.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . 56.25 -92.28 0.02 OUTLIER Glycine 0 C--N 1.334 0.424 0 O-C-N 123.68 0.613 . . . . 0.0 113.881 172.104 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 776' ' ' LYS . . . . . 0.578 ' HD2' ' H ' ' A' ' 776' ' ' LYS . 10.9 mptt -65.09 -34.44 78.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.282 0.563 . . . . 0.0 109.551 179.557 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.78 16.64 10.39 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.985 -178.604 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 778' ' ' ARG . . . . . 0.404 ' HE ' ' HB2' ' A' ' 771' ' ' SER . 67.7 ttt180 -76.79 116.59 17.6 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 121.525 0.678 . . . . 0.0 110.13 177.151 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 779' ' ' PHE . . . . . 0.484 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 44.4 p90 -122.85 -172.01 2.4 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.208 -0.906 . . . . 0.0 109.833 -178.312 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 12.6 tt -127.5 133.82 66.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-O 120.984 0.421 . . . . 0.0 110.773 -178.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 24.7 m -119.71 116.01 25.08 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.415 -179.774 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 38.0 t -94.36 133.88 33.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.872 179.661 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -117.02 135.03 54.01 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.764 0.316 . . . . 0.0 111.16 -179.421 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 23.2 mtpp -66.16 147.15 53.77 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.171 175.267 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 785' ' ' ARG . . . . . 0.478 ' HA ' ' NE ' ' A' ' 785' ' ' ARG . 4.2 mmp_? -133.1 118.37 18.65 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.586 -176.942 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.973 0 CA-C-O 118.703 -0.665 . . . . 0.0 110.255 -178.884 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 801' ' ' DGP . . . . . 0.522 " H4'" ' HB2' ' A' ' 756' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo . . . . . 0 N--CA 1.478 0.567 0 N-CA-C 110.133 -0.756 . . . . 0.0 110.133 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -108.92 125.67 52.26 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.967 0.413 . . . . 0.0 110.49 -176.016 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . 172.05 139.75 2.9 Favored Glycine 0 N--CA 1.443 -0.849 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.709 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 16.4 t 58.59 67.3 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.651 0.739 . . . . 0.0 110.363 -178.704 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 721' ' ' GLU . . . . . 0.43 ' H ' ' CD ' ' A' ' 721' ' ' GLU . 0.3 OUTLIER -97.34 70.26 2.3 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.791 0.805 . . . . 0.0 109.512 178.202 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 7.6 m -69.33 97.49 0.96 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.012 -0.994 . . . . 0.0 111.415 -174.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 92.4 mt-30 -129.99 -52.38 1.13 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.042 175.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -82.78 67.62 8.92 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.688 0.756 . . . . 0.0 110.415 175.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . -162.6 36.76 0.35 Allowed Glycine 0 N--CA 1.441 -1.0 0 CA-C-N 114.942 -1.027 . . . . 0.0 110.87 178.333 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 3.1 p -111.61 92.54 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.791 0 CA-C-O 122.415 1.103 . . . . 0.0 109.906 -177.387 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 727' ' ' ASP . . . . . 0.495 ' HB3' ' HB3' ' A' ' 730' ' ' ARG . 5.7 t70 -140.06 133.77 30.43 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 113.839 -1.528 . . . . 0.0 108.17 179.541 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 30.6 t60 -55.4 -43.95 75.72 Favored 'General case' 0 C--N 1.327 -0.411 0 O-C-N 123.366 0.416 . . . . 0.0 111.359 -173.342 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 729' ' ' PHE . . . . . 0.467 ' CZ ' ' HB3' ' A' ' 754' ' ' ASP . 55.6 m-85 -80.98 -36.47 30.69 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.679 -175.769 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 730' ' ' ARG . . . . . 0.495 ' HB3' ' HB3' ' A' ' 727' ' ' ASP . 15.2 tpp85 -56.95 -43.72 81.86 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 174.427 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -64.63 -47.46 78.45 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.239 -179.556 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 4.5 mtm -65.78 -35.52 80.95 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.164 -178.428 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 733' ' ' ILE . . . . . 0.507 HD11 HG13 ' A' ' 758' ' ' VAL . 81.2 mt -73.27 -42.78 57.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.581 -0.282 . . . . 0.0 111.535 179.392 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 9.1 p -66.06 -37.53 79.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 120.594 -0.442 . . . . 0.0 110.975 -176.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -75.14 -29.3 60.45 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.881 0.372 . . . . 0.0 110.251 176.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 736' ' ' PHE . . . . . 0.535 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 36.1 t80 -61.8 -40.11 94.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.1 176.535 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 49.1 mtm -62.46 -33.19 74.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.788 178.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -92.08 3.58 54.98 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.069 -178.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 22.8 t -97.44 166.99 11.27 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -88.72 -1.17 57.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.79 0.329 . . . . 0.0 111.132 -178.569 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 741' ' ' LYS . . . . . 0.509 ' O ' ' HE2' ' A' ' 784' ' ' LYS . 97.0 mttt -66.64 133.13 49.62 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 173.69 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 27.2 ptt? -88.26 -23.2 23.57 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 178.213 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 743' ' ' GLN . . . . . 0.406 ' HA ' ' O ' ' A' ' 782' ' ' VAL . 29.6 pt20 -141.73 140.46 33.13 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.19 -179.13 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 744' ' ' LEU . . . . . 0.535 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 57.0 tp -118.76 103.65 9.85 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.353 177.437 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 745' ' ' GLU . . . . . 0.444 ' H ' ' CD ' ' A' ' 745' ' ' GLU . 0.1 OUTLIER -87.69 109.22 19.53 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.855 179.295 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 746' ' ' PHE . . . . . 0.412 ' HA ' ' HD3' ' A' ' 747' ' ' PRO . 75.3 m-85 -77.01 148.3 78.41 Favored Pre-proline 0 C--N 1.321 -0.669 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.36 178.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 747' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 746' ' ' PHE . 25.5 Cg_exo -62.66 151.14 85.24 Favored 'Trans proline' 0 CA--C 1.529 0.263 0 C-N-CA 122.711 2.274 . . . . 0.0 112.237 179.348 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -65.76 -7.4 16.46 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.781 2.321 . . . . 0.0 112.619 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 41.6 t -68.63 -17.64 64.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.953 178.364 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.1 mp -66.07 110.69 3.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.919 173.498 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -82.08 -176.93 6.4 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 175.594 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 14.6 m -49.59 -48.56 48.75 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -174.751 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 753' ' ' HIS . . . . . 0.457 ' O ' ' HG2' ' A' ' 757' ' ' ARG . 37.4 t-80 -56.73 -46.84 81.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.508 178.099 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 754' ' ' ASP . . . . . 0.467 ' HB3' ' CZ ' ' A' ' 729' ' ' PHE . 58.9 m-20 -65.34 -46.63 79.48 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.803 -176.021 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 755' ' ' ARG . . . . . 0.545 ' HB2' H5'' ' A' ' 801' ' ' DGP . 80.8 mtt180 -59.66 -45.64 91.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.672 177.385 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 756' ' ' LEU . . . . . 0.529 ' HB2' " H4'" ' A' ' 801' ' ' DGP . 3.2 tm? -54.75 -45.82 74.21 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.768 179.173 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 757' ' ' ARG . . . . . 0.457 ' HG2' ' O ' ' A' ' 753' ' ' HIS . 31.1 mmm180 -54.69 -50.34 68.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.213 -0.448 . . . . 0.0 109.868 177.332 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 758' ' ' VAL . . . . . 0.507 HG13 HD11 ' A' ' 733' ' ' ILE . 73.6 t -59.24 -48.0 88.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.01 178.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 88.4 m-70 -54.74 -58.83 5.97 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.444 -0.343 . . . . 0.0 110.87 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 18.3 mt-30 -60.05 -36.23 76.85 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -177.489 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 91.5 mt -70.78 -48.43 57.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 C-N-CA 121.123 -0.231 . . . . 0.0 111.133 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -65.45 -34.32 78.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.208 0.528 . . . . 0.0 110.273 179.142 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 763' ' ' GLU . . . . . 0.481 ' CD ' HN21 ' A' ' 801' ' ' DGP . 35.2 tt0 -63.5 -37.27 86.66 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.241 176.337 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -74.0 -39.44 63.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.557 178.038 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 10.4 m170 -69.7 -22.18 63.43 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.36 179.369 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 89.37 23.39 34.35 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.112 179.047 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 72.2 mt -93.26 -179.38 5.05 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 -179.125 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 768' ' ' ARG . . . . . 0.408 ' HE ' ' HB3' ' A' ' 783' ' ' SER . 61.2 ttp180 -104.68 127.97 52.6 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 177.385 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 5.5 p80 -135.27 130.0 34.46 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.024 0.44 . . . . 0.0 110.681 -176.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -149.08 155.67 41.08 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.276 -178.67 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 15.8 m -103.81 146.75 28.18 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.724 -177.315 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 23.0 t -134.01 145.88 49.89 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 179.307 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 99.5 -174.88 27.51 Favored Glycine 0 N--CA 1.446 -0.633 0 C-N-CA 120.54 -0.838 . . . . 0.0 111.77 -178.288 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -136.07 132.81 36.64 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.452 0.168 . . . . 0.0 111.162 -176.037 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . 63.14 -116.42 9.32 Favored Glycine 0 C--N 1.331 0.272 0 CA-C-N 116.014 -0.539 . . . . 0.0 113.447 173.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -82.59 -15.55 51.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.847 0.356 . . . . 0.0 110.864 -178.332 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 83.6 mtt180 -96.5 12.3 31.98 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.81 175.781 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 778' ' ' ARG . . . . . . . . . . . . . 59.7 ttt180 -85.82 120.49 27.3 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.153 176.318 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 779' ' ' PHE . . . . . 0.401 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 40.7 p90 -120.59 178.46 4.67 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.402 -0.817 . . . . 0.0 109.473 178.272 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 11.5 tt -125.41 135.02 65.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-O 121.076 0.465 . . . . 0.0 110.678 -178.398 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 25.0 m -119.3 120.64 37.56 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.406 -179.088 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 782' ' ' VAL . . . . . 0.406 ' O ' ' HA ' ' A' ' 743' ' ' GLN . 46.9 t -101.13 133.73 43.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.967 178.619 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 783' ' ' SER . . . . . 0.408 ' HB3' ' HE ' ' A' ' 768' ' ' ARG . 48.4 t -121.26 140.48 51.99 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 784' ' ' LYS . . . . . 0.509 ' HE2' ' O ' ' A' ' 741' ' ' LYS . 51.3 mtmt -75.06 143.73 43.33 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.614 -178.139 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -107.29 89.7 3.08 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.13 179.043 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.471 -0.776 . . . . 0.0 110.301 -177.859 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 801' ' ' DGP . . . . . 0.545 H5'' ' HB2' ' A' ' 755' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_endo . . . . . 0 N--CA 1.48 0.724 0 N-CA-C 110.549 -0.597 . . . . 0.0 110.549 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -77.13 149.53 35.65 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.172 -178.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . 117.77 20.7 4.48 Favored Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 120.719 -0.753 . . . . 0.0 111.604 -175.709 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 34.6 m -69.73 -20.04 23.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-O 121.191 0.519 . . . . 0.0 110.595 -179.542 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -84.77 85.37 7.46 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 175.572 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 6.8 m -107.3 98.01 7.69 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.275 -174.457 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -128.4 135.79 50.01 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.757 0.313 . . . . 0.0 110.511 175.617 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -74.79 -70.29 0.42 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.991 -0.549 . . . . 0.0 109.801 175.475 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . -115.66 -118.84 3.18 Favored Glycine 0 N--CA 1.444 -0.8 0 N-CA-C 110.154 -1.178 . . . . 0.0 110.154 171.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 8.7 p -163.89 119.97 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 121.611 0.72 . . . . 0.0 110.412 172.519 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 727' ' ' ASP . . . . . 0.414 ' HB3' ' HB3' ' A' ' 730' ' ' ARG . 19.7 t70 -84.3 150.11 25.62 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.066 179.526 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -52.77 -54.28 36.14 Favored 'General case' 0 C--N 1.331 -0.237 0 O-C-N 123.374 0.421 . . . . 0.0 111.062 -178.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 29.9 m-85 -72.9 -30.74 64.16 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.46 -175.596 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 730' ' ' ARG . . . . . 0.414 ' HB3' ' HB3' ' A' ' 727' ' ' ASP . 16.6 tpp85 -61.63 -45.91 92.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.088 173.618 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -62.24 -46.72 87.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.95 179.615 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 22.7 mmm -62.11 -39.44 92.54 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.313 -179.326 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 733' ' ' ILE . . . . . 0.436 ' O ' ' HG3' ' A' ' 737' ' ' MET . 57.9 mt -75.84 -41.33 39.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -178.371 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 8.4 p -66.82 -34.08 67.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 C-N-CA 120.936 -0.305 . . . . 0.0 111.066 -177.605 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 61.7 mt-10 -76.97 -31.54 56.62 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.011 0.434 . . . . 0.0 110.087 175.679 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 736' ' ' PHE . . . . . 0.461 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 37.6 t80 -63.03 -37.29 86.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.522 178.71 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 737' ' ' MET . . . . . 0.436 ' HG3' ' O ' ' A' ' 733' ' ' ILE . 52.3 mtm -61.84 -26.51 68.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.944 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -101.65 4.08 40.44 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.122 0.486 . . . . 0.0 111.088 -178.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 40.2 t -88.99 166.63 13.78 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.974 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 30.2 mtpp -87.33 -10.37 52.4 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.861 0.362 . . . . 0.0 110.398 178.556 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 29.3 mtpp -67.6 124.46 23.32 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.269 177.59 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 22.9 ptp -75.37 -27.23 59.06 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.492 178.24 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 -137.69 136.53 37.49 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.402 -178.125 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 744' ' ' LEU . . . . . 0.461 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 34.5 tp -106.89 104.99 14.8 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.19 -0.671 . . . . 0.0 109.19 176.585 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -87.76 104.6 16.71 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.979 -178.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 746' ' ' PHE . . . . . 0.406 ' HA ' ' HD3' ' A' ' 747' ' ' PRO . 68.2 m-85 -78.41 155.01 79.28 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.351 179.055 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 747' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 746' ' ' PHE . 14.5 Cg_exo -70.04 152.69 67.96 Favored 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 122.358 2.039 . . . . 0.0 111.892 176.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -65.83 -4.53 10.13 Favored 'Trans proline' 0 CA--C 1.529 0.244 0 C-N-CA 122.897 2.398 . . . . 0.0 112.394 178.453 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 11.6 m -67.57 -18.35 64.98 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.065 177.541 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 11.0 mp -70.4 109.29 4.68 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.983 -0.376 . . . . 0.0 109.983 175.32 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -78.2 -178.03 5.43 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 -179.227 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 20.0 m -52.85 -41.05 63.91 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 111.64 0.237 . . . . 0.0 111.64 -178.307 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 65.5 m170 -68.93 -44.35 73.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.499 0.19 . . . . 0.0 110.97 179.044 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -58.28 -49.01 78.64 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.156 0.503 . . . . 0.0 110.143 177.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 755' ' ' ARG . . . . . 0.44 HH11 ' HD3' ' A' ' 755' ' ' ARG . 24.0 mtm180 -63.72 -43.3 96.96 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.833 -179.676 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 756' ' ' LEU . . . . . 0.543 ' HB2' " H4'" ' A' ' 801' ' ' DGP . 54.4 tp -54.91 -42.35 72.08 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.872 0.367 . . . . 0.0 111.024 179.273 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 757' ' ' ARG . . . . . 0.434 ' HA ' ' NE ' ' A' ' 757' ' ' ARG . 1.9 mmp_? -62.9 -47.07 84.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.519 176.233 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 758' ' ' VAL . . . . . 0.468 ' CG1' HD13 ' A' ' 780' ' ' ILE . 99.7 t -59.5 -48.05 88.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.895 179.341 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 88.6 m-70 -55.27 -55.41 31.68 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 120.843 0.354 . . . . 0.0 110.438 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -62.43 -38.61 90.4 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.962 -178.223 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 85.2 mt -67.43 -44.97 86.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 C-N-CA 121.144 -0.222 . . . . 0.0 111.081 178.403 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -65.9 -36.91 84.7 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.18 0.514 . . . . 0.0 110.353 178.081 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -67.07 -33.38 75.37 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.825 175.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -71.5 -40.18 70.34 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.593 178.243 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -71.86 -30.66 65.67 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.136 176.676 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 96.15 31.97 6.98 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.717 -0.754 . . . . 0.0 111.945 -179.12 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 61.5 mt -104.75 -178.96 3.81 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 768' ' ' ARG . . . . . 0.515 ' HD3' ' O ' ' A' ' 786' ' ' ALA . 50.6 ttt180 -100.6 142.85 31.5 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 177.276 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.7 p80 -149.17 141.64 24.29 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.861 0.362 . . . . 0.0 110.785 -178.146 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -160.14 152.42 20.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.696 179.235 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 6.4 m -95.92 136.92 35.72 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.25 0.547 . . . . 0.0 110.904 -177.803 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 772' ' ' SER . . . . . 0.531 ' O ' ' HA ' ' A' ' 778' ' ' ARG . 46.8 t -114.99 144.21 43.96 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.419 -179.46 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 95.56 168.86 35.55 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.651 -0.785 . . . . 0.0 111.988 -177.803 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 774' ' ' GLU . . . . . 0.441 ' O ' ' HD2' ' A' ' 778' ' ' ARG . 26.1 mt-10 -87.73 -77.48 0.34 Allowed 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 -177.309 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . -125.32 -76.37 0.27 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.58 -176.522 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 53.2 mttp -70.89 -31.18 67.76 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.992 0.425 . . . . 0.0 110.023 178.106 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -83.06 -3.05 56.87 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.638 176.013 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 778' ' ' ARG . . . . . 0.531 ' HA ' ' O ' ' A' ' 772' ' ' SER . 30.9 ttt85 -78.36 115.18 17.89 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.721 0.772 . . . . 0.0 111.75 -174.363 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 49.9 p90 -128.86 -176.68 3.93 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 114.569 -1.196 . . . . 0.0 108.498 176.375 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 780' ' ' ILE . . . . . 0.468 HD13 ' CG1' ' A' ' 758' ' ' VAL . 17.1 tt -118.04 140.12 42.58 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 C-N-CA 120.405 -0.518 . . . . 0.0 110.905 -179.02 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 25.1 m -121.64 117.98 28.05 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.883 -0.598 . . . . 0.0 109.944 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 22.1 t -100.95 133.95 42.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 179.124 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 20.0 p -124.09 143.09 50.66 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.391 0.615 . . . . 0.0 110.964 178.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 56.2 mtpt -69.13 -50.52 47.18 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.421 -177.056 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 24.2 mmm180 -118.86 -59.22 1.88 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.379 -176.731 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 786' ' ' ALA . . . . . 0.515 ' O ' ' HD3' ' A' ' 768' ' ' ARG . . . . . . . . 0 C--O 1.245 0.862 0 CA-C-O 118.345 -0.836 . . . . 0.0 110.218 -179.176 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 801' ' ' DGP . . . . . 0.543 " H4'" ' HB2' ' A' ' 756' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo . . . . . 0 N--CA 1.475 0.436 0 N-CA-C 110.4 -0.654 . . . . 0.0 110.4 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -105.2 -77.79 0.58 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.272 0.558 . . . . 0.0 110.076 -179.789 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . -178.61 152.16 11.14 Favored Glycine 0 N--CA 1.446 -0.677 0 N-CA-C 110.598 -1.001 . . . . 0.0 110.598 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 35.5 m -107.82 -15.08 9.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 117.217 0.508 . . . . 0.0 110.802 -177.403 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 721' ' ' GLU . . . . . 0.464 ' H ' ' CD ' ' A' ' 721' ' ' GLU . 2.1 mp0 -71.74 -10.04 59.18 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.259 179.705 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 13.5 m -67.45 -17.57 64.75 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.823 178.043 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -139.97 -174.25 3.87 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.07 177.49 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -90.26 -4.57 57.09 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.227 0.537 . . . . 0.0 109.573 173.893 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . 91.82 -26.84 11.18 Favored Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 110.37 -1.092 . . . . 0.0 110.37 -170.51 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 27.9 t -106.91 91.49 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.654 0 CA-C-O 121.357 0.599 . . . . 0.0 110.098 176.332 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 727' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -84.94 152.27 23.63 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 170.302 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 728' ' ' HIS . . . . . 0.519 ' O ' ' HG3' ' A' ' 732' ' ' MET . 14.0 t60 -53.81 -50.91 65.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.094 0.473 . . . . 0.0 110.155 -176.622 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -77.88 -29.9 50.53 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.857 -176.072 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 44.6 ttm-85 -66.06 -37.88 86.93 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 176.416 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -65.84 -41.34 91.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.397 176.583 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 732' ' ' MET . . . . . 0.519 ' HG3' ' O ' ' A' ' 728' ' ' HIS . 93.5 mtp -63.81 -42.47 97.68 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.428 178.356 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 59.5 mt -71.51 -42.25 72.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.172 -0.467 . . . . 0.0 112.023 -178.741 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 11.4 p -65.3 -41.31 91.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 C-N-CA 120.784 -0.366 . . . . 0.0 111.162 -176.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -70.85 -33.09 70.29 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.963 0.411 . . . . 0.0 110.291 176.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 736' ' ' PHE . . . . . 0.497 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 11.7 t80 -59.97 -36.99 78.32 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.013 176.394 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 737' ' ' MET . . . . . 0.63 ' HA ' ' HD3' ' A' ' 784' ' ' LYS . 69.9 mtm -64.16 -32.28 73.8 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.62 177.689 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -92.4 9.12 35.55 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.791 0.329 . . . . 0.0 111.1 178.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 55.7 m -101.02 167.37 10.29 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.762 0.315 . . . . 0.0 110.87 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 740' ' ' LYS . . . . . 0.427 ' NZ ' ' HB2' ' A' ' 740' ' ' LYS . 0.1 OUTLIER -73.9 -30.02 62.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.179 -179.241 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -58.38 127.9 34.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.768 178.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 69.9 mtm -95.93 -10.62 28.26 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.84 0.353 . . . . 0.0 110.626 178.219 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 743' ' ' GLN . . . . . 0.41 ' HA ' ' O ' ' A' ' 782' ' ' VAL . 9.2 pt20 -139.67 126.85 21.17 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.063 174.285 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 744' ' ' LEU . . . . . 0.497 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 48.0 tp -102.1 105.69 16.45 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -87.25 105.68 17.39 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.744 178.276 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 746' ' ' PHE . . . . . 0.439 ' HA ' ' HD3' ' A' ' 747' ' ' PRO . 70.6 m-85 -76.04 146.07 78.27 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.821 -178.493 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 747' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 746' ' ' PHE . 33.1 Cg_exo -62.38 152.36 77.33 Favored 'Trans proline' 0 C--O 1.234 0.285 0 C-N-CA 122.971 2.448 . . . . 0.0 112.51 177.869 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -65.84 -3.93 9.08 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 123.143 2.562 . . . . 0.0 112.62 177.752 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 13.8 m -66.56 -25.16 66.51 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.721 176.379 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.1 mp -71.35 112.27 7.35 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.221 176.336 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 751' ' ' ASN . . . . . 0.434 ' O ' ' HG3' ' A' ' 755' ' ' ARG . 1.6 p-10 -86.31 -177.59 6.26 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 178.237 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 10.8 m -52.18 -45.46 65.13 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 112.592 0.589 . . . . 0.0 112.592 -170.888 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 33.2 m170 -66.7 -40.35 88.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.653 0.263 . . . . 0.0 111.62 -179.75 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -67.23 -41.56 85.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.926 0.393 . . . . 0.0 110.55 178.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 755' ' ' ARG . . . . . 0.434 ' HG3' ' O ' ' A' ' 751' ' ' ASN . 43.7 mtm-85 -64.35 -39.28 93.58 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.945 177.789 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 62.9 tp -54.34 -45.23 72.65 Favored 'General case' 0 C--N 1.332 -0.191 0 O-C-N 123.474 0.484 . . . . 0.0 110.855 176.29 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 7.7 mmt85 -55.41 -50.06 70.76 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.484 175.38 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 84.8 t -58.58 -48.32 85.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.02 179.264 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -56.28 -52.32 64.95 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.707 179.093 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -60.36 -41.7 94.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.753 -177.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 95.0 mt -68.82 -46.79 78.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.192 -179.237 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -63.54 -35.63 81.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.319 0.581 . . . . 0.0 110.021 178.195 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 763' ' ' GLU . . . . . 0.446 ' CD ' HN21 ' A' ' 801' ' ' DGP . 39.7 tt0 -63.5 -39.86 95.56 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.361 176.524 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -68.3 -44.75 74.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.839 178.347 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 27.1 m-70 -73.98 -21.44 60.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.61 -176.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 90.3 39.41 6.03 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.251 177.48 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 64.6 mt -111.12 169.62 8.65 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 178.694 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 37.3 ttm180 -90.05 132.08 35.58 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 177.571 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.8 p80 -138.82 136.63 35.83 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 120.726 0.298 . . . . 0.0 110.482 -177.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -162.4 147.67 12.53 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.523 177.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 771' ' ' SER . . . . . 0.466 ' HA ' ' HA ' ' A' ' 780' ' ' ILE . 9.7 m -109.74 138.97 45.34 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.263 178.154 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 6.2 t -122.16 154.23 37.71 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 -178.267 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 87.22 -174.08 45.07 Favored Glycine 0 N--CA 1.445 -0.738 0 C-N-CA 120.589 -0.815 . . . . 0.0 112.001 -177.038 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -146.45 170.27 17.2 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.842 0.354 . . . . 0.0 110.852 178.072 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . 62.8 -133.51 43.91 Favored Glycine 0 N--CA 1.448 -0.554 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.684 178.218 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -84.72 -1.97 56.95 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.705 0.288 . . . . 0.0 110.754 -176.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 -113.17 12.14 18.97 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.109 -179.446 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 778' ' ' ARG . . . . . . . . . . . . . 35.7 ttt180 -81.68 112.97 19.34 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 121.169 0.509 . . . . 0.0 109.96 173.485 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 50.8 p90 -118.76 160.4 21.95 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.858 -176.522 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 780' ' ' ILE . . . . . 0.466 ' HA ' ' HA ' ' A' ' 771' ' ' SER . 11.9 tt -114.77 133.65 60.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-O 121.184 0.516 . . . . 0.0 111.039 -176.595 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 34.5 m -115.6 124.03 49.92 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.328 178.571 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 782' ' ' VAL . . . . . 0.41 ' O ' ' HA ' ' A' ' 743' ' ' GLN . 59.1 t -103.61 119.7 52.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.692 176.67 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 13.9 m -113.41 133.64 55.07 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 121.049 0.452 . . . . 0.0 111.011 -176.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 784' ' ' LYS . . . . . 0.63 ' HD3' ' HA ' ' A' ' 737' ' ' MET . 56.8 mtmt -81.75 -7.92 59.64 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.83 0.824 . . . . 0.0 110.354 177.173 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 785' ' ' ARG . . . . . 0.641 ' HA ' ' NE ' ' A' ' 785' ' ' ARG . 3.2 mmp_? -92.29 84.75 5.24 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 114.872 -1.058 . . . . 0.0 109.436 172.231 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.954 0 CA-C-O 118.387 -0.816 . . . . 0.0 110.522 -177.509 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 801' ' ' DGP . . . . . 0.446 HN21 ' CD ' ' A' ' 763' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo . . . . . 0 N--CA 1.478 0.586 0 N-CA-C 110.918 -0.455 . . . . 0.0 110.918 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -129.03 178.95 6.03 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.876 178.767 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . 84.15 30.04 29.4 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.726 -0.749 . . . . 0.0 111.456 -177.674 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 45.0 t -83.58 -37.74 13.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.164 0.507 . . . . 0.0 110.303 -178.366 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -78.69 141.69 37.73 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.358 -179.552 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 14.6 m -96.89 -33.08 11.75 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.5 -178.277 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -101.63 112.15 24.63 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 178.19 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -67.57 -2.48 6.72 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -171.418 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . 89.51 79.79 1.33 Allowed Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 120.556 -0.831 . . . . 0.0 112.188 176.121 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 5.8 p -130.63 121.39 50.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.378 0.609 . . . . 0.0 110.955 -178.059 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 727' ' ' ASP . . . . . 0.437 ' HB2' ' HB2' ' A' ' 730' ' ' ARG . 4.1 m-20 -81.34 151.62 27.91 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.044 172.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 46.0 t60 -54.24 -48.11 71.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.294 0.569 . . . . 0.0 109.532 176.867 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -72.06 -26.09 62.04 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.261 -177.807 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 730' ' ' ARG . . . . . 0.437 ' HB2' ' HB2' ' A' ' 727' ' ' ASP . 12.0 tpt180 -65.77 -42.66 90.58 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 176.628 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -68.17 -46.05 71.77 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.629 177.82 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 35.5 mmm -56.96 -45.12 83.07 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.285 178.795 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 38.7 mt -67.28 -44.69 87.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.891 -177.775 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 12.4 p -66.75 -36.12 76.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 C-N-CA 120.298 -0.561 . . . . 0.0 111.015 -177.772 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 735' ' ' GLU . . . . . 0.404 ' O ' ' HB2' ' A' ' 739' ' ' SER . 45.4 mt-10 -71.88 -28.22 63.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.148 0.499 . . . . 0.0 110.402 176.8 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 736' ' ' PHE . . . . . 0.431 ' CE2' ' HG3' ' A' ' 784' ' ' LYS . 23.4 t80 -71.18 -40.55 71.19 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.287 174.398 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 87.2 mtp -62.37 -41.68 98.81 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.099 179.222 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -80.88 -6.05 58.15 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.278 -179.388 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 739' ' ' SER . . . . . 0.404 ' HB2' ' O ' ' A' ' 735' ' ' GLU . 14.7 t -92.91 167.33 11.9 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.593 -177.777 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -75.47 -9.68 58.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.817 178.218 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 741' ' ' LYS . . . . . 0.462 ' O ' ' HD3' ' A' ' 784' ' ' LYS . 61.9 mttp -61.35 133.6 56.01 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.538 -178.961 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 62.7 mtt -99.94 -17.36 17.6 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.076 177.656 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -144.71 140.53 28.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.155 175.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 744' ' ' LEU . . . . . 0.486 HD13 ' CZ ' ' A' ' 746' ' ' PHE . 0.8 OUTLIER -113.65 108.43 17.12 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 -179.935 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -85.63 96.35 9.64 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.439 176.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 746' ' ' PHE . . . . . 0.486 ' CZ ' HD13 ' A' ' 744' ' ' LEU . 61.1 m-85 -71.12 146.84 93.08 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.28 177.796 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -65.92 150.89 85.35 Favored 'Trans proline' 0 CA--C 1.529 0.247 0 C-N-CA 122.637 2.224 . . . . 0.0 112.509 -179.293 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -63.74 -6.22 10.33 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.845 2.363 . . . . 0.0 112.362 175.457 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 34.4 t -61.4 -25.18 67.02 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.077 174.155 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.1 mp -65.2 109.44 2.21 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.816 176.713 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -80.06 -177.37 6.0 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 173.684 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 20.0 m -57.68 -43.71 85.25 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -171.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 35.0 m80 -63.92 -39.82 95.04 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 120.954 0.406 . . . . 0.0 110.774 179.39 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -63.03 -49.03 76.2 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.706 178.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 755' ' ' ARG . . . . . 0.55 ' CB ' " H5'" ' A' ' 801' ' ' DGP . 63.8 mtt85 -57.6 -49.29 76.89 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.549 177.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 756' ' ' LEU . . . . . 0.479 ' HB2' " H4'" ' A' ' 801' ' ' DGP . 60.5 tp -54.72 -39.73 68.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.303 -179.009 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 23.8 tpt180 -65.04 -39.19 92.99 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.055 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 96.3 t -64.4 -50.98 73.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.752 176.773 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -53.8 -48.81 69.48 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 123.453 0.47 . . . . 0.0 110.243 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 760' ' ' GLN . . . . . 0.401 ' NE2' ' HG ' ' A' ' 756' ' ' LEU . 69.9 mt-30 -50.96 -51.27 54.19 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.888 176.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 88.5 mt -69.98 -42.33 79.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.439 -174.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -66.21 -38.16 87.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.075 0.464 . . . . 0.0 110.453 179.571 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 763' ' ' GLU . . . . . 0.523 ' CD ' HN21 ' A' ' 801' ' ' DGP . 29.7 tt0 -67.05 -36.64 82.5 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.127 177.706 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -65.76 -49.28 68.93 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.533 176.64 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 13.8 m170 -69.8 -29.42 66.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.636 -175.608 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 100.67 36.14 4.11 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.457 -0.877 . . . . 0.0 112.451 177.74 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 63.9 mt -111.85 170.64 8.01 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.294 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 32.5 ttp180 -89.89 136.52 32.99 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 178.389 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 5.5 p80 -137.45 121.95 18.39 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-O 121.464 0.65 . . . . 0.0 110.499 -179.377 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -144.1 153.76 42.49 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.239 -0.892 . . . . 0.0 109.971 -178.201 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 10.7 m -109.97 139.71 44.77 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.041 0.448 . . . . 0.0 110.57 -179.1 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 35.6 m -139.27 149.3 44.13 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.022 -177.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 134.41 177.46 14.96 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.596 -0.812 . . . . 0.0 111.923 178.452 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -105.64 107.55 18.6 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 -175.786 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . 59.42 -105.03 0.63 Allowed Glycine 0 N--CA 1.453 -0.168 0 CA-C-N 115.905 -0.589 . . . . 0.0 113.489 174.149 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -78.5 -23.72 46.23 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.015 0.436 . . . . 0.0 110.785 -178.267 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 61.1 mtp180 -85.71 13.44 7.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.023 0.439 . . . . 0.0 110.218 178.022 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 778' ' ' ARG . . . . . . . . . . . . . 50.4 ttt180 -72.61 116.96 13.7 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.964 175.804 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 44.1 p90 -118.92 165.27 14.28 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.781 -177.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 12.8 tt -104.09 133.82 47.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-O 121.163 0.506 . . . . 0.0 110.562 -178.571 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 781' ' ' THR . . . . . 0.456 ' HA ' ' O ' ' A' ' 744' ' ' LEU . 17.7 m -118.1 112.55 20.36 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.263 179.687 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 45.3 t -90.91 130.51 39.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 177.076 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 12.8 t -125.3 141.54 52.02 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.444 0.64 . . . . 0.0 111.492 -175.507 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 784' ' ' LYS . . . . . 0.462 ' HD3' ' O ' ' A' ' 741' ' ' LYS . 55.4 mtpt -92.68 -15.01 27.26 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-O 122.392 1.092 . . . . 0.0 108.7 175.517 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -99.89 111.27 23.59 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 113.473 -1.694 . . . . 0.0 111.016 -173.051 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.492 -0.766 . . . . 0.0 109.337 172.993 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 801' ' ' DGP . . . . . 0.55 " H5'" ' CB ' ' A' ' 755' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo . . . . . 0 N--CA 1.476 0.474 0 N-CA-C 110.796 -0.501 . . . . 0.0 110.796 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 718' ' ' GLU . . . . . 0.429 ' CD ' ' H ' ' A' ' 718' ' ' GLU . 1.7 mp0 -71.82 -43.05 66.24 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 177.583 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . 81.73 30.77 34.76 Favored Glycine 0 N--CA 1.446 -0.657 0 CA-C-N 115.533 -0.758 . . . . 0.0 112.656 179.23 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 23.2 t -107.06 78.76 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.11 0.481 . . . . 0.0 110.032 179.633 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -97.54 -30.22 13.0 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.742 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 17.4 m -79.91 96.05 6.26 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 177.037 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 16.7 tm0? -75.0 -50.5 16.33 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.495 -174.471 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -110.78 88.44 2.78 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.297 0.57 . . . . 0.0 110.224 -178.366 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . -140.66 49.51 0.78 Allowed Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 111.023 -0.831 . . . . 0.0 111.023 178.182 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 44.1 t -113.15 108.19 24.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.901 0.381 . . . . 0.0 110.072 -175.787 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 727' ' ' ASP . . . . . 0.431 ' HB3' ' HB3' ' A' ' 730' ' ' ARG . 14.4 t70 -129.1 139.11 52.12 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.04 178.69 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 27.4 t60 -65.82 -58.49 5.5 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.641 -177.029 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -70.04 -32.03 69.96 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.209 -173.389 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 730' ' ' ARG . . . . . 0.431 ' HB3' ' HB3' ' A' ' 727' ' ' ASP . 12.3 tpt180 -58.62 -49.7 76.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.141 0.496 . . . . 0.0 109.828 174.625 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -61.62 -48.58 80.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.805 178.731 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 46.8 mmm -56.38 -39.79 73.53 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.599 -179.405 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 43.0 mt -70.72 -49.15 53.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.542 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 12.9 p -65.52 -36.36 77.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 C-N-CA 120.732 -0.387 . . . . 0.0 111.08 -176.176 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -71.65 -32.29 67.75 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 121.089 0.471 . . . . 0.0 110.423 177.211 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 736' ' ' PHE . . . . . 0.574 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 24.4 t80 -65.59 -36.54 84.06 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.518 175.596 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 737' ' ' MET . . . . . 0.513 ' HA ' ' HD3' ' A' ' 784' ' ' LYS . 84.9 mtp -65.83 -27.1 68.0 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.331 176.633 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -91.71 -0.62 57.57 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.743 178.471 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 24.3 t -97.0 168.15 10.64 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.584 -178.072 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 740' ' ' LYS . . . . . 0.574 ' HA ' ' HE2' ' A' ' 740' ' ' LYS . 11.0 mmpt? -84.6 -11.59 55.71 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.186 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 741' ' ' LYS . . . . . 0.474 ' O ' ' HE2' ' A' ' 784' ' ' LYS . 59.9 mttp -67.31 129.57 40.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.112 177.969 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 70.2 mtm -91.09 -17.83 25.55 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.648 177.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -136.13 130.06 32.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.605 179.121 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 744' ' ' LEU . . . . . 0.574 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 45.8 tp -112.95 109.0 18.14 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.786 177.581 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -94.36 110.14 21.93 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.158 -178.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 746' ' ' PHE . . . . . 0.52 ' O ' ' HB2' ' A' ' 779' ' ' PHE . 72.2 m-85 -80.53 156.56 73.23 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.158 -178.444 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 747' ' ' PRO . . . . . 0.435 ' O ' HD13 ' A' ' 750' ' ' LEU . 40.2 Cg_exo -58.9 156.33 33.9 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.966 2.444 . . . . 0.0 112.565 177.353 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -74.19 -11.76 23.15 Favored 'Trans proline' 0 CA--C 1.53 0.295 0 C-N-CA 122.764 2.309 . . . . 0.0 112.77 178.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 17.6 m -71.59 -12.61 61.44 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.989 -0.55 . . . . 0.0 112.354 -176.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 750' ' ' LEU . . . . . 0.435 HD13 ' O ' ' A' ' 747' ' ' PRO . 11.2 mp -61.22 121.53 12.79 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 110.416 -0.216 . . . . 0.0 110.416 176.527 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 751' ' ' ASN . . . . . 0.571 ' O ' ' HG2' ' A' ' 755' ' ' ARG . 2.0 p30 -80.38 176.92 9.35 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 179.495 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 14.4 t -53.6 -37.26 62.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.913 0.387 . . . . 0.0 111.352 -177.04 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 73.8 m80 -76.07 -27.87 57.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.976 -179.227 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -72.25 -40.37 67.73 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 175.719 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 755' ' ' ARG . . . . . 0.571 ' HG2' ' O ' ' A' ' 751' ' ' ASN . 33.1 mmt180 -56.69 -58.58 7.45 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.51 175.181 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 62.0 tp -54.16 -38.63 65.74 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 114.871 -1.059 . . . . 0.0 111.045 -178.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 26.5 tpt180 -57.45 -48.53 78.9 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 120.996 0.427 . . . . 0.0 110.187 178.034 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 79.8 t -65.79 -46.54 88.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.838 179.009 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -56.05 -50.89 69.71 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.903 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -55.52 -47.98 75.39 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.407 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 96.6 mt -67.58 -49.1 73.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.523 -176.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -63.34 -30.77 71.84 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.224 0.535 . . . . 0.0 110.67 -178.61 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 763' ' ' GLU . . . . . 0.441 ' CD ' HN21 ' A' ' 801' ' ' DGP . 39.9 tt0 -70.71 -37.75 73.59 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.768 177.273 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -68.57 -36.99 79.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.361 0.6 . . . . 0.0 110.243 178.291 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 12.0 m170 -74.89 -23.12 58.33 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.438 177.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 84.68 44.4 6.46 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.936 -0.65 . . . . 0.0 112.272 178.482 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 82.0 mt -111.86 177.63 4.58 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 178.093 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 75.4 ttt180 -96.72 133.47 41.22 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.079 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 5.7 p80 -145.92 133.39 20.8 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.079 0.466 . . . . 0.0 111.555 -176.009 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -170.56 164.59 8.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.215 -0.902 . . . . 0.0 108.976 176.184 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 771' ' ' SER . . . . . 0.471 ' HA ' ' HA ' ' A' ' 780' ' ' ILE . 14.3 m -110.17 146.76 34.97 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.357 0.599 . . . . 0.0 112.035 -173.83 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 20.1 m -109.76 155.81 21.11 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.14 175.395 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 90.01 -179.44 44.02 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.345 -0.931 . . . . 0.0 111.723 -178.237 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -134.21 144.95 48.76 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.787 0.293 . . . . 0.0 111.183 -176.558 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . 65.44 -117.29 9.85 Favored Glycine 0 N--CA 1.452 -0.256 0 CA-C-N 115.802 -0.635 . . . . 0.0 113.124 174.543 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 23.0 ttpp -98.81 -7.34 27.6 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.957 0.408 . . . . 0.0 110.125 -177.639 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 85.1 mtt180 -92.28 4.33 53.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.603 0.716 . . . . 0.0 109.463 172.004 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 778' ' ' ARG . . . . . 0.403 ' HD2' HH11 ' A' ' 778' ' ' ARG . 22.5 ttt180 -77.75 135.59 38.03 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.726 -1.125 . . . . 0.0 109.686 177.334 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 779' ' ' PHE . . . . . 0.52 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 37.7 p90 -136.39 137.54 40.63 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.685 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 780' ' ' ILE . . . . . 0.471 ' HA ' ' HA ' ' A' ' 771' ' ' SER . 10.8 tt -83.93 135.33 25.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 121.201 0.525 . . . . 0.0 110.826 -176.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 35.2 m -120.38 119.82 34.2 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.479 -179.27 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 43.1 t -95.97 125.12 48.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.322 176.311 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 34.3 t -119.29 130.27 55.32 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.322 0.582 . . . . 0.0 110.789 -176.416 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 784' ' ' LYS . . . . . 0.513 ' HD3' ' HA ' ' A' ' 737' ' ' MET . 48.0 mtmt -77.79 -19.33 55.23 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 172.568 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 14.0 mmt180 -84.14 102.88 12.9 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.231 174.596 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.36 -0.829 . . . . 0.0 109.533 177.498 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 801' ' ' DGP . . . . . 0.441 HN21 ' CD ' ' A' ' 763' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo . . . . . 0 N--CA 1.474 0.372 0 N-CA-C 110.405 -0.652 . . . . 0.0 110.405 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 60.65 99.16 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 O-C-N 123.691 0.619 . . . . 0.0 111.402 -178.623 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . 100.16 51.16 1.27 Allowed Glycine 0 N--CA 1.445 -0.746 0 C-N-CA 120.595 -0.812 . . . . 0.0 111.558 -177.598 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 39.5 t -77.37 92.16 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 177.614 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -123.86 87.17 2.69 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.46 -173.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 25.4 p -87.49 -39.75 14.91 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 169.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 37.1 tt0 55.01 41.32 31.97 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 114.685 -1.143 . . . . 0.0 109.872 175.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -97.13 -156.92 0.56 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.834 -1.076 . . . . 0.0 110.38 -178.29 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . 98.95 75.31 1.19 Allowed Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 120.628 -0.796 . . . . 0.0 111.487 -177.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 8.7 p -156.09 131.67 1.73 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-O 120.962 0.411 . . . . 0.0 110.627 -176.214 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 727' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -68.55 151.61 46.52 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 174.517 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 29.9 t60 -52.82 -44.2 66.5 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.485 0.66 . . . . 0.0 109.391 174.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 44.7 m-85 -75.15 -26.76 59.38 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.692 -176.874 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 23.6 ttt180 -71.22 -36.59 71.91 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 178.32 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -66.39 -42.66 87.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.177 175.763 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 12.3 mmm -62.0 -40.91 97.28 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.131 176.791 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 733' ' ' ILE . . . . . 0.449 ' O ' ' HG3' ' A' ' 737' ' ' MET . 49.3 mt -69.22 -44.11 80.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.684 -179.149 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 11.4 p -63.99 -37.01 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 C-N-CA 120.564 -0.454 . . . . 0.0 110.994 -177.136 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -74.62 -27.26 60.38 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.05 0.452 . . . . 0.0 110.472 176.571 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 736' ' ' PHE . . . . . 0.553 ' CE1' ' HB2' ' A' ' 744' ' ' LEU . 26.9 t80 -69.36 -35.89 76.31 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.531 175.135 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 737' ' ' MET . . . . . 0.449 ' HG3' ' O ' ' A' ' 733' ' ' ILE . 86.2 mtp -64.27 -39.72 94.5 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.58 178.018 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -78.97 -23.49 44.48 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.54 178.498 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 33.1 t -73.54 164.13 27.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.465 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 45.2 mtmt -78.54 -22.38 47.33 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.621 -177.023 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 56.1 mtmt -55.43 128.32 33.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.658 -175.138 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 27.0 ptm -86.66 -18.96 29.98 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.898 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 19.8 mm-40 -135.71 139.01 43.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.313 178.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 744' ' ' LEU . . . . . 0.553 ' HB2' ' CE1' ' A' ' 736' ' ' PHE . 37.3 tp -118.44 108.67 15.31 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 176.479 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -92.27 112.15 23.98 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.049 -178.144 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -88.34 145.15 35.14 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.568 178.044 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 747' ' ' PRO . . . . . 0.447 ' HA ' ' HD3' ' A' ' 748' ' ' PRO . 23.0 Cg_exo -65.0 152.53 82.08 Favored 'Trans proline' 0 N--CA 1.463 -0.313 0 C-N-CA 122.638 2.225 . . . . 0.0 112.037 177.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 748' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 747' ' ' PRO . 13.3 Cg_exo -68.68 -7.32 20.15 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 123.126 2.55 . . . . 0.0 111.462 177.493 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 5.6 m -59.61 -21.4 60.35 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.685 173.013 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.8 mp -73.34 115.4 12.65 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.865 173.062 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 10.9 p30 -82.7 -178.56 7.13 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 178.129 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 65.1 m -58.81 -29.0 66.53 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -175.33 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 54.2 t-80 -71.52 -45.04 63.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.894 0.378 . . . . 0.0 110.087 177.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 754' ' ' ASP . . . . . 0.411 ' O ' HG23 ' A' ' 758' ' ' VAL . 70.9 m-20 -61.49 -51.09 70.09 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.036 178.346 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 755' ' ' ARG . . . . . 0.614 ' HB2' H5'' ' A' ' 801' ' ' DGP . 22.3 mtm180 -57.96 -43.58 86.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.806 179.643 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 756' ' ' LEU . . . . . 0.465 ' CD1' " H1'" ' A' ' 801' ' ' DGP . 51.5 tp -55.45 -41.96 73.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.466 179.845 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 19.0 mmm180 -63.77 -47.43 81.0 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.998 -0.281 . . . . 0.0 110.465 176.088 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 758' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 754' ' ' ASP . 61.9 t -56.48 -46.31 82.21 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.97 179.64 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 87.3 m-70 -56.7 -53.68 54.91 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.648 178.024 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -59.44 -40.42 86.76 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.69 -178.045 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 95.6 mt -65.29 -53.78 36.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.106 -179.639 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -62.0 -36.82 82.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.176 0.512 . . . . 0.0 110.597 -179.653 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -64.84 -31.58 72.88 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.915 177.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -81.86 -36.75 27.9 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.66 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 11.3 m170 -74.57 -23.01 58.7 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.215 179.436 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 95.85 31.09 7.55 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.577 -0.82 . . . . 0.0 112.52 177.264 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 66.3 mt -108.65 -176.56 3.08 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 110.267 -0.272 . . . . 0.0 110.267 -178.688 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 768' ' ' ARG . . . . . 0.433 ' HB3' ' HB3' ' A' ' 783' ' ' SER . 17.4 ttm180 -100.95 135.62 42.11 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.439 177.797 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 7.2 p80 -144.65 135.3 24.66 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.936 -178.684 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -164.54 150.09 10.24 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.48 177.444 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 771' ' ' SER . . . . . 0.427 ' HA ' ' HA ' ' A' ' 780' ' ' ILE . 3.8 m -113.95 132.88 55.8 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-O 120.932 0.396 . . . . 0.0 110.297 179.112 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 772' ' ' SER . . . . . 0.505 ' O ' ' HA ' ' A' ' 778' ' ' ARG . 24.8 m -113.38 145.77 40.58 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.105 -178.653 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 99.91 -169.26 21.89 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.887 -0.673 . . . . 0.0 111.684 -178.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -143.19 139.77 30.45 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.819 0.343 . . . . 0.0 111.332 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . 65.9 -123.36 24.04 Favored Glycine 0 N--CA 1.448 -0.503 0 CA-C-N 115.656 -0.702 . . . . 0.0 112.592 177.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 16.8 tppt? -85.58 -2.7 58.43 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.466 0.65 . . . . 0.0 110.054 -179.704 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -96.95 0.74 49.4 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.828 172.317 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 778' ' ' ARG . . . . . 0.505 ' HA ' ' O ' ' A' ' 772' ' ' SER . 31.6 ttt180 -97.47 117.82 32.57 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.6 -178.549 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 38.8 p90 -127.34 158.52 37.03 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.148 -179.497 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 780' ' ' ILE . . . . . 0.427 ' HA ' ' HA ' ' A' ' 771' ' ' SER . 13.3 tt -107.17 134.03 50.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-O 121.057 0.456 . . . . 0.0 111.147 -175.884 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 5.7 m -118.36 124.25 47.28 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.023 178.257 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 43.3 t -107.28 127.0 63.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.767 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 783' ' ' SER . . . . . 0.433 ' HB3' ' HB3' ' A' ' 768' ' ' ARG . 22.8 t -112.47 147.16 37.1 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 120.821 0.344 . . . . 0.0 110.493 -178.716 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 784' ' ' LYS . . . . . 0.409 ' HD3' ' HA ' ' A' ' 737' ' ' MET . 17.7 mtmm -76.88 -12.49 59.97 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.421 0.629 . . . . 0.0 110.073 173.537 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 16.8 mmm180 -94.9 113.94 25.73 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.483 -0.781 . . . . 0.0 111.071 179.609 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.244 0.801 0 CA-C-O 118.635 -0.698 . . . . 0.0 109.565 175.329 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 801' ' ' DGP . . . . . 0.614 H5'' ' HB2' ' A' ' 755' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo . . . . . 0 N--CA 1.478 0.581 0 N-CA-C 109.994 -0.81 . . . . 0.0 109.994 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -101.78 103.45 14.18 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 177.139 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . 166.5 108.67 0.21 Allowed Glycine 0 N--CA 1.443 -0.839 0 C-N-CA 120.693 -0.765 . . . . 0.0 111.67 -176.588 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 25.7 t 57.31 68.45 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.446 0 CA-C-O 121.676 0.751 . . . . 0.0 110.245 -178.228 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -67.54 -34.64 77.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.565 176.016 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 14.2 m -116.06 103.32 10.45 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.505 -0.771 . . . . 0.0 109.595 174.136 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -64.34 -40.15 95.31 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.209 0.528 . . . . 0.0 109.825 177.769 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -102.21 94.46 5.75 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.109 175.139 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . -123.43 26.55 6.0 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.039 -177.602 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 2.9 p -91.07 96.22 6.15 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 CA-C-O 122.33 1.062 . . . . 0.0 110.048 -179.236 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 727' ' ' ASP . . . . . 0.462 ' HB3' ' HB3' ' A' ' 730' ' ' ARG . 9.9 t70 -102.77 140.62 36.81 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 114.334 -1.303 . . . . 0.0 109.545 -178.8 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 18.1 t60 -55.69 -47.47 76.73 Favored 'General case' 0 C--N 1.328 -0.337 0 O-C-N 123.365 0.416 . . . . 0.0 111.289 -177.27 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -75.07 -36.85 61.76 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.462 -176.753 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 730' ' ' ARG . . . . . 0.462 ' HB3' ' HB3' ' A' ' 727' ' ' ASP . 27.7 ttm-85 -61.8 -42.36 98.91 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.765 0.316 . . . . 0.0 110.383 175.811 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -60.44 -45.73 92.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.815 179.683 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 31.8 mtm -68.52 -33.32 73.92 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.236 -179.286 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 733' ' ' ILE . . . . . 0.542 ' O ' ' HG3' ' A' ' 737' ' ' MET . 58.3 mt -70.34 -49.31 54.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 N-CA-C 111.339 0.126 . . . . 0.0 111.339 178.499 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 13.0 p -62.86 -34.65 67.22 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 120.801 -0.36 . . . . 0.0 110.829 -177.68 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -70.6 -41.61 72.06 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.021 0.439 . . . . 0.0 110.142 175.474 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 736' ' ' PHE . . . . . 0.517 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 44.1 t80 -57.59 -35.47 70.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.33 177.777 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 737' ' ' MET . . . . . 0.542 ' HG3' ' O ' ' A' ' 733' ' ' ILE . 87.6 mtp -61.34 -32.89 72.78 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.824 178.92 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -96.01 -7.18 37.04 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.278 -179.457 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 64.3 m -82.78 168.47 17.14 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.082 -177.635 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 740' ' ' LYS . . . . . 0.449 ' NZ ' ' HB2' ' A' ' 740' ' ' LYS . 4.4 ttmp? -81.29 -21.85 39.04 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.435 -178.69 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -62.83 127.9 33.41 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.668 179.294 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 25.6 ptt? -88.86 -17.22 30.11 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.617 178.153 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -139.05 119.65 14.03 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.139 -178.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 744' ' ' LEU . . . . . 0.517 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 49.1 tp -101.03 105.24 16.43 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.334 176.334 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -89.67 115.89 27.38 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.305 -179.204 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 746' ' ' PHE . . . . . 0.488 ' HB2' HG23 ' A' ' 780' ' ' ILE . 58.5 m-85 -88.27 145.6 36.22 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.934 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -58.28 153.79 44.6 Favored 'Trans proline' 0 CA--C 1.533 0.441 0 C-N-CA 123.178 2.585 . . . . 0.0 112.771 178.314 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -69.61 -9.37 26.0 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.922 2.415 . . . . 0.0 112.936 -179.759 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 2.3 p -69.24 -24.07 63.95 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.878 -178.287 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.8 mp -55.7 117.49 3.68 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.256 175.623 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -76.68 174.73 10.08 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.873 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 13.7 t -55.35 -32.53 62.63 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.649 0.24 . . . . 0.0 111.649 -175.418 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 40.2 m80 -79.43 -31.86 42.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.456 0.17 . . . . 0.0 110.962 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -66.32 -45.37 80.52 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 174.447 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 755' ' ' ARG . . . . . 0.522 ' HB2' " H5'" ' A' ' 801' ' ' DGP . 63.3 mtt-85 -62.6 -47.42 83.88 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.733 177.456 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 756' ' ' LEU . . . . . 0.513 ' HB2' " H4'" ' A' ' 801' ' ' DGP . 62.5 tp -55.04 -40.6 70.41 Favored 'General case' 0 N--CA 1.464 0.272 0 O-C-N 123.346 0.404 . . . . 0.0 110.877 179.103 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 27.9 tpt180 -56.87 -51.0 70.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.915 176.011 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 99.1 t -60.51 -49.67 83.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.258 178.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 759' ' ' HIS . . . . . 0.419 ' O ' ' HB2' ' A' ' 763' ' ' GLU . 89.8 m-70 -53.79 -51.2 64.22 Favored 'General case' 0 N--CA 1.463 0.192 0 O-C-N 123.302 0.376 . . . . 0.0 110.635 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -60.59 -44.19 96.52 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -178.751 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 98.1 mt -66.3 -49.31 76.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.756 0.313 . . . . 0.0 110.963 -177.841 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -64.32 -32.74 74.47 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.945 0.402 . . . . 0.0 110.59 -179.736 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 763' ' ' GLU . . . . . 0.419 ' HB2' ' O ' ' A' ' 759' ' ' HIS . 27.3 tt0 -66.01 -37.03 84.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.407 178.612 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 13.7 tp10 -75.0 -43.26 54.88 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.676 177.705 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 10.6 m-70 -69.22 -24.89 64.08 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.434 -176.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 99.45 29.91 6.82 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.496 -0.859 . . . . 0.0 113.14 174.419 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 767' ' ' LEU . . . . . 0.423 HD11 ' HG2' ' A' ' 737' ' ' MET . 54.3 mt -107.59 170.76 7.78 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 176.879 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 30.5 ttt180 -96.55 139.89 31.97 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 119.616 -0.834 . . . . 0.0 109.745 175.143 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.5 p80 -137.19 131.71 32.87 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.428 -0.806 . . . . 0.0 109.837 -176.789 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -159.62 144.91 15.56 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.306 -179.379 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 771' ' ' SER . . . . . 0.455 ' HA ' ' HA ' ' A' ' 780' ' ' ILE . 8.8 t -110.3 149.31 30.38 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.45 0.643 . . . . 0.0 110.084 178.55 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 772' ' ' SER . . . . . 0.459 ' O ' ' HA ' ' A' ' 778' ' ' ARG . 29.3 t -147.15 157.7 43.69 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.161 -173.578 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 773' ' ' GLY . . . . . 0.514 ' HA3' ' O ' ' A' ' 777' ' ' ARG . . . 90.53 175.41 44.6 Favored Glycine 0 N--CA 1.448 -0.523 0 O-C-N 123.623 0.577 . . . . 0.0 112.159 178.421 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -135.08 149.21 50.03 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 110.322 -0.251 . . . . 0.0 110.322 178.811 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . 63.8 -128.05 37.11 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 121.227 -0.511 . . . . 0.0 112.137 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -77.1 -5.25 48.23 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.989 0.423 . . . . 0.0 110.625 178.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 777' ' ' ARG . . . . . 0.514 ' O ' ' HA3' ' A' ' 773' ' ' GLY . 31.5 mmt180 -99.2 4.3 46.67 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.294 175.091 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 778' ' ' ARG . . . . . 0.459 ' HA ' ' O ' ' A' ' 772' ' ' SER . 65.6 ttt180 -93.42 111.2 22.8 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-O 121.315 0.579 . . . . 0.0 110.315 178.278 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 779' ' ' PHE . . . . . 0.465 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 14.3 p90 -140.88 156.08 46.18 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.453 -174.248 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 780' ' ' ILE . . . . . 0.488 HG23 ' HB2' ' A' ' 746' ' ' PHE . 6.2 tt -103.9 130.17 54.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-O 121.138 0.494 . . . . 0.0 110.107 179.079 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 27.1 m -111.13 120.36 42.04 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.449 -179.243 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 55.8 t -96.42 118.68 43.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 173.066 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 53.9 p -113.61 137.81 51.07 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.458 -177.027 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 59.0 mtpt -68.2 -85.35 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 172.68 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 53.92 27.56 7.45 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 123.431 0.457 . . . . 0.0 111.919 168.054 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.959 0 CA-C-O 118.49 -0.767 . . . . 0.0 110.121 -177.692 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 801' ' ' DGP . . . . . 0.522 " H5'" ' HB2' ' A' ' 755' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_exo . . . . . 0 N--CA 1.478 0.584 0 N-CA-C 110.362 -0.668 . . . . 0.0 110.362 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -145.65 97.68 3.01 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.993 0.425 . . . . 0.0 110.069 -177.769 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . -103.29 50.59 0.88 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.253 -178.453 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 35.3 m -86.74 3.31 4.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.988 0.423 . . . . 0.0 111.065 -179.063 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -148.91 134.46 18.65 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 -179.368 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 7.2 t -112.66 100.13 8.47 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 -179.183 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 723' ' ' GLN . . . . . 0.549 ' HA ' ' NH2' ' A' ' 730' ' ' ARG . 25.9 mp0 -60.47 -35.32 75.61 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.652 -0.704 . . . . 0.0 112.089 -172.575 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -85.21 90.53 7.91 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.215 0.531 . . . . 0.0 110.203 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . 175.8 99.93 0.13 Allowed Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.005 -179.715 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 17.2 t -88.07 79.63 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.6 0.714 . . . . 0.0 109.68 -179.285 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 727' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -109.12 142.86 39.28 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 114.941 -1.027 . . . . 0.0 110.29 -177.75 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 9.7 t60 -55.68 -56.28 22.25 Favored 'General case' 0 C--N 1.332 -0.185 0 O-C-N 123.652 0.595 . . . . 0.0 110.792 -179.205 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 40.6 m-85 -75.56 -31.3 59.98 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.371 -172.912 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 730' ' ' ARG . . . . . 0.549 ' NH2' ' HA ' ' A' ' 723' ' ' GLN . 40.0 ttt-85 -59.77 -45.7 91.45 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.18 174.236 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -61.12 -42.53 98.7 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.536 -179.773 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 32.8 mmm -62.54 -39.09 92.49 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.925 178.877 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 733' ' ' ILE . . . . . 0.506 ' O ' ' HB3' ' A' ' 736' ' ' PHE . 68.1 mt -77.76 -39.57 26.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -177.678 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 10.8 p -65.16 -37.69 80.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.817 -178.422 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -78.19 -29.35 48.43 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 120.811 -0.355 . . . . 0.0 110.37 176.731 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 736' ' ' PHE . . . . . 0.544 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 29.2 t80 -52.88 -44.79 67.11 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.873 175.281 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 71.1 mtm -67.13 -23.21 65.78 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.732 -179.688 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -97.09 -9.63 27.63 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.696 0.284 . . . . 0.0 111.529 -178.714 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 50.7 m -90.01 2.55 55.04 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.604 -177.135 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 740' ' ' LYS . . . . . 0.446 ' O ' ' HG2' ' A' ' 740' ' ' LYS . 61.5 tttp 65.4 9.76 6.0 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.257 0.551 . . . . 0.0 111.03 -179.923 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 62.4 mttm -68.27 129.78 40.95 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.625 179.118 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.08 -25.47 47.65 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.064 177.49 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -155.34 148.8 25.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.314 177.502 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 744' ' ' LEU . . . . . 0.544 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 59.0 tp -124.81 108.27 11.78 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.777 178.642 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -80.78 114.55 19.74 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.91 179.536 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 746' ' ' PHE . . . . . 0.464 ' HB2' HG23 ' A' ' 780' ' ' ILE . 68.1 m-85 -90.93 154.78 45.38 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.354 177.853 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 747' ' ' PRO . . . . . 0.415 ' O ' HD13 ' A' ' 750' ' ' LEU . 33.8 Cg_exo -59.17 155.36 40.31 Favored 'Trans proline' 0 CA--C 1.533 0.466 0 C-N-CA 122.666 2.244 . . . . 0.0 112.294 176.304 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -75.6 -14.46 19.87 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.653 2.236 . . . . 0.0 112.169 -179.366 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 7.8 p -71.75 -11.08 60.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.594 -175.473 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 750' ' ' LEU . . . . . 0.415 HD13 ' O ' ' A' ' 747' ' ' PRO . 11.1 mp -58.59 113.67 2.12 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 174.091 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 751' ' ' ASN . . . . . 0.578 ' O ' ' HG2' ' A' ' 755' ' ' ARG . 3.1 p30 -75.13 178.94 5.34 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 110.345 -0.243 . . . . 0.0 110.345 -175.325 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 30.2 m -51.76 -42.44 62.37 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 120.606 0.241 . . . . 0.0 111.522 -176.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 70.1 m80 -70.24 -36.98 74.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.106 -179.285 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 754' ' ' ASP . . . . . 0.43 ' O ' HG23 ' A' ' 758' ' ' VAL . 73.7 m-20 -64.38 -49.47 71.48 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 177.121 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 755' ' ' ARG . . . . . 0.578 ' HG2' ' O ' ' A' ' 751' ' ' ASN . 1.4 mmm-85 -54.36 -57.49 11.08 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.648 178.615 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 66.7 tp -52.29 -41.89 63.28 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 114.978 -1.01 . . . . 0.0 111.901 -178.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -63.09 -45.41 92.21 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 121.195 -0.202 . . . . 0.0 110.73 178.703 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 758' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 754' ' ' ASP . 93.4 t -60.69 -47.16 94.24 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.728 178.234 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -56.79 -51.48 68.79 Favored 'General case' 0 N--CA 1.462 0.139 0 O-C-N 123.339 0.399 . . . . 0.0 110.206 178.487 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -54.96 -47.62 74.28 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.671 179.419 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 97.3 mt -63.55 -55.4 23.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.119 -178.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -60.24 -35.13 74.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.968 0.413 . . . . 0.0 110.88 -177.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -66.69 -38.16 86.2 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.144 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -77.22 -36.46 54.68 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.586 0.232 . . . . 0.0 110.448 179.159 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 9.8 m-70 -65.31 -23.48 67.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.959 0.409 . . . . 0.0 110.709 176.24 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 89.25 35.75 7.91 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.108 177.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 62.9 mt -114.0 177.16 4.74 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.275 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 22.5 ttp180 -95.56 143.92 26.46 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 178.416 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 5.3 p80 -140.32 122.47 15.78 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.092 0.472 . . . . 0.0 110.276 -178.244 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -134.83 155.19 51.07 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.926 -174.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 10.0 m -120.79 129.57 53.64 Favored 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 172.123 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 16.0 t -153.61 176.68 11.79 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.106 -171.079 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 118.8 165.6 13.27 Favored Glycine 0 N--CA 1.441 -1.0 0 C-N-CA 120.877 -0.678 . . . . 0.0 111.577 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 774' ' ' GLU . . . . . 0.429 ' H ' ' HB2' ' A' ' 777' ' ' ARG . 39.8 mm-40 -70.54 178.8 2.8 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.653 0.263 . . . . 0.0 110.69 178.679 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . -57.75 -35.75 75.97 Favored Glycine 0 CA--C 1.519 0.312 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.349 179.597 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -102.3 12.09 37.16 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.84 0.352 . . . . 0.0 110.87 178.231 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 777' ' ' ARG . . . . . 0.429 ' HB2' ' H ' ' A' ' 774' ' ' GLU . 17.3 mmm180 -137.03 19.34 3.0 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.236 -175.931 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 778' ' ' ARG . . . . . . . . . . . . . 49.2 ttt180 -75.78 113.99 13.87 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.375 0.607 . . . . 0.0 111.589 -177.637 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 11.1 p90 -135.07 -166.92 1.9 Allowed 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.241 -0.89 . . . . 0.0 109.986 -179.635 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 780' ' ' ILE . . . . . 0.464 HG23 ' HB2' ' A' ' 746' ' ' PHE . 6.5 tt -126.32 140.26 49.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 120.906 0.384 . . . . 0.0 110.265 177.909 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 26.3 m -128.23 117.98 22.49 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.656 -179.008 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 49.5 t -86.72 127.86 40.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 174.771 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 26.2 m -127.83 139.68 52.49 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.345 0.593 . . . . 0.0 112.059 -173.681 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 784' ' ' LYS . . . . . 0.404 ' HG3' ' CE2' ' A' ' 736' ' ' PHE . 10.0 mtpm? -85.23 -12.88 51.54 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.93 0.871 . . . . 0.0 109.092 172.205 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 16.6 mmm180 -76.37 139.5 40.99 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 114.114 -1.403 . . . . 0.0 110.657 174.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.917 0 CA-C-O 118.734 -0.651 . . . . 0.0 110.41 177.847 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 801' ' ' DGP . . . . . 0.471 " H5'" ' CB ' ' A' ' 755' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo . . . . . 0 N--CA 1.475 0.413 0 N-CA-C 111.52 -0.223 . . . . 0.0 111.52 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -74.79 149.7 39.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.047 0.451 . . . . 0.0 111.707 -176.501 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . -138.5 99.9 0.28 Allowed Glycine 0 N--CA 1.444 -0.771 0 N-CA-C 110.906 -0.877 . . . . 0.0 110.906 174.036 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 15.4 m -78.39 56.38 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.432 0.634 . . . . 0.0 111.344 -175.8 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -75.56 -60.04 2.48 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.591 -179.744 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 10.3 m -75.62 95.25 3.33 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.01 -177.104 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -103.47 83.37 2.16 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 176.729 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -113.33 -179.0 3.52 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.612 -175.796 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . 81.07 72.71 1.22 Allowed Glycine 0 N--CA 1.448 -0.559 0 N-CA-C 110.715 -0.954 . . . . 0.0 110.715 -176.672 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 2.9 p -105.74 108.57 25.36 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.945 0 CA-C-O 121.922 0.868 . . . . 0.0 110.987 -171.514 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 727' ' ' ASP . . . . . 0.533 ' HB3' ' HB3' ' A' ' 730' ' ' ARG . 8.1 t70 -128.85 128.45 43.89 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 114.772 -1.104 . . . . 0.0 108.217 172.26 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 23.1 t60 -57.94 -45.54 86.42 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.089 0.471 . . . . 0.0 111.392 -172.057 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -82.41 -37.55 25.37 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.738 -174.648 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 730' ' ' ARG . . . . . 0.533 ' HB3' ' HB3' ' A' ' 727' ' ' ASP . 17.1 tpt180 -55.76 -44.58 77.79 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.975 0.417 . . . . 0.0 109.96 175.721 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 731' ' ' ALA . . . . . 0.432 ' O ' ' HG3' ' A' ' 735' ' ' GLU . . . -63.43 -52.08 63.02 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.872 179.72 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 31.6 mtm -63.63 -33.49 75.74 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.757 -177.433 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 733' ' ' ILE . . . . . 0.404 HD11 HG13 ' A' ' 758' ' ' VAL . 81.2 mt -72.74 -43.13 61.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 -179.898 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 11.9 p -67.98 -36.55 75.96 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.339 -179.204 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 735' ' ' GLU . . . . . 0.432 ' HG3' ' O ' ' A' ' 731' ' ' ALA . 52.4 mt-10 -68.83 -35.84 77.47 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.077 0.465 . . . . 0.0 109.768 175.376 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 736' ' ' PHE . . . . . 0.416 ' CE2' ' HG3' ' A' ' 784' ' ' LYS . 26.8 t80 -61.69 -38.23 87.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.39 178.591 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 737' ' ' MET . . . . . 0.557 ' HA ' ' HD3' ' A' ' 784' ' ' LYS . 42.0 mtm -62.29 -40.23 95.58 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 121.077 -0.249 . . . . 0.0 111.028 179.563 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -81.49 -17.98 46.75 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.948 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 32.7 t -74.08 160.77 30.8 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.905 -178.74 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 740' ' ' LYS . . . . . 0.555 ' H ' ' HD2' ' A' ' 740' ' ' LYS . 0.0 OUTLIER -77.43 -12.2 59.93 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.819 -178.944 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -67.24 133.29 49.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.154 -0.475 . . . . 0.0 109.859 177.014 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 59.2 mtt -95.76 -20.56 18.77 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.04 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -133.31 124.53 27.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.854 179.268 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 744' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -93.34 97.53 10.65 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 176.796 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -84.3 101.35 11.87 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.166 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 746' ' ' PHE . . . . . 0.408 ' O ' ' HB2' ' A' ' 779' ' ' PHE . 65.1 m-85 -79.66 154.02 75.94 Favored Pre-proline 0 C--N 1.321 -0.645 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.58 179.29 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -75.27 160.16 39.59 Favored 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 122.759 2.306 . . . . 0.0 111.602 175.049 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -68.14 -4.35 12.46 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.796 2.331 . . . . 0.0 112.612 177.033 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 12.2 p -63.9 -27.13 68.94 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.553 179.53 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.2 mp -63.22 115.34 4.43 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.466 -0.333 . . . . 0.0 110.552 176.317 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 751' ' ' ASN . . . . . 0.411 ' O ' ' HG3' ' A' ' 755' ' ' ARG . 2.6 p-10 -91.86 -170.04 2.45 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 174.577 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 12.8 p -46.19 -61.81 1.61 Allowed 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -173.462 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -55.53 -43.74 76.05 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.412 -178.006 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -62.94 -47.35 83.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.991 -178.286 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 755' ' ' ARG . . . . . 0.544 ' HB2' " H5'" ' A' ' 801' ' ' DGP . 82.8 mtt180 -60.89 -48.22 82.8 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.798 177.345 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 65.3 tp -54.26 -40.98 68.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.059 -179.065 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 9.9 mmt180 -59.02 -48.76 80.41 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.448 175.792 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 758' ' ' VAL . . . . . 0.404 HG13 HD11 ' A' ' 733' ' ' ILE . 59.3 t -62.27 -48.42 88.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.059 -179.773 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -57.0 -49.67 75.06 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 110.442 -0.207 . . . . 0.0 110.442 179.742 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 67.0 mt-30 -56.21 -50.37 71.44 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.599 179.633 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 95.5 mt -67.32 -46.23 84.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.542 -176.349 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -62.53 -39.59 94.09 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.838 0.351 . . . . 0.0 110.421 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -65.75 -33.87 76.87 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.58 177.917 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -73.89 -35.23 64.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.513 178.742 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 11.3 m170 -79.08 -11.77 60.0 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.389 179.416 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 81.92 21.68 60.89 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.482 179.382 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 71.8 mt -95.06 172.68 7.99 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 -179.183 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 768' ' ' ARG . . . . . 0.425 ' HD2' ' O ' ' A' ' 786' ' ' ALA . 58.0 ttt180 -96.15 132.71 41.27 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.891 0.377 . . . . 0.0 110.226 178.944 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -133.6 124.62 27.16 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 121.293 0.568 . . . . 0.0 110.537 178.697 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -145.25 145.24 31.21 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.424 -177.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 14.3 m -115.68 143.99 44.58 Favored 'General case' 0 C--N 1.316 -0.849 0 C-N-CA 120.843 -0.343 . . . . 0.0 111.005 -176.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 28.4 t -119.71 148.11 43.79 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.641 -0.708 . . . . 0.0 109.478 179.09 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 103.36 -178.8 25.54 Favored Glycine 0 N--CA 1.447 -0.606 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.08 -178.037 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -101.05 -84.39 0.43 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -175.282 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . -117.01 -86.65 1.22 Allowed Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.267 -0.968 . . . . 0.0 113.011 -174.247 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -76.4 -14.72 60.05 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.649 0.261 . . . . 0.0 111.434 -176.303 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 777' ' ' ARG . . . . . 0.427 HH11 ' HD3' ' A' ' 777' ' ' ARG . 47.1 mtt180 -107.0 7.35 29.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.821 0.343 . . . . 0.0 110.952 175.4 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 778' ' ' ARG . . . . . . . . . . . . . 47.0 ttt180 -74.59 119.22 18.49 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.029 0.442 . . . . 0.0 110.193 177.391 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 779' ' ' PHE . . . . . 0.408 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 48.0 p90 -117.41 148.47 41.74 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.842 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 9.3 tt -102.74 136.76 33.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.587 -177.5 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 18.6 m -120.75 116.04 24.47 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.58 -178.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 47.2 t -92.28 117.03 34.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.841 177.766 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 34.3 t -111.6 127.79 55.85 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.108 0.48 . . . . 0.0 110.43 -178.113 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 784' ' ' LYS . . . . . 0.557 ' HD3' ' HA ' ' A' ' 737' ' ' MET . 52.4 mtmt -83.53 -24.53 31.61 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.486 0.66 . . . . 0.0 109.222 174.481 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 20.9 mmt180 -90.64 162.43 14.96 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.99 -1.005 . . . . 0.0 110.801 179.467 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 786' ' ' ALA . . . . . 0.425 ' O ' ' HD2' ' A' ' 768' ' ' ARG . . . . . . . . 0 C--O 1.25 1.086 0 O-C-N 123.994 0.809 . . . . 0.0 111.372 178.143 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 801' ' ' DGP . . . . . 0.742 ' H8 ' ' OP3' ' A' ' 801' ' ' DGP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo . . . . . 0 N--CA 1.483 0.864 0 N-CA-C 111.245 -0.329 . . . . 0.0 111.245 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 718' ' ' GLU . . . . . 0.518 ' CD ' ' H ' ' A' ' 718' ' ' GLU . 0.1 OUTLIER -62.24 -30.12 70.88 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.787 178.527 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . -76.75 72.43 2.02 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.082 -0.807 . . . . 0.0 111.082 174.099 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 3.7 p -81.33 109.59 15.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 121.694 0.759 . . . . 0.0 110.922 -177.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.32 127.64 33.2 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 114.976 -1.011 . . . . 0.0 108.801 178.148 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 34.5 t -116.26 10.27 14.78 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -167.495 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -55.83 144.74 26.72 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.662 175.249 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -52.35 -37.36 55.92 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.785 -176.544 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . 144.85 -57.98 0.52 Allowed Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.733 -0.746 . . . . 0.0 111.93 178.718 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 27.9 t -104.89 97.89 6.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.692 0.758 . . . . 0.0 109.712 -177.701 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 727' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -127.98 139.71 52.41 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 114.727 -1.124 . . . . 0.0 109.006 178.571 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 728' ' ' HIS . . . . . 0.465 ' O ' ' HG2' ' A' ' 732' ' ' MET . 22.3 t60 -54.41 -55.19 31.19 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 123.534 0.521 . . . . 0.0 111.161 -176.545 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -70.75 -39.63 73.15 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.101 -174.891 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 26.8 ttt180 -55.71 -40.45 72.43 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.215 0.531 . . . . 0.0 110.059 176.188 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 731' ' ' ALA . . . . . 0.482 ' O ' HG12 ' A' ' 734' ' ' VAL . . . -71.82 -42.57 66.86 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.96 179.05 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 732' ' ' MET . . . . . 0.465 ' HG2' ' O ' ' A' ' 728' ' ' HIS . 44.8 mmm -60.65 -37.49 81.69 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.767 0.318 . . . . 0.0 110.895 178.638 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 70.8 mt -71.02 -41.0 76.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.528 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 734' ' ' VAL . . . . . 0.482 HG12 ' O ' ' A' ' 731' ' ' ALA . 10.0 p -67.66 -34.32 67.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.664 -179.167 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 735' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 731' ' ' ALA . 51.9 mt-10 -63.08 -45.56 91.57 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-O 121.349 0.595 . . . . 0.0 109.543 173.436 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 736' ' ' PHE . . . . . 0.422 ' HB2' HD12 ' A' ' 744' ' ' LEU . 41.6 t80 -57.41 -44.52 84.67 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.849 -1.069 . . . . 0.0 111.535 -179.383 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 737' ' ' MET . . . . . 0.412 ' HA ' ' HE2' ' A' ' 784' ' ' LYS . 45.8 mtm -69.15 -34.34 74.85 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.035 -179.345 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -78.04 -28.64 49.07 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.902 0.382 . . . . 0.0 111.224 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 25.2 t -80.69 -172.04 3.43 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.496 -179.225 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 740' ' ' LYS . . . . . 0.653 ' H ' ' HD2' ' A' ' 740' ' ' LYS . 0.0 OUTLIER -110.53 12.46 22.83 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.154 0.502 . . . . 0.0 110.848 -175.094 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -71.75 142.09 49.76 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.368 -0.605 . . . . 0.0 109.368 172.12 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 742' ' ' MET . . . . . 0.498 ' O ' ' HA ' ' A' ' 783' ' ' SER . 17.6 ptp -104.12 -14.91 15.71 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.468 177.454 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -140.7 116.34 10.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.662 179.122 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 744' ' ' LEU . . . . . 0.422 HD12 ' HB2' ' A' ' 736' ' ' PHE . 1.4 tt -89.63 103.55 16.18 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 177.646 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -88.27 99.07 11.95 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.646 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -77.03 153.35 82.64 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.352 178.674 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_exo -66.23 156.32 65.51 Favored 'Trans proline' 0 CA--C 1.532 0.422 0 C-N-CA 122.8 2.333 . . . . 0.0 112.13 176.045 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 748' ' ' PRO . . . . . 0.404 ' HB2' ' O ' ' A' ' 776' ' ' LYS . 53.5 Cg_endo -71.41 -5.24 16.61 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.928 2.419 . . . . 0.0 112.665 177.917 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 23.6 p -65.01 -25.23 67.77 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.156 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.9 mp -60.17 118.12 5.97 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.577 177.441 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -90.12 -176.53 4.89 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.075 176.663 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 17.4 m -48.29 -53.99 15.31 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 113.237 0.828 . . . . 0.0 113.237 -171.006 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -68.0 -37.86 81.97 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.693 0.282 . . . . 0.0 110.956 -175.866 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -65.16 -45.58 84.37 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.781 0.324 . . . . 0.0 110.405 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 755' ' ' ARG . . . . . 0.404 ' HB2' " H5'" ' A' ' 801' ' ' DGP . 78.2 mtt180 -58.53 -48.62 80.24 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 174.532 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 756' ' ' LEU . . . . . 0.421 ' HB2' " H4'" ' A' ' 801' ' ' DGP . 56.9 tp -53.68 -43.32 68.81 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.61 179.894 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -60.53 -41.73 95.02 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.293 -0.412 . . . . 0.0 109.963 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 91.7 t -64.18 -48.27 86.38 Favored 'Isoleucine or valine' 0 C--O 1.232 0.175 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.067 176.753 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -55.08 -48.35 73.64 Favored 'General case' 0 N--CA 1.464 0.236 0 O-C-N 123.255 0.347 . . . . 0.0 111.056 -179.737 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -58.98 -48.58 81.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.692 -179.622 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 98.5 mt -65.65 -49.17 79.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.987 -177.61 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -60.96 -41.41 96.27 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 120.912 0.387 . . . . 0.0 110.841 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 763' ' ' GLU . . . . . 0.434 ' CD ' HN21 ' A' ' 801' ' ' DGP . 37.7 tt0 -63.28 -39.68 95.27 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.033 -179.602 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -74.62 -36.79 62.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.807 0.337 . . . . 0.0 110.765 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 11.8 m170 -65.79 -25.06 67.08 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.908 177.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 100.15 14.62 32.94 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.384 177.408 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 39.7 mt -94.52 169.61 10.07 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 -179.48 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 768' ' ' ARG . . . . . 0.594 ' HB2' ' HA ' ' A' ' 786' ' ' ALA . 59.8 ttt180 -100.73 152.3 20.64 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 179.228 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 5.8 p80 -153.14 142.82 21.94 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.736 0.303 . . . . 0.0 110.803 -176.172 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -142.21 160.9 39.33 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.204 178.136 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 4.4 m -124.74 135.64 53.17 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.601 176.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 38.7 m -135.64 140.96 44.95 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.816 -175.247 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 115.01 170.74 16.47 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 121.147 -0.549 . . . . 0.0 111.952 178.485 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -109.77 129.89 55.58 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.788 0.327 . . . . 0.0 111.463 -177.216 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . 61.31 -112.05 4.39 Favored Glycine 0 N--CA 1.451 -0.342 0 CA-C-N 115.843 -0.617 . . . . 0.0 113.251 172.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 776' ' ' LYS . . . . . 0.406 ' HA ' ' HD2' ' A' ' 776' ' ' LYS . 19.3 tptm -97.63 -0.76 45.11 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.147 0.499 . . . . 0.0 110.607 -177.534 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 9.8 mtm-85 -91.38 0.49 57.51 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 172.693 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 778' ' ' ARG . . . . . . . . . . . . . 55.8 ttt85 -83.51 125.45 31.76 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 114.431 -1.259 . . . . 0.0 110.909 -176.565 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 43.8 p90 -118.92 170.61 8.87 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.816 178.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 8.3 tt -122.7 141.22 43.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-O 120.928 0.394 . . . . 0.0 110.594 179.815 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 781' ' ' THR . . . . . 0.408 ' HA ' ' O ' ' A' ' 744' ' ' LEU . 25.7 m -127.14 127.63 44.88 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.468 -179.648 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 35.4 t -106.19 124.44 61.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.653 178.517 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 783' ' ' SER . . . . . 0.498 ' HA ' ' O ' ' A' ' 742' ' ' MET . 55.6 p -112.36 139.55 47.83 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.072 0.463 . . . . 0.0 111.259 -177.114 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 784' ' ' LYS . . . . . 0.412 ' HE2' ' HA ' ' A' ' 737' ' ' MET . 89.6 mttt -69.4 -28.22 65.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.408 0.623 . . . . 0.0 110.326 175.268 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 785' ' ' ARG . . . . . 0.566 ' HA ' ' NE ' ' A' ' 785' ' ' ARG . 4.1 mmp_? -87.15 114.31 23.64 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.821 177.342 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 786' ' ' ALA . . . . . 0.594 ' HA ' ' HB2' ' A' ' 768' ' ' ARG . . . . . . . . 0 C--O 1.245 0.841 0 CA-C-O 118.438 -0.792 . . . . 0.0 111.136 -175.846 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 801' ' ' DGP . . . . . 0.56 ' H8 ' ' OP3' ' A' ' 801' ' ' DGP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo . . . . . 0 N--CA 1.474 0.354 0 N-CA-C 110.876 -0.471 . . . . 0.0 110.876 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -102.54 114.67 29.08 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.225 -179.155 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . -75.52 81.9 0.95 Allowed Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 121.098 -0.572 . . . . 0.0 112.334 179.7 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 48.5 t -92.39 115.28 30.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 121.027 0.441 . . . . 0.0 110.496 -178.113 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -107.57 156.32 19.15 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.758 -0.655 . . . . 0.0 109.424 175.961 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 14.9 m -75.97 103.57 6.1 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.887 -178.349 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -79.29 93.07 5.22 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.061 0.458 . . . . 0.0 109.822 175.922 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -140.01 151.62 45.61 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.866 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . 91.12 51.26 2.63 Favored Glycine 0 N--CA 1.445 -0.753 0 N-CA-C 110.068 -1.213 . . . . 0.0 110.068 -172.166 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 17.4 t -98.14 104.69 16.26 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 CA-C-O 120.94 0.4 . . . . 0.0 110.752 -171.246 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 727' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -72.55 158.93 34.75 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 173.038 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 31.8 t60 -55.28 -51.36 66.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.212 0.529 . . . . 0.0 109.602 177.422 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 36.2 m-85 -70.24 -24.24 63.05 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.45 -178.494 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 12.0 ttm180 -70.34 -39.76 74.52 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 178.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -63.96 -41.73 97.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.133 175.653 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 35.0 mmm -59.83 -43.36 94.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.549 178.004 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 733' ' ' ILE . . . . . 0.453 ' O ' ' HG3' ' A' ' 737' ' ' MET . 48.7 mt -70.03 -45.15 77.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.871 -0.604 . . . . 0.0 112.101 -178.304 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 10.9 p -63.47 -37.12 78.71 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 120.968 -0.293 . . . . 0.0 111.166 -176.075 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -74.02 -36.01 64.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.06 0.457 . . . . 0.0 110.186 176.529 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 736' ' ' PHE . . . . . 0.465 ' CE1' ' HB2' ' A' ' 744' ' ' LEU . 19.3 t80 -60.76 -37.02 80.41 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.819 175.838 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 737' ' ' MET . . . . . 0.453 ' HG3' ' O ' ' A' ' 733' ' ' ILE . 87.6 mtp -63.23 -36.24 82.98 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.093 178.863 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -86.28 -16.14 38.5 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.383 -178.862 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 58.9 m -84.53 169.41 14.48 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.874 0.369 . . . . 0.0 111.316 -177.905 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -73.36 -16.38 61.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.936 -0.575 . . . . 0.0 112.061 -176.304 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -60.16 134.59 57.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.127 0.489 . . . . 0.0 111.051 -177.338 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 56.6 mtm -92.47 -26.96 17.74 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.935 177.737 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 29.1 pt20 -137.35 135.68 37.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.311 -179.157 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 744' ' ' LEU . . . . . 0.465 ' HB2' ' CE1' ' A' ' 736' ' ' PHE . 30.4 tp -112.94 105.37 13.43 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 176.848 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -91.37 112.65 24.65 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.243 -178.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 746' ' ' PHE . . . . . 0.531 ' O ' ' HB2' ' A' ' 779' ' ' PHE . 87.4 m-85 -85.51 150.07 53.19 Favored Pre-proline 0 C--N 1.321 -0.661 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.154 178.023 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 747' ' ' PRO . . . . . 0.408 ' O ' HD13 ' A' ' 750' ' ' LEU . 11.9 Cg_exo -67.41 158.81 55.29 Favored 'Trans proline' 0 N--CA 1.461 -0.391 0 C-N-CA 122.407 2.071 . . . . 0.0 112.008 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -66.09 -5.64 12.74 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.787 2.324 . . . . 0.0 112.532 176.683 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 3.4 m -63.4 -20.74 65.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.476 -0.783 . . . . 0.0 111.42 178.648 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 750' ' ' LEU . . . . . 0.408 HD13 ' O ' ' A' ' 747' ' ' PRO . 10.5 mp -69.06 113.85 6.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.372 177.75 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 27.2 p30 -84.86 -167.36 1.79 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 110.247 -0.279 . . . . 0.0 110.247 179.061 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 6.2 m -52.25 -52.09 54.56 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 111.664 0.246 . . . . 0.0 111.664 -177.059 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 753' ' ' HIS . . . . . 0.451 ' O ' ' HG2' ' A' ' 757' ' ' ARG . 32.0 t-80 -59.54 -49.71 76.7 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.625 -0.261 . . . . 0.0 111.347 179.097 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -56.63 -55.73 30.34 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.168 -176.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 755' ' ' ARG . . . . . 0.492 ' HB2' H5'' ' A' ' 801' ' ' DGP . 77.1 mtt85 -56.55 -49.69 74.06 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.35 -179.788 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 756' ' ' LEU . . . . . 0.477 HD23 " H1'" ' A' ' 801' ' ' DGP . 3.1 tm? -53.08 -46.25 68.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.218 -178.07 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 757' ' ' ARG . . . . . 0.451 ' HG2' ' O ' ' A' ' 753' ' ' HIS . 31.9 mmm180 -60.35 -45.86 91.96 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.355 178.48 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 91.9 t -60.45 -47.39 92.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.648 -0.251 . . . . 0.0 110.943 179.067 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 87.8 m-70 -52.33 -56.73 12.95 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.711 178.431 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -60.79 -41.95 96.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.041 -0.527 . . . . 0.0 112.099 -178.377 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.59 -50.5 79.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.749 0.309 . . . . 0.0 110.845 179.257 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -64.39 -36.73 85.1 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.889 0.376 . . . . 0.0 110.58 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 763' ' ' GLU . . . . . 0.447 ' CD ' HN21 ' A' ' 801' ' ' DGP . 31.8 tt0 -65.32 -40.25 93.49 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.573 178.919 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.21 -43.37 78.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.053 -0.522 . . . . 0.0 109.852 177.686 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 10.5 m170 -69.09 -17.0 63.81 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.431 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 84.38 34.99 15.3 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.457 177.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 80.1 mt -110.4 172.95 6.56 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.03 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 73.3 ttt180 -92.71 143.75 25.99 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 177.841 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 5.5 p80 -146.06 121.49 10.32 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.222 0.534 . . . . 0.0 110.638 179.498 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -129.32 138.07 51.37 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.7 -176.368 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 5.1 m -104.02 128.08 51.59 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 174.637 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 20.4 p -132.06 150.22 52.21 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.783 -175.125 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 117.79 -157.68 15.03 Favored Glycine 0 N--CA 1.444 -0.77 0 N-CA-C 111.435 -0.666 . . . . 0.0 111.435 -177.51 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -94.76 -88.79 0.24 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.605 0.241 . . . . 0.0 111.585 -178.746 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . -142.93 -66.21 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.622 -0.799 . . . . 0.0 112.08 -179.676 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -79.62 -28.28 40.95 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.108 0.48 . . . . 0.0 110.439 179.079 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 777' ' ' ARG . . . . . 0.438 HH11 ' HD3' ' A' ' 777' ' ' ARG . 51.4 mtt180 -97.38 3.11 51.14 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.51 175.857 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 778' ' ' ARG . . . . . . . . . . . . . 28.2 ttt180 -72.42 129.48 38.46 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.0 178.657 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 779' ' ' PHE . . . . . 0.531 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 45.8 p90 -121.34 166.53 13.92 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.274 -178.309 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 6.7 tt -116.41 135.5 56.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-O 121.278 0.561 . . . . 0.0 110.775 -178.028 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 55.9 m -119.91 120.24 35.83 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.733 -179.496 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 46.5 t -94.14 122.53 45.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.51 176.109 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 45.5 t -114.22 134.05 55.19 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-O 121.072 0.463 . . . . 0.0 110.835 -176.018 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 50.9 mtpt -88.03 -43.23 11.87 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.771 179.268 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 785' ' ' ARG . . . . . 0.699 ' HA ' ' NE ' ' A' ' 785' ' ' ARG . 2.0 mmp_? -121.08 122.3 39.75 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.665 -175.818 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.882 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.323 176.574 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 801' ' ' DGP . . . . . 0.527 " H3'" ' OP3' ' A' ' 801' ' ' DGP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_endo . . . . . 0 N--CA 1.478 0.6 0 N-CA-C 109.892 -0.849 . . . . 0.0 109.892 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 718' ' ' GLU . . . . . 0.401 ' OE1' ' HA ' ' A' ' 718' ' ' GLU . 5.5 mm-40 -78.87 70.23 5.17 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.169 0.509 . . . . 0.0 110.85 178.929 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . -87.79 65.66 3.49 Favored Glycine 0 N--CA 1.445 -0.726 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.72 178.715 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 3.4 p -126.72 100.34 6.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-O 121.574 0.702 . . . . 0.0 110.227 178.345 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -65.71 114.09 4.75 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.556 177.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 46.7 m -74.08 120.13 19.25 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.954 -0.388 . . . . 0.0 109.954 178.615 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 47.7 tt0 -71.53 -47.82 52.74 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.238 -0.437 . . . . 0.0 109.872 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -156.28 -167.57 2.47 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.374 178.822 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . 86.0 31.71 19.65 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.538 -0.839 . . . . 0.0 112.516 178.603 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 17.4 t -89.27 100.52 10.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 176.629 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 727' ' ' ASP . . . . . 0.531 ' CG ' ' HB2' ' A' ' 730' ' ' ARG . 2.1 p-10 -75.89 137.41 40.39 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.748 -175.327 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 44.2 t60 -51.1 -54.97 20.15 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 114.842 -1.072 . . . . 0.0 111.948 -175.671 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -64.22 -23.03 67.16 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.187 -176.349 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 730' ' ' ARG . . . . . 0.531 ' HB2' ' CG ' ' A' ' 727' ' ' ASP . 1.8 ttm180 -69.2 -47.69 64.17 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 178.284 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -63.5 -42.43 98.52 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.668 178.724 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 37.9 mmm -60.63 -38.15 83.83 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.381 179.542 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 48.8 mt -72.9 -45.99 53.88 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.661 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 11.1 p -64.9 -35.1 74.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 C-N-CA 120.861 -0.335 . . . . 0.0 110.94 -176.665 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -74.73 -33.34 62.34 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 121.023 0.439 . . . . 0.0 110.208 176.874 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 736' ' ' PHE . . . . . 0.479 ' CE2' ' HG3' ' A' ' 784' ' ' LYS . 32.2 t80 -61.79 -36.26 80.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.913 174.347 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 80.8 mtp -74.14 -26.05 60.1 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.15 177.464 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -87.77 -24.97 23.62 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.859 0.362 . . . . 0.0 110.609 -176.46 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 77.3 p -89.9 -173.81 4.03 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.45 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -100.92 16.47 25.13 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.436 -176.13 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 741' ' ' LYS . . . . . 0.463 ' O ' ' HD3' ' A' ' 784' ' ' LYS . 58.3 mttp -72.78 132.23 43.33 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 177.049 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 25.7 mmt -88.97 -28.51 20.2 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.727 0.299 . . . . 0.0 110.583 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -141.19 136.76 32.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.321 -177.731 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 744' ' ' LEU . . . . . 0.444 HD13 ' CZ ' ' A' ' 746' ' ' PHE . 0.7 OUTLIER -107.78 103.79 13.14 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 179.059 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -86.52 103.29 14.9 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.981 0.42 . . . . 0.0 110.554 177.718 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 746' ' ' PHE . . . . . 0.444 ' CZ ' HD13 ' A' ' 744' ' ' LEU . 72.2 m-85 -81.83 151.9 68.27 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.474 176.82 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 747' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 746' ' ' PHE . 22.4 Cg_exo -65.45 153.6 77.48 Favored 'Trans proline' 0 CA--C 1.531 0.367 0 C-N-CA 122.706 2.27 . . . . 0.0 112.47 178.431 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -67.15 -5.68 14.28 Favored 'Trans proline' 0 N--CA 1.474 0.352 0 C-N-CA 123.218 2.612 . . . . 0.0 113.051 179.235 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 23.2 t -71.5 -13.95 61.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.786 179.32 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.9 mp -71.51 112.59 7.75 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 175.281 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 31.1 p30 -85.3 -170.59 3.19 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.425 -179.326 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 19.5 m -57.63 -38.43 74.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.509 0.195 . . . . 0.0 111.366 -176.855 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 38.2 t-80 -69.64 -48.67 59.13 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.834 178.515 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -59.39 -50.6 73.32 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 121.217 0.532 . . . . 0.0 110.5 -179.178 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 755' ' ' ARG . . . . . 0.454 ' HB2' " H5'" ' A' ' 801' ' ' DGP . 22.9 mtm180 -60.9 -40.59 93.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.339 179.645 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 756' ' ' LEU . . . . . 0.504 ' HB2' " H4'" ' A' ' 801' ' ' DGP . 54.5 tp -55.54 -44.03 76.36 Favored 'General case' 0 C--N 1.332 -0.194 0 O-C-N 123.287 0.367 . . . . 0.0 110.819 178.399 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 19.2 tpt180 -59.74 -43.1 94.39 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 121.033 0.444 . . . . 0.0 110.07 179.138 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 48.6 t -64.83 -48.35 84.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.937 178.418 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -57.2 -47.25 81.74 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 110.324 -0.25 . . . . 0.0 110.324 178.407 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -52.03 -53.62 39.79 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.687 177.583 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 761' ' ' ILE . . . . . 0.404 HD13 ' HA ' ' A' ' 730' ' ' ARG . 74.8 mt -65.82 -43.57 93.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.398 -175.775 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -64.8 -37.0 86.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.987 0.422 . . . . 0.0 110.679 179.853 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 763' ' ' GLU . . . . . 0.508 ' CD ' HN21 ' A' ' 801' ' ' DGP . 40.7 tt0 -69.65 -36.92 76.5 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.378 178.478 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -64.51 -49.33 71.76 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.412 175.75 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 13.1 m170 -69.44 -31.41 69.71 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.365 -176.836 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 98.77 38.41 3.9 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.203 179.031 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 78.6 mt -111.26 174.39 5.89 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 178.742 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 768' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' A' ' 768' ' ' ARG . 21.5 ttt180 -93.52 136.6 33.63 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 178.892 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.7 p80 -142.35 134.24 27.12 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 120.648 0.261 . . . . 0.0 110.805 -177.268 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -146.56 142.91 28.48 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.345 179.829 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 3.3 p -127.97 125.69 39.95 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.276 176.419 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 3.0 p -157.73 -176.73 6.1 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.117 -173.622 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 126.96 -107.46 0.9 Allowed Glycine 0 N--CA 1.449 -0.434 0 N-CA-C 111.455 -0.658 . . . . 0.0 111.455 -179.15 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 774' ' ' GLU . . . . . 0.596 ' O ' ' HB2' ' A' ' 778' ' ' ARG . 44.8 mt-10 -124.82 -175.84 3.39 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 175.014 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . -71.1 -49.27 28.02 Favored Glycine 0 N--CA 1.445 -0.706 0 C-N-CA 120.094 -1.05 . . . . 0.0 111.148 174.528 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.04 -38.98 69.42 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.216 -0.492 . . . . 0.0 111.159 177.461 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 777' ' ' ARG . . . . . 0.406 ' O ' ' HG2' ' A' ' 777' ' ' ARG . 33.2 ttp85 -106.91 27.93 8.48 Favored 'General case' 0 N--CA 1.439 -0.984 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.679 -170.198 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 778' ' ' ARG . . . . . 0.596 ' HB2' ' O ' ' A' ' 774' ' ' GLU . 60.8 ttt180 -72.25 111.17 7.23 Favored 'General case' 0 C--N 1.315 -0.918 0 C-N-CA 119.814 -0.754 . . . . 0.0 110.187 177.096 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 50.7 p90 -113.33 156.68 22.97 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 115.114 -0.948 . . . . 0.0 109.481 -177.444 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 15.2 tt -107.85 133.41 52.78 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-O 121.387 0.613 . . . . 0.0 110.733 -179.258 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 781' ' ' THR . . . . . 0.44 ' HA ' ' O ' ' A' ' 744' ' ' LEU . 26.7 m -116.05 115.75 26.66 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.048 177.686 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 33.5 t -91.04 134.18 30.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 176.112 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 33.7 t -125.26 137.12 54.09 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.126 0.489 . . . . 0.0 110.731 -175.246 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 784' ' ' LYS . . . . . 0.479 ' HG3' ' CE2' ' A' ' 736' ' ' PHE . 60.1 mtpt -86.78 -18.63 30.61 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.411 178.775 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 18.4 mmm180 -115.4 -81.42 0.61 Allowed 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.246 -178.26 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 786' ' ' ALA . . . . . 0.401 ' O ' ' HD3' ' A' ' 768' ' ' ARG . . . . . . . . 0 C--O 1.244 0.794 0 CA-C-O 118.158 -0.925 . . . . 0.0 110.257 -179.409 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 801' ' ' DGP . . . . . 0.508 HN21 ' CD ' ' A' ' 763' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_endo . . . . . 0 N--CA 1.479 0.658 0 N-CA-C 110.774 -0.51 . . . . 0.0 110.774 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.82 -36.98 1.97 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.159 0.504 . . . . 0.0 110.719 -178.628 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . 124.19 50.06 0.21 Allowed Glycine 0 N--CA 1.443 -0.873 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.16 179.384 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 11.7 p -65.51 -21.78 29.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 121.284 0.564 . . . . 0.0 110.062 176.612 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -66.47 146.99 53.93 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.965 176.5 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 33.0 t -162.0 158.53 25.21 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 178.525 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 43.3 tt0 -83.26 62.66 6.8 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.708 0.766 . . . . 0.0 109.556 179.029 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -139.06 -174.08 3.75 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 179.824 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . 57.78 48.18 83.65 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.933 -0.651 . . . . 0.0 111.882 -177.122 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 18.1 t -77.63 82.07 0.83 Allowed 'Isoleucine or valine' 0 CA--C 1.512 -0.481 0 CA-C-O 121.69 0.757 . . . . 0.0 109.127 -175.846 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 727' ' ' ASP . . . . . 0.449 ' HB3' ' CB ' ' A' ' 730' ' ' ARG . 13.2 t70 -107.48 133.93 51.25 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.144 -174.459 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 26.1 t60 -55.17 -52.66 62.6 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 123.473 0.483 . . . . 0.0 111.252 -178.237 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 24.7 m-85 -74.46 -35.54 63.31 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.672 -174.873 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 730' ' ' ARG . . . . . 0.449 ' CB ' ' HB3' ' A' ' 727' ' ' ASP . 17.1 ttp85 -64.34 -39.65 94.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.744 0.307 . . . . 0.0 110.351 178.947 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -64.06 -48.14 77.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.704 178.452 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 11.9 mtm -61.96 -35.42 78.42 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.145 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 733' ' ' ILE . . . . . 0.508 ' O ' ' HG3' ' A' ' 737' ' ' MET . 66.4 mt -71.72 -49.86 42.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.706 -0.224 . . . . 0.0 111.6 179.316 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 11.2 p -63.58 -34.6 68.63 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 120.988 -0.285 . . . . 0.0 111.39 -175.639 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -77.49 -31.18 53.46 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.95 0.405 . . . . 0.0 110.356 177.849 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 736' ' ' PHE . . . . . 0.513 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 0.7 OUTLIER -66.22 -37.01 84.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.447 174.489 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 737' ' ' MET . . . . . 0.508 ' HG3' ' O ' ' A' ' 733' ' ' ILE . 88.7 mtp -61.74 -28.65 69.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.013 179.408 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -102.85 9.55 38.85 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.005 -179.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 7.6 t -96.54 -164.54 1.16 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.028 -179.033 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -108.19 10.66 27.86 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.731 0.301 . . . . 0.0 111.628 -176.267 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 56.5 mttp -91.7 136.97 32.74 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.827 0.346 . . . . 0.0 110.541 177.679 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.86 -24.63 35.67 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.534 179.501 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -152.87 138.12 17.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.11 0.481 . . . . 0.0 111.092 177.694 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 744' ' ' LEU . . . . . 0.513 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 59.7 tp -102.67 105.75 16.27 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.607 -179.61 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -87.36 114.16 23.72 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.278 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 746' ' ' PHE . . . . . 0.417 ' HA ' ' HD3' ' A' ' 747' ' ' PRO . 80.9 m-85 -84.77 151.33 57.9 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.501 179.52 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 747' ' ' PRO . . . . . 0.441 ' HB2' ' OG ' ' A' ' 749' ' ' SER . 13.8 Cg_exo -68.33 155.71 68.28 Favored 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 122.606 2.204 . . . . 0.0 112.184 177.456 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -67.94 -3.01 9.73 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 122.995 2.463 . . . . 0.0 112.821 178.413 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 749' ' ' SER . . . . . 0.441 ' OG ' ' HB2' ' A' ' 747' ' ' PRO . 5.3 p -68.62 -23.18 64.42 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.251 178.648 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.7 mp -63.14 115.65 4.68 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.01 175.166 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -84.62 -171.38 3.59 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.186 -179.747 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 2.8 m -48.19 -54.25 14.07 Favored 'General case' 0 C--N 1.328 -0.349 0 O-C-N 123.59 0.556 . . . . 0.0 111.914 -178.387 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 34.9 m80 -73.31 -31.16 63.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.462 -175.258 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -64.47 -47.4 79.11 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 176.608 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 23.3 mtm180 -61.87 -45.98 91.39 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.041 177.353 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 756' ' ' LEU . . . . . 0.58 ' HB2' " H4'" ' A' ' 801' ' ' DGP . 57.8 tp -52.69 -41.82 64.23 Favored 'General case' 0 C--N 1.332 -0.168 0 O-C-N 123.432 0.457 . . . . 0.0 110.848 178.543 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 26.2 tpt180 -61.47 -45.91 92.26 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.952 179.357 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 99.6 t -64.83 -47.42 88.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.188 179.306 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -55.23 -48.6 73.69 Favored 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 178.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 63.8 mt-30 -52.74 -51.79 59.05 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.516 177.489 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 77.3 mt -66.36 -47.65 83.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.505 -175.341 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -64.22 -39.03 93.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.834 0.349 . . . . 0.0 110.463 -179.113 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -65.86 -40.79 92.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.216 178.656 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -66.95 -45.52 77.55 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.741 178.276 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 10.7 m170 -70.38 -27.76 64.56 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.445 -177.177 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 98.24 30.69 6.87 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.527 -0.844 . . . . 0.0 112.544 177.592 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 53.1 mt -107.05 162.78 13.55 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 177.677 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 26.0 ttp180 -84.43 132.39 34.57 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.654 -0.418 . . . . 0.0 109.893 178.698 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 4.4 p80 -130.71 123.68 29.83 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-O 121.111 0.482 . . . . 0.0 110.254 178.868 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -136.83 155.76 49.38 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.944 -179.002 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 9.4 t -113.05 162.01 16.4 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 178.307 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 772' ' ' SER . . . . . 0.509 ' O ' ' HA ' ' A' ' 778' ' ' ARG . 23.0 t -151.52 149.66 29.47 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.61 -179.233 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 89.13 167.96 43.36 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.988 -0.625 . . . . 0.0 111.883 -178.684 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -125.79 138.42 53.84 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.762 0.315 . . . . 0.0 111.007 179.113 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . 65.68 -120.43 16.9 Favored Glycine 0 N--CA 1.449 -0.488 0 CA-C-N 115.871 -0.604 . . . . 0.0 112.559 177.9 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 20.5 tptm -74.96 -10.83 59.85 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.271 0.558 . . . . 0.0 110.39 -179.336 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 19.6 mtt180 -91.18 -6.32 53.65 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.944 176.17 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 778' ' ' ARG . . . . . 0.509 ' HA ' ' O ' ' A' ' 772' ' ' SER . 36.9 ttt180 -81.11 120.74 25.22 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.186 0.517 . . . . 0.0 111.152 -175.092 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 45.3 p90 -134.47 174.67 10.28 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.291 -0.868 . . . . 0.0 108.809 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 8.9 tt -127.07 143.49 40.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-O 121.025 0.44 . . . . 0.0 111.166 -175.549 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 57.3 m -124.6 125.83 44.78 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.678 179.036 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 47.5 t -102.94 114.29 42.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 176.125 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 11.2 t -110.78 140.0 45.59 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.087 0.47 . . . . 0.0 110.726 -175.194 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -80.63 -36.48 32.55 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.955 176.138 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 19.2 mmm180 -104.13 156.07 18.19 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.098 -178.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.365 -0.826 . . . . 0.0 109.708 175.993 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 801' ' ' DGP . . . . . 0.832 ' H8 ' ' OP3' ' A' ' 801' ' ' DGP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo . . . . . 0 N--CA 1.481 0.74 0 N-CA-C 110.542 -0.599 . . . . 0.0 110.542 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -111.9 -17.26 12.95 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.334 -177.477 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . 83.27 57.21 2.53 Favored Glycine 0 N--CA 1.444 -0.773 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 -175.3 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 720' ' ' VAL . . . . . 0.404 HG12 ' HA ' ' A' ' 764' ' ' GLU . 35.2 m -127.12 163.22 30.44 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 CA-C-O 121.186 0.517 . . . . 0.0 110.321 -176.385 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -143.89 92.59 2.35 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.695 179.216 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 50.9 m -69.91 105.7 2.91 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.848 -172.2 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -107.3 103.98 13.48 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.833 179.14 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 724' ' ' ASP . . . . . 0.493 ' CG ' ' H ' ' A' ' 725' ' ' GLY . 14.4 t70 -104.09 -156.26 0.56 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.794 -176.269 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 725' ' ' GLY . . . . . 0.493 ' H ' ' CG ' ' A' ' 724' ' ' ASP . . . 99.72 -79.95 0.5 Allowed Glycine 0 N--CA 1.445 -0.738 0 N-CA-C 111.137 -0.785 . . . . 0.0 111.137 -176.544 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 14.9 p -170.29 137.9 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 176.815 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 727' ' ' ASP . . . . . 0.438 ' HB3' ' CB ' ' A' ' 730' ' ' ARG . 13.4 t70 -159.71 134.98 8.19 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 177.319 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 728' ' ' HIS . . . . . 0.468 ' O ' ' HG3' ' A' ' 732' ' ' MET . 46.5 t-80 -64.02 -46.55 83.96 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.452 -175.328 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -77.03 -31.38 56.28 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.007 -175.229 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 730' ' ' ARG . . . . . 0.438 ' CB ' ' HB3' ' A' ' 727' ' ' ASP . 15.7 tpt180 -57.75 -43.23 85.27 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 174.589 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -64.8 -48.22 75.22 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.665 177.589 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 732' ' ' MET . . . . . 0.468 ' HG3' ' O ' ' A' ' 728' ' ' HIS . 92.2 mtp -57.37 -45.76 84.08 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.933 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 733' ' ' ILE . . . . . 0.462 ' O ' ' HG3' ' A' ' 737' ' ' MET . 72.9 mt -67.17 -45.57 86.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.912 -178.236 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 11.3 p -66.98 -38.42 81.33 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 120.594 -0.442 . . . . 0.0 111.065 -176.491 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 735' ' ' GLU . . . . . 0.463 ' O ' ' HB2' ' A' ' 739' ' ' SER . 42.8 mt-10 -72.09 -33.35 67.82 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-O 120.842 0.353 . . . . 0.0 110.114 177.33 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 736' ' ' PHE . . . . . 0.626 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 7.0 t80 -60.12 -42.66 95.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.354 177.31 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 737' ' ' MET . . . . . 0.476 ' SD ' HD11 ' A' ' 767' ' ' LEU . 46.4 mtm -62.4 -25.8 68.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.59 -176.592 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -112.61 12.89 19.9 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.907 0.384 . . . . 0.0 111.152 -178.446 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 739' ' ' SER . . . . . 0.463 ' HB2' ' O ' ' A' ' 735' ' ' GLU . 7.7 t -94.98 7.09 47.18 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.407 -176.937 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? 65.27 16.81 10.74 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.201 -177.772 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -97.32 125.04 41.66 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 176.497 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.0 -20.11 33.36 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.147 -177.972 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -147.06 129.15 15.55 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.145 -174.528 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 744' ' ' LEU . . . . . 0.626 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 42.6 tp -118.61 102.29 8.76 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 110.067 -0.345 . . . . 0.0 110.067 179.805 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 11.3 mp0 -85.72 108.16 17.93 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.214 -0.448 . . . . 0.0 109.946 177.052 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -75.23 152.02 85.94 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.647 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -64.89 149.59 89.33 Favored 'Trans proline' 0 CA--C 1.53 0.316 0 C-N-CA 122.774 2.316 . . . . 0.0 112.06 177.011 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -67.31 -2.44 8.17 Favored 'Trans proline' 0 N--CA 1.474 0.346 0 C-N-CA 123.239 2.626 . . . . 0.0 113.145 -179.454 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 13.0 t -74.02 -18.1 60.89 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.93 179.351 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.8 mp -64.38 113.76 3.84 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.155 176.409 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 751' ' ' ASN . . . . . 0.461 ' O ' ' HG3' ' A' ' 755' ' ' ARG . 4.5 p30 -81.25 -176.69 6.11 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 -179.019 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 44.3 t -49.44 -49.11 46.59 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.515 -179.065 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 753' ' ' HIS . . . . . 0.401 ' O ' ' HG2' ' A' ' 757' ' ' ARG . 41.1 m80 -67.87 -37.54 81.94 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.524 -178.262 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -64.0 -49.68 71.53 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.142 0.496 . . . . 0.0 110.218 179.176 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 755' ' ' ARG . . . . . 0.461 ' HG3' ' O ' ' A' ' 751' ' ' ASN . 23.5 mtm180 -63.83 -38.46 91.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.208 -179.718 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 62.1 tp -54.41 -44.71 72.62 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 123.393 0.433 . . . . 0.0 110.779 177.789 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 757' ' ' ARG . . . . . 0.401 ' HG2' ' O ' ' A' ' 753' ' ' HIS . 31.2 mmm180 -58.9 -47.02 86.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.974 177.775 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 59.0 t -59.24 -48.47 86.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.976 178.662 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -57.38 -55.02 40.22 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.638 -0.255 . . . . 0.0 110.841 179.498 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -53.45 -46.3 69.84 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 121.097 0.475 . . . . 0.0 111.416 -178.532 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 96.4 mt -68.56 -47.52 76.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.294 -176.831 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -65.37 -34.1 77.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.937 0.399 . . . . 0.0 110.532 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 763' ' ' GLU . . . . . 0.407 ' CD ' HN21 ' A' ' 801' ' ' DGP . 36.5 tt0 -64.0 -35.15 79.76 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.39 178.179 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 764' ' ' GLU . . . . . 0.404 ' HA ' HG12 ' A' ' 720' ' ' VAL . 39.8 tt0 -74.81 -42.64 57.69 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 120.975 0.417 . . . . 0.0 110.848 176.66 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 11.4 m170 -65.28 -26.23 67.99 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.401 -179.127 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 93.29 20.68 31.9 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.928 -0.653 . . . . 0.0 111.838 -179.409 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 767' ' ' LEU . . . . . 0.476 HD11 ' SD ' ' A' ' 737' ' ' MET . 32.6 mt -97.62 166.49 11.48 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 -177.251 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 28.7 ttt180 -85.68 125.18 32.98 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.057 175.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 3.3 p80 -121.2 116.63 25.29 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.113 174.77 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 41.2 t0 -141.83 156.9 45.53 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.802 -172.742 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 6.1 p -126.22 144.49 50.76 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 120.982 0.42 . . . . 0.0 111.305 -175.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 772' ' ' SER . . . . . 0.418 ' O ' ' HA ' ' A' ' 778' ' ' ARG . 15.2 m -134.3 137.58 44.34 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.535 -178.323 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 773' ' ' GLY . . . . . 0.455 ' HA3' ' HA ' ' A' ' 778' ' ' ARG . . . 122.97 -176.95 16.61 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.916 -0.659 . . . . 0.0 112.727 177.795 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -84.88 -92.64 0.08 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.559 0.219 . . . . 0.0 111.385 -176.299 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . -118.91 -82.64 0.81 Allowed Glycine 0 N--CA 1.451 -0.345 0 N-CA-C 111.536 -0.626 . . . . 0.0 111.536 178.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 21.3 tptm -70.93 -26.13 63.05 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.388 0.613 . . . . 0.0 109.593 175.441 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 3.3 mmt180 -86.56 8.24 22.93 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.044 175.529 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 778' ' ' ARG . . . . . 0.455 ' HA ' ' HA3' ' A' ' 773' ' ' GLY . 46.6 ttt85 -97.84 110.84 23.33 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 121.46 0.648 . . . . 0.0 110.717 177.525 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 50.4 p90 -110.92 172.68 6.73 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.819 -177.765 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 12.7 tt -116.06 143.0 27.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-O 121.1 0.476 . . . . 0.0 110.519 -179.231 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 49.5 m -129.72 130.15 45.09 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.639 179.342 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 98.7 t -106.85 132.27 54.6 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.722 178.223 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 16.4 m -124.88 139.41 53.86 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.208 -179.657 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 784' ' ' LYS . . . . . 0.429 ' HA ' HD22 ' A' ' 767' ' ' LEU . 27.4 mtpp -68.57 137.59 54.42 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.49 -177.287 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 16.0 mmm180 -147.47 98.72 3.03 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.394 -179.266 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.514 -0.755 . . . . 0.0 110.384 179.026 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 801' ' ' DGP . . . . . 0.897 " H3'" ' OP3' ' A' ' 801' ' ' DGP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 728' ' ' HIS . . . . . 0.478 ' O ' ' HG2' ' A' ' 732' ' ' MET . 51.1 t60 . . . . . 0 CA--C 1.52 -0.199 0 CA-C-O 120.739 0.304 . . . . 0.0 110.885 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 729' ' ' PHE . . . . . 0.419 ' CZ ' ' HB3' ' A' ' 754' ' ' ASP . 66.1 m-85 -71.96 -32.48 67.33 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.314 -173.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 17.2 ttt180 -67.99 -35.13 77.81 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.152 177.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -67.17 -39.84 86.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.324 176.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 732' ' ' MET . . . . . 0.478 ' HG2' ' O ' ' A' ' 728' ' ' HIS . 38.7 mmm -61.86 -40.46 95.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.681 177.729 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 733' ' ' ILE . . . . . 0.413 ' O ' ' HG3' ' A' ' 737' ' ' MET . 64.5 mt -71.53 -42.99 72.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.898 -178.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 8.0 p -64.7 -35.37 74.71 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 C-N-CA 120.738 -0.385 . . . . 0.0 110.763 -177.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -66.33 -47.35 73.79 Favored 'General case' 0 CA--C 1.522 -0.124 0 CA-C-O 121.25 0.547 . . . . 0.0 109.577 173.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 736' ' ' PHE . . . . . 0.599 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 45.2 t80 -52.96 -42.73 65.78 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.015 -0.993 . . . . 0.0 111.676 179.014 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 737' ' ' MET . . . . . 0.413 ' HG3' ' O ' ' A' ' 733' ' ' ILE . 83.6 mtp -61.08 -32.68 72.33 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.673 -177.594 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -101.02 2.38 40.49 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.488 -177.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 60.7 m -98.44 174.45 6.46 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.18 0.514 . . . . 0.0 112.049 -175.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 16.5 ptmt -74.43 -18.26 60.67 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.726 177.023 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 29.9 mttm -57.93 111.18 1.08 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.101 -178.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 26.6 ptt? -78.1 -22.21 49.27 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.219 0.533 . . . . 0.0 109.717 175.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -143.19 135.99 27.7 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.329 -0.851 . . . . 0.0 109.698 178.152 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 744' ' ' LEU . . . . . 0.599 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 36.4 tp -105.69 105.77 15.96 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 179.095 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -86.47 115.41 23.95 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.146 -0.933 . . . . 0.0 110.208 178.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 746' ' ' PHE . . . . . 0.409 ' HA ' ' HD3' ' A' ' 747' ' ' PRO . 68.3 m-85 -90.34 149.73 41.68 Favored Pre-proline 0 C--N 1.319 -0.737 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.756 177.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 747' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 746' ' ' PHE . 11.3 Cg_exo -69.32 156.04 65.62 Favored 'Trans proline' 0 N--CA 1.462 -0.358 0 C-N-CA 122.758 2.305 . . . . 0.0 111.953 177.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -66.15 -4.13 9.82 Favored 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 122.73 2.286 . . . . 0.0 112.771 176.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 32.9 t -67.04 -16.52 64.41 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.516 179.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.8 mp -71.97 128.63 36.33 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.699 0.285 . . . . 0.0 110.391 177.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 751' ' ' ASN . . . . . 0.489 ' O ' ' HG3' ' A' ' 755' ' ' ARG . 4.7 p30 -93.97 -176.89 4.15 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 175.469 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 20.7 t -54.13 -41.81 68.8 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 122.971 0.169 . . . . 0.0 111.303 -177.314 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 49.1 t-80 -65.06 -45.47 85.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.68 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 754' ' ' ASP . . . . . 0.419 ' HB3' ' CZ ' ' A' ' 729' ' ' PHE . 45.2 m-20 -62.03 -43.17 99.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.222 0.534 . . . . 0.0 110.057 -177.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 755' ' ' ARG . . . . . 0.489 ' HG3' ' O ' ' A' ' 751' ' ' ASN . 70.9 mtt-85 -65.21 -46.56 80.21 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.964 177.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 56.1 tp -52.78 -40.87 63.57 Favored 'General case' 0 N--CA 1.463 0.223 0 O-C-N 123.443 0.465 . . . . 0.0 110.533 177.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 757' ' ' ARG . . . . . 0.565 ' HE ' ' HA ' ' A' ' 757' ' ' ARG . 1.6 tpm_? -57.65 -50.81 71.94 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.248 176.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 61.2 t -63.15 -48.08 89.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.297 -179.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -55.74 -46.72 77.75 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.425 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 64.4 mt-30 -56.89 -52.96 63.11 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.949 0.404 . . . . 0.0 111.607 178.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 76.1 mt -65.55 -47.12 87.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.356 -175.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -63.74 -36.55 84.23 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.744 0.307 . . . . 0.0 110.876 -178.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -65.98 -39.16 90.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.719 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -73.99 -39.66 63.5 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.124 178.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 10.5 m170 -70.43 -34.97 73.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.086 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 107.4 31.41 3.77 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.414 -0.898 . . . . 0.0 112.925 176.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 29.3 mt -111.14 164.75 12.52 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 179.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 70.8 ttt-85 -88.5 132.99 34.27 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 -179.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.0 p80 -134.34 130.85 37.57 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.566 -177.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -155.43 146.22 22.29 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.831 -177.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 771' ' ' SER . . . . . 0.409 ' HA ' ' HA ' ' A' ' 780' ' ' ILE . 4.3 m . . . . . 0 N--CA 1.443 -0.793 0 CA-C-O 121.227 0.537 . . . . 0.0 109.823 176.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 37.0 p90 . . . . . 0 N--CA 1.451 -0.403 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 780' ' ' ILE . . . . . 0.409 ' HA ' ' HA ' ' A' ' 771' ' ' SER . 8.0 tt -116.22 133.54 62.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-O 121.12 0.486 . . . . 0.0 110.904 -177.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 4.0 m -115.17 124.73 52.2 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.365 -178.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 60.0 t -104.89 129.71 57.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 174.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 41.5 t -118.93 143.74 46.84 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.136 0.493 . . . . 0.0 110.979 -177.294 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 784' ' ' LYS . . . . . 0.56 ' HG3' ' CZ ' ' A' ' 736' ' ' PHE . 62.6 mtpt . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.973 -179.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 13.5 t60 . . . . . 0 N--CA 1.455 -0.201 0 CA-C-O 121.065 0.459 . . . . 0.0 110.638 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -77.53 -36.93 51.92 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.398 -172.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 53.2 ttp180 -59.92 -41.02 90.85 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 175.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -65.76 -45.59 81.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.714 178.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 19.3 mmm -58.24 -45.02 88.49 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.93 178.089 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 74.9 mt -70.71 -43.39 77.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.827 -177.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 8.5 p -66.28 -35.5 75.12 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.14 -177.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -77.15 -27.6 53.9 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-O 120.789 0.328 . . . . 0.0 110.449 176.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 736' ' ' PHE . . . . . 0.507 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 25.7 t80 -65.34 -41.1 94.28 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.299 178.015 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 65.6 mtm -63.58 -29.71 70.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.071 0.463 . . . . 0.0 110.518 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -96.45 8.45 44.03 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.026 -0.533 . . . . 0.0 111.097 179.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 44.2 t -93.68 165.88 12.5 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.363 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -84.91 -1.65 56.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.292 -179.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -73.79 160.47 31.44 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.719 179.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 4.4 mpp? -108.89 -28.56 9.09 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.217 175.102 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -142.92 127.68 18.18 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.211 0.529 . . . . 0.0 111.145 178.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 744' ' ' LEU . . . . . 0.507 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 52.7 tp -96.73 106.13 18.37 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.312 179.057 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -90.94 106.07 18.26 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.089 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -75.14 157.18 85.44 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.19 -177.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 747' ' ' PRO . . . . . 0.411 ' HA ' ' HD3' ' A' ' 748' ' ' PRO . 19.6 Cg_exo -68.33 161.8 43.2 Favored 'Trans proline' 0 CA--C 1.535 0.539 0 C-N-CA 122.641 2.228 . . . . 0.0 112.057 175.125 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 748' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 747' ' ' PRO . 5.5 Cg_exo -76.39 -9.75 18.89 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.505 2.137 . . . . 0.0 111.753 178.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 20.1 t -64.07 -21.44 66.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.427 -179.139 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 11.2 mp -61.5 121.24 12.21 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.655 -0.248 . . . . 0.0 110.74 178.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 751' ' ' ASN . . . . . 0.489 ' O ' ' HG2' ' A' ' 755' ' ' ARG . 3.4 p-10 -90.72 -176.65 4.77 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 177.661 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 15.1 m -50.11 -49.83 50.42 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -173.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 38.7 t-80 -54.04 -47.9 71.11 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.977 177.368 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 754' ' ' ASP . . . . . 0.491 ' O ' HG23 ' A' ' 758' ' ' VAL . 57.9 m-20 -62.75 -45.43 92.76 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.629 -176.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 755' ' ' ARG . . . . . 0.489 ' HG2' ' O ' ' A' ' 751' ' ' ASN . 23.7 mmt180 -52.99 -60.59 3.09 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.835 176.263 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -52.62 -45.04 66.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 114.654 -1.157 . . . . 0.0 111.269 -177.298 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 10.2 mmt85 -55.48 -49.04 73.56 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.991 178.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 758' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 754' ' ' ASP . 63.1 t -62.71 -45.34 99.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.738 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -55.69 -54.33 45.61 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.824 179.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 99.3 mt-30 -54.69 -52.04 63.65 Favored 'General case' 0 C--O 1.232 0.183 0 O-C-N 123.25 0.344 . . . . 0.0 111.528 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 94.3 mt -62.77 -50.42 79.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.228 -176.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -64.1 -38.78 92.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.842 0.353 . . . . 0.0 111.166 -178.078 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -66.25 -35.83 81.43 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.035 -178.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -85.19 -29.55 24.63 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.757 0.313 . . . . 0.0 110.942 -178.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 6.7 m170 -70.08 -24.44 63.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.835 0.35 . . . . 0.0 110.598 174.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 96.2 28.82 8.88 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.871 -0.681 . . . . 0.0 112.366 177.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 56.0 mt -105.08 170.89 7.61 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 768' ' ' ARG . . . . . 0.566 ' HB3' ' OG ' ' A' ' 783' ' ' SER . 30.4 ttt180 -98.89 140.12 33.53 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 -178.06 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -150.92 134.05 16.04 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.28 0.562 . . . . 0.0 111.782 -176.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -155.47 168.23 27.79 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.493 175.291 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 7.2 m . . . . . 0 C--N 1.318 -0.799 0 CA-C-O 121.12 0.486 . . . . 0.0 110.694 -176.76 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 49.0 p90 . . . . . 0 N--CA 1.448 -0.551 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 6.2 tt -121.13 135.64 60.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.85 0.357 . . . . 0.0 110.68 -178.152 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 29.5 m -116.97 124.86 50.39 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.697 -177.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 47.5 t -108.53 124.06 64.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.095 176.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 783' ' ' SER . . . . . 0.566 ' OG ' ' HB3' ' A' ' 768' ' ' ARG . 4.6 p -113.37 140.78 47.75 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 121.311 0.577 . . . . 0.0 111.099 -179.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 784' ' ' LYS . . . . . 0.481 ' HG3' ' CZ ' ' A' ' 736' ' ' PHE . 62.7 mtpt . . . . . 0 C--N 1.326 -0.439 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.084 179.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 10.6 t60 . . . . . 0 N--CA 1.461 0.082 0 CA-C-O 120.801 0.334 . . . . 0.0 111.202 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -69.38 -32.96 72.33 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.832 -174.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 57.8 ttm-85 -64.2 -45.78 86.82 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.227 177.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 731' ' ' ALA . . . . . 0.438 ' HA ' HG12 ' A' ' 734' ' ' VAL . . . -62.24 -42.68 99.53 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.727 179.619 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 26.8 mmm -59.3 -44.71 92.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.687 177.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 733' ' ' ILE . . . . . 0.422 HD11 HG13 ' A' ' 758' ' ' VAL . 66.7 mt -74.01 -43.04 52.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.146 -0.479 . . . . 0.0 112.174 -176.724 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 734' ' ' VAL . . . . . 0.438 HG12 ' HA ' ' A' ' 731' ' ' ALA . 12.1 p -64.62 -40.3 88.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.19 -176.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -77.45 -26.38 51.45 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.367 178.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 736' ' ' PHE . . . . . 0.47 ' CZ ' ' HG3' ' A' ' 784' ' ' LYS . 23.8 t80 -60.52 -39.97 89.75 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.756 174.432 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 67.7 mtm -63.54 -25.38 68.22 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.02 0.438 . . . . 0.0 110.698 177.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -96.96 3.07 52.22 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.26 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 67.0 m -101.52 170.99 7.84 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.801 0.334 . . . . 0.0 110.992 -178.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -85.43 -11.27 54.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.389 -176.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -63.98 128.53 36.24 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.473 176.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 742' ' ' MET . . . . . 0.401 ' HG3' ' HG3' ' A' ' 743' ' ' GLN . 14.5 ptp -83.57 -24.71 31.44 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.838 0.351 . . . . 0.0 110.407 175.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 743' ' ' GLN . . . . . 0.401 ' HG3' ' HG3' ' A' ' 742' ' ' MET . 52.0 mt-30 -134.63 131.83 38.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.286 -178.266 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 744' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -94.71 98.63 10.91 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 175.211 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -83.29 101.3 11.19 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.386 -178.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 746' ' ' PHE . . . . . 0.426 ' HA ' ' HD3' ' A' ' 747' ' ' PRO . 68.1 m-85 -85.56 148.29 48.82 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.734 179.586 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 747' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 746' ' ' PHE . 14.8 Cg_exo -68.29 155.0 70.87 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 122.68 2.253 . . . . 0.0 112.028 176.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -68.02 -8.71 23.48 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.729 2.286 . . . . 0.0 112.46 178.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 32.1 t -63.14 -22.67 67.02 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.284 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 11.2 mp -59.29 118.54 6.06 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 175.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 751' ' ' ASN . . . . . 0.408 HD21 ' HB2' ' A' ' 753' ' ' HIS . 1.0 OUTLIER -81.02 -178.2 6.78 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 179.494 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 14.0 p -54.63 -42.6 71.4 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.688 0.28 . . . . 0.0 111.201 -178.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 753' ' ' HIS . . . . . 0.408 ' HB2' HD21 ' A' ' 751' ' ' ASN . 75.6 m80 -68.99 -40.0 79.03 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.886 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 41.5 m-20 -59.8 -51.0 71.62 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 121.07 0.462 . . . . 0.0 110.261 178.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 43.8 mtt180 -64.96 -43.72 91.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.519 -178.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 55.7 tp -54.26 -41.47 68.84 Favored 'General case' 0 C--N 1.33 -0.242 0 O-C-N 123.367 0.417 . . . . 0.0 110.292 177.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 757' ' ' ARG . . . . . 0.616 ' HE ' ' HA ' ' A' ' 757' ' ' ARG . 0.7 OUTLIER -60.39 -48.22 82.68 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.065 176.886 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 758' ' ' VAL . . . . . 0.422 HG13 HD11 ' A' ' 733' ' ' ILE . 58.7 t -59.75 -50.18 81.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.022 178.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -55.26 -50.18 70.15 Favored 'General case' 0 C--O 1.226 -0.156 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.557 179.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -63.93 -37.72 88.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.829 -177.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 96.3 mt -69.54 -44.11 80.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 120.8 0.333 . . . . 0.0 110.65 178.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -66.01 -34.98 79.34 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.201 0.525 . . . . 0.0 110.182 177.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -66.53 -38.32 86.92 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.41 175.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -69.77 -42.81 73.33 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.906 177.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 11.7 m170 -75.24 -29.33 60.19 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.88 -178.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 92.99 43.49 4.1 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.117 178.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 82.8 mt -110.35 -170.16 1.59 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.923 0.392 . . . . 0.0 110.544 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 768' ' ' ARG . . . . . 0.435 ' HD3' ' HB2' ' A' ' 783' ' ' SER . 60.3 ttt-85 -106.67 126.63 52.52 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.822 -179.226 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -139.77 132.44 28.92 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.066 0.46 . . . . 0.0 111.243 -177.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -156.36 138.87 14.94 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.668 -176.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 771' ' ' SER . . . . . 0.424 ' HA ' ' HA ' ' A' ' 780' ' ' ILE . 19.2 m . . . . . 0 C--N 1.321 -0.65 0 CA-C-O 121.047 0.451 . . . . 0.0 110.191 178.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 779' ' ' PHE . . . . . 0.413 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 28.4 p90 . . . . . 0 N--CA 1.454 -0.234 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 780' ' ' ILE . . . . . 0.424 ' HA ' ' HA ' ' A' ' 771' ' ' SER . 9.8 tt -127.96 131.82 69.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 121.198 0.523 . . . . 0.0 111.238 -177.779 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 13.4 m -113.71 119.22 36.66 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.345 -178.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 43.3 t -102.09 121.15 52.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.007 177.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 783' ' ' SER . . . . . 0.435 ' HB2' ' HD3' ' A' ' 768' ' ' ARG . 4.2 m -109.3 138.96 44.85 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-O 120.738 0.304 . . . . 0.0 110.322 -179.128 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 784' ' ' LYS . . . . . 0.47 ' HG3' ' CZ ' ' A' ' 736' ' ' PHE . 61.4 mtpt . . . . . 0 C--N 1.324 -0.533 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.663 178.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 15.6 t60 . . . . . 0 N--CA 1.462 0.17 0 CA-C-O 120.66 0.267 . . . . 0.0 110.63 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -71.21 -33.01 69.52 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.466 -0.333 . . . . 0.0 110.755 -175.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 10.4 tpt180 -55.31 -47.74 75.16 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.938 0.399 . . . . 0.0 110.355 173.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 731' ' ' ALA . . . . . 0.408 ' HA ' HG12 ' A' ' 734' ' ' VAL . . . -64.89 -42.34 94.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.43 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 35.6 mmm -60.62 -39.6 88.81 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.011 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 733' ' ' ILE . . . . . 0.435 HD11 HG13 ' A' ' 758' ' ' VAL . 74.3 mt -74.93 -45.45 43.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.781 -178.412 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 734' ' ' VAL . . . . . 0.408 HG12 ' HA ' ' A' ' 731' ' ' ALA . 11.3 p -66.33 -37.42 79.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 C-N-CA 120.648 -0.421 . . . . 0.0 110.911 -177.577 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -80.59 -21.6 41.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.752 0.311 . . . . 0.0 110.374 178.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 736' ' ' PHE . . . . . 0.599 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 15.8 t80 -61.16 -46.08 91.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.532 174.015 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 64.7 mtm -60.66 -34.53 74.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.546 178.036 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -78.86 -29.63 44.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.182 -179.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 68.6 m -73.55 -17.64 61.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.064 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 58.5 mttp 69.99 17.25 7.46 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 173.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 741' ' ' LYS . . . . . 0.474 ' HE2' ' O ' ' A' ' 743' ' ' GLN . 46.1 mtpt -69.7 139.01 53.38 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 172.13 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -73.31 -31.14 63.84 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.854 0.359 . . . . 0.0 110.675 -178.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 743' ' ' GLN . . . . . 0.474 ' O ' ' HE2' ' A' ' 741' ' ' LYS . 54.9 mt-30 -143.73 136.94 27.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.943 -0.572 . . . . 0.0 109.726 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 744' ' ' LEU . . . . . 0.599 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 52.9 tp -112.24 110.74 21.16 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 176.235 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 745' ' ' GLU . . . . . 0.411 ' H ' ' CD ' ' A' ' 745' ' ' GLU . 0.7 OUTLIER -86.07 108.02 18.08 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.741 178.616 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . 60.6 m-85 -78.97 154.33 77.73 Favored Pre-proline 0 C--N 1.322 -0.623 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.401 177.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 747' ' ' PRO . . . . . 0.46 ' O ' HD13 ' A' ' 750' ' ' LEU . 31.5 Cg_exo -60.4 147.78 92.83 Favored 'Trans proline' 0 CA--C 1.529 0.269 0 C-N-CA 122.689 2.259 . . . . 0.0 112.233 178.029 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -70.73 -7.45 21.37 Favored 'Trans proline' 0 CA--C 1.528 0.187 0 C-N-CA 122.704 2.269 . . . . 0.0 112.689 179.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 24.6 m -71.11 -16.88 62.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.377 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 750' ' ' LEU . . . . . 0.46 HD13 ' O ' ' A' ' 747' ' ' PRO . 10.9 mp -59.97 118.91 6.82 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.096 174.429 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 751' ' ' ASN . . . . . 0.54 ' ND2' ' H ' ' A' ' 753' ' ' HIS . 1.5 p-10 -88.11 -178.69 6.02 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 177.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 19.7 m -53.19 -31.41 42.69 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -176.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 753' ' ' HIS . . . . . 0.54 ' H ' ' ND2' ' A' ' 751' ' ' ASN . 61.8 m170 -79.42 -37.72 36.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.457 0.17 . . . . 0.0 111.124 -179.194 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 754' ' ' ASP . . . . . 0.428 ' HB3' ' HG ' ' A' ' 750' ' ' LEU . 67.6 m-20 -66.43 -44.39 83.02 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.222 0.534 . . . . 0.0 109.758 177.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 74.8 mtt180 -60.6 -50.28 74.16 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.179 177.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 55.8 tp -54.54 -39.69 67.93 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.702 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 757' ' ' ARG . . . . . 0.416 ' HB3' ' O ' ' A' ' 754' ' ' ASP . 3.8 tpt180 -55.98 -51.78 66.52 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.202 175.305 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 758' ' ' VAL . . . . . 0.435 HG13 HD11 ' A' ' 733' ' ' ILE . 85.5 t -61.33 -49.22 85.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.974 179.356 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 89.6 m-70 -53.59 -56.28 18.5 Favored 'General case' 0 N--CA 1.463 0.217 0 O-C-N 123.419 0.449 . . . . 0.0 110.838 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -55.97 -45.24 78.98 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.057 0.392 . . . . 0.0 112.057 -179.173 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 98.5 mt -66.69 -48.55 79.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.574 0.226 . . . . 0.0 111.069 -178.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -65.44 -32.13 73.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.916 0.389 . . . . 0.0 110.68 -179.029 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -69.74 -33.45 72.47 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.347 178.56 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -73.46 -35.85 65.77 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.018 176.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 -67.19 -35.98 80.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.682 175.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 102.01 19.02 15.81 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.18 -179.251 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 71.2 mt -92.35 178.48 5.82 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 18.4 ttt180 -96.43 140.04 31.67 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 174.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.1 p80 -145.63 123.31 11.85 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.22 -179.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -151.07 167.52 27.43 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.07 -179.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 15.1 m . . . . . 0 C--N 1.318 -0.761 0 CA-C-O 121.029 0.443 . . . . 0.0 110.745 -177.671 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 45.7 p90 . . . . . 0 N--CA 1.449 -0.518 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 12.2 tt -102.49 132.59 48.24 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-O 121.155 0.503 . . . . 0.0 110.489 -179.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 6.1 m -113.6 118.75 35.27 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.047 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 50.4 t -98.57 130.23 47.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 177.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 8.5 t -122.26 142.26 50.64 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.063 0.459 . . . . 0.0 110.249 -177.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 9.6 mtpm? . . . . . 0 C--N 1.324 -0.542 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.751 -178.638 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 14.3 t60 . . . . . 0 N--CA 1.463 0.222 0 CA-C-O 120.767 0.317 . . . . 0.0 111.621 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -72.35 -22.6 61.13 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.903 -175.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 730' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 730' ' ' ARG . 0.4 OUTLIER -60.7 -49.59 76.9 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 172.658 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 731' ' ' ALA . . . . . 0.512 ' HA ' HG12 ' A' ' 734' ' ' VAL . . . -59.81 -46.15 90.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.548 178.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 35.5 mmm -55.48 -44.55 76.58 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.011 178.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 59.1 mt -77.38 -38.22 26.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.188 -0.46 . . . . 0.0 112.003 -176.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 734' ' ' VAL . . . . . 0.512 HG12 ' HA ' ' A' ' 731' ' ' ALA . 8.8 p -68.01 -36.69 76.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 O-C-N 122.036 -0.415 . . . . 0.0 110.666 -178.724 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -73.47 -31.77 63.96 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 121.153 0.501 . . . . 0.0 109.804 175.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 736' ' ' PHE . . . . . 0.535 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 22.1 t80 -63.46 -40.82 98.15 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.824 175.293 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 737' ' ' MET . . . . . 0.437 ' SD ' HD11 ' A' ' 767' ' ' LEU . 73.2 mtm -72.99 -6.86 48.26 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.998 0.428 . . . . 0.0 110.833 177.237 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -103.24 0.46 31.63 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.857 174.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 32.8 t -102.67 169.77 8.43 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.28 -178.168 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 2.6 ptmt -90.9 -6.54 54.01 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.063 -177.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 741' ' ' LYS . . . . . 0.542 ' O ' ' HE2' ' A' ' 784' ' ' LYS . 27.6 mtpp -64.47 126.25 27.23 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.586 177.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 3.2 mpp? -67.73 -30.32 69.77 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.439 176.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -149.17 155.0 39.99 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 120.904 0.383 . . . . 0.0 111.372 176.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 744' ' ' LEU . . . . . 0.535 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 69.0 tp -115.17 111.31 20.8 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.277 -176.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -82.72 105.74 13.99 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.417 178.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 746' ' ' PHE . . . . . 0.467 ' O ' ' HB2' ' A' ' 779' ' ' PHE . 71.8 m-85 -79.01 154.81 77.71 Favored Pre-proline 0 C--N 1.325 -0.489 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 176.254 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 747' ' ' PRO . . . . . 0.445 ' O ' HD13 ' A' ' 750' ' ' LEU . 59.6 Cg_endo -76.4 156.39 36.84 Favored 'Trans proline' 0 CA--C 1.533 0.452 0 C-N-CA 122.453 2.102 . . . . 0.0 112.24 178.295 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -68.75 -5.12 14.68 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.959 2.44 . . . . 0.0 113.203 -179.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 4.4 p -69.23 -16.93 63.71 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.86 -178.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 750' ' ' LEU . . . . . 0.445 HD13 ' O ' ' A' ' 747' ' ' PRO . 11.2 mp -63.55 117.98 7.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.337 176.057 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -78.8 -176.95 5.22 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 20.0 t -54.47 -39.51 67.53 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 120.768 0.318 . . . . 0.0 110.871 -177.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 40.1 m80 -73.25 -38.83 65.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.304 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 754' ' ' ASP . . . . . 0.423 ' HB3' ' HG ' ' A' ' 750' ' ' LEU . 66.2 m-20 -63.37 -48.1 79.31 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.928 0.394 . . . . 0.0 110.259 179.287 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 74.0 mtt180 -60.62 -46.77 89.02 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.985 177.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 60.9 tp -55.2 -44.38 75.28 Favored 'General case' 0 CA--C 1.523 -0.066 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.727 179.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 757' ' ' ARG . . . . . 0.457 ' HE ' ' HA ' ' A' ' 757' ' ' ARG . 2.6 mmp_? -51.5 -54.82 23.19 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.474 174.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 90.6 t -60.21 -46.79 94.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.495 -178.136 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -56.93 -52.22 66.04 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 110.314 -0.254 . . . . 0.0 110.314 178.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 99.3 mt-30 -56.71 -43.68 80.82 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.462 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 95.4 mt -67.08 -50.06 67.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.257 -178.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -62.14 -38.66 89.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.045 0.45 . . . . 0.0 110.523 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -68.03 -30.68 69.97 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.554 178.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -76.49 -42.42 43.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.502 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 38.0 m-70 -75.41 -28.34 59.37 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.956 -179.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 103.67 24.42 7.79 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.657 177.411 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 767' ' ' LEU . . . . . 0.437 HD11 ' SD ' ' A' ' 737' ' ' MET . 79.2 mt -96.16 164.34 12.72 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.878 -0.415 . . . . 0.0 109.878 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 37.9 ttp180 -93.63 112.92 24.9 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.953 0.406 . . . . 0.0 110.151 -178.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . 0.442 ' H ' ' CD2' ' A' ' 769' ' ' HIS . 2.9 p80 -108.54 124.25 50.17 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.625 -178.229 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -137.7 130.27 29.7 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.298 -179.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 771' ' ' SER . . . . . 0.448 ' HA ' ' HA ' ' A' ' 780' ' ' ILE . 12.5 p . . . . . 0 C--N 1.314 -0.963 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.794 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 779' ' ' PHE . . . . . 0.467 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 48.1 p90 . . . . . 0 N--CA 1.448 -0.563 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 780' ' ' ILE . . . . . 0.448 ' HA ' ' HA ' ' A' ' 771' ' ' SER . 12.3 tt -120.68 138.39 51.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 121.063 0.459 . . . . 0.0 110.79 -178.696 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 8.8 m -121.86 120.91 35.92 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.374 -179.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 50.1 t -99.8 115.6 41.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 177.363 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 29.2 t -110.92 136.18 50.34 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 121.266 0.555 . . . . 0.0 110.553 -178.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 784' ' ' LYS . . . . . 0.542 ' HE2' ' O ' ' A' ' 741' ' ' LYS . 52.8 mtmt . . . . . 0 C--N 1.324 -0.506 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.136 178.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 13.4 t60 . . . . . 0 N--CA 1.455 -0.186 0 CA-C-O 120.538 0.209 . . . . 0.0 110.793 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -71.97 -38.27 69.76 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.994 -176.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 42.1 ttt85 -62.54 -38.84 91.58 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.184 176.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -64.65 -45.56 86.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.241 176.639 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 32.9 mmm -58.01 -42.74 85.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.886 177.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 733' ' ' ILE . . . . . 0.43 HD11 HG13 ' A' ' 758' ' ' VAL . 72.8 mt -72.25 -42.92 66.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 N-CA-C 111.908 0.336 . . . . 0.0 111.908 -177.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 8.2 p -65.97 -36.99 78.82 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.576 -178.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -78.21 -24.44 47.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.073 0.463 . . . . 0.0 110.405 177.132 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 736' ' ' PHE . . . . . 0.551 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 34.9 t80 -64.43 -41.59 96.49 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.537 175.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 59.7 mtm -64.02 -28.81 70.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.844 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -85.81 -15.29 42.45 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.229 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 61.6 m -81.33 166.87 20.09 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.45 -179.271 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.98 7.22 44.94 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.924 0.392 . . . . 0.0 111.466 -179.579 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 73.5 mttt -85.22 126.92 34.06 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.024 173.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 95.5 mmm -81.6 -17.88 46.71 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.886 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -138.76 136.21 35.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.684 -178.178 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 744' ' ' LEU . . . . . 0.551 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 44.3 tp -120.17 109.97 16.06 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.096 178.62 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -90.09 113.08 24.75 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.457 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 746' ' ' PHE . . . . . 0.484 ' O ' ' HB2' ' A' ' 779' ' ' PHE . 84.1 m-85 -83.08 153.47 66.59 Favored Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.964 176.338 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 747' ' ' PRO . . . . . 0.438 ' O ' HD13 ' A' ' 750' ' ' LEU . 16.8 Cg_exo -67.18 155.79 69.1 Favored 'Trans proline' 0 CA--C 1.532 0.394 0 C-N-CA 122.508 2.139 . . . . 0.0 112.44 178.445 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -68.19 -7.71 20.73 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.838 2.359 . . . . 0.0 112.394 177.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 7.3 m -63.89 -20.25 65.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.552 179.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 750' ' ' LEU . . . . . 0.438 HD13 ' O ' ' A' ' 747' ' ' PRO . 11.2 mp -63.34 122.74 16.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.352 176.445 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 1.6 p30 -84.42 -178.61 6.96 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 15.2 m -48.55 -46.57 39.11 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 123.166 0.291 . . . . 0.0 111.381 179.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 50.9 m80 -72.03 -36.9 69.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.636 -178.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 -60.36 -50.67 72.69 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.133 0.492 . . . . 0.0 109.801 178.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 62.8 mtt85 -61.0 -45.15 95.98 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.181 178.334 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 756' ' ' LEU . . . . . 0.424 HD11 HE21 ' A' ' 760' ' ' GLN . 53.4 tp -52.98 -42.81 65.89 Favored 'General case' 0 C--O 1.235 0.334 0 O-C-N 123.535 0.522 . . . . 0.0 111.03 -179.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 11.0 mmm180 -58.83 -53.69 55.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.017 176.168 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 758' ' ' VAL . . . . . 0.43 HG13 HD11 ' A' ' 733' ' ' ILE . 60.9 t -56.79 -48.68 80.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.401 -179.378 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -55.28 -55.3 33.01 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.596 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 760' ' ' GLN . . . . . 0.424 HE21 HD11 ' A' ' 756' ' ' LEU . 70.3 mt-30 -64.47 -33.37 75.73 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 -176.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 96.9 mt -70.14 -48.64 60.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 C-N-CA 120.894 -0.323 . . . . 0.0 110.464 178.057 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -63.49 -34.6 78.13 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.167 0.508 . . . . 0.0 110.28 177.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -64.28 -36.7 84.94 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.652 176.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -70.02 -46.54 64.85 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.189 176.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 11.2 m-70 -65.15 -30.12 71.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.108 -178.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 95.01 25.18 15.03 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.767 -0.73 . . . . 0.0 111.825 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 68.1 mt -99.3 176.93 5.36 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 22.6 ttp180 -99.66 135.29 41.29 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -132.69 127.69 35.33 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.189 0.518 . . . . 0.0 110.691 -178.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -133.85 143.12 48.12 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.98 -177.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 12.7 p . . . . . 0 C--N 1.317 -0.848 0 CA-C-O 121.275 0.56 . . . . 0.0 110.296 175.962 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 779' ' ' PHE . . . . . 0.484 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 44.4 p90 . . . . . 0 N--CA 1.448 -0.57 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 12.6 tt -127.5 133.82 66.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-O 120.984 0.421 . . . . 0.0 110.773 -178.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 24.7 m -119.71 116.01 25.08 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.415 -179.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 38.0 t -94.36 133.88 33.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.872 179.661 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -117.02 135.03 54.01 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.764 0.316 . . . . 0.0 111.16 -179.421 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 23.2 mtpp . . . . . 0 C--O 1.234 0.237 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.171 175.267 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 30.6 t60 . . . . . 0 C--O 1.233 0.202 0 CA-C-O 120.843 0.354 . . . . 0.0 111.359 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 729' ' ' PHE . . . . . 0.467 ' CZ ' ' HB3' ' A' ' 754' ' ' ASP . 55.6 m-85 -80.98 -36.47 30.69 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.679 -175.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 15.2 tpp85 -56.95 -43.72 81.86 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 174.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -64.63 -47.46 78.45 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.239 -179.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 4.5 mtm -65.78 -35.52 80.95 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.164 -178.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 733' ' ' ILE . . . . . 0.507 HD11 HG13 ' A' ' 758' ' ' VAL . 81.2 mt -73.27 -42.78 57.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.581 -0.282 . . . . 0.0 111.535 179.392 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 9.1 p -66.06 -37.53 79.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 120.594 -0.442 . . . . 0.0 110.975 -176.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -75.14 -29.3 60.45 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.881 0.372 . . . . 0.0 110.251 176.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 736' ' ' PHE . . . . . 0.535 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 36.1 t80 -61.8 -40.11 94.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.1 176.535 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 49.1 mtm -62.46 -33.19 74.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.788 178.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -92.08 3.58 54.98 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.069 -178.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 22.8 t -97.44 166.99 11.27 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -88.72 -1.17 57.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.79 0.329 . . . . 0.0 111.132 -178.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 741' ' ' LYS . . . . . 0.509 ' O ' ' HE2' ' A' ' 784' ' ' LYS . 97.0 mttt -66.64 133.13 49.62 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 173.69 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 27.2 ptt? -88.26 -23.2 23.57 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 178.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 743' ' ' GLN . . . . . 0.406 ' HA ' ' O ' ' A' ' 782' ' ' VAL . 4.2 pt20 -141.73 140.46 33.13 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.19 -179.13 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 744' ' ' LEU . . . . . 0.535 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 57.0 tp -118.76 103.65 9.85 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.353 177.437 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 745' ' ' GLU . . . . . 0.444 ' H ' ' CD ' ' A' ' 745' ' ' GLU . 0.1 OUTLIER -87.69 109.22 19.53 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.855 179.295 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 746' ' ' PHE . . . . . 0.412 ' HA ' ' HD3' ' A' ' 747' ' ' PRO . 75.3 m-85 -77.01 148.3 78.41 Favored Pre-proline 0 C--N 1.321 -0.669 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.36 178.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 747' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 746' ' ' PHE . 25.5 Cg_exo -62.66 151.14 85.24 Favored 'Trans proline' 0 CA--C 1.529 0.263 0 C-N-CA 122.711 2.274 . . . . 0.0 112.237 179.348 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -65.76 -7.4 16.46 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.781 2.321 . . . . 0.0 112.619 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 41.6 t -68.63 -17.64 64.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.953 178.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.1 mp -66.07 110.69 3.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.919 173.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -82.08 -176.93 6.4 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 175.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 14.6 m -49.59 -48.56 48.75 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -174.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 753' ' ' HIS . . . . . 0.457 ' O ' ' HG2' ' A' ' 757' ' ' ARG . 37.4 t-80 -56.73 -46.84 81.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.508 178.099 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 754' ' ' ASP . . . . . 0.467 ' HB3' ' CZ ' ' A' ' 729' ' ' PHE . 58.9 m-20 -65.34 -46.63 79.48 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.803 -176.021 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 80.8 mtt180 -59.66 -45.64 91.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.672 177.385 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 756' ' ' LEU . . . . . 0.413 HD13 ' C ' ' A' ' 756' ' ' LEU . 3.2 tm? -54.75 -45.82 74.21 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.768 179.173 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 757' ' ' ARG . . . . . 0.457 ' HG2' ' O ' ' A' ' 753' ' ' HIS . 31.1 mmm180 -54.69 -50.34 68.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.213 -0.448 . . . . 0.0 109.868 177.332 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 758' ' ' VAL . . . . . 0.507 HG13 HD11 ' A' ' 733' ' ' ILE . 73.6 t -59.24 -48.0 88.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.01 178.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 88.4 m-70 -54.74 -58.83 5.97 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.444 -0.343 . . . . 0.0 110.87 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -60.05 -36.23 76.85 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -177.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 91.5 mt -70.78 -48.43 57.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 C-N-CA 121.123 -0.231 . . . . 0.0 111.133 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -65.45 -34.32 78.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.208 0.528 . . . . 0.0 110.273 179.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -63.5 -37.27 86.66 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.241 176.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -74.0 -39.44 63.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.557 178.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 10.4 m170 -69.7 -22.18 63.43 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.36 179.369 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 89.37 23.39 34.35 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.112 179.047 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 72.2 mt -93.26 -179.38 5.05 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 -179.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 768' ' ' ARG . . . . . 0.408 ' HE ' ' HB3' ' A' ' 783' ' ' SER . 61.2 ttp180 -104.68 127.97 52.6 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 177.385 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 5.5 p80 -135.27 130.0 34.46 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.024 0.44 . . . . 0.0 110.681 -176.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -149.08 155.67 41.08 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.276 -178.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 15.8 m . . . . . 0 C--N 1.32 -0.706 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.724 -177.315 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 779' ' ' PHE . . . . . 0.401 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 40.7 p90 . . . . . 0 N--CA 1.45 -0.461 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 11.5 tt -125.41 135.02 65.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-O 121.076 0.465 . . . . 0.0 110.678 -178.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 25.0 m -119.3 120.64 37.56 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.406 -179.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . 0.406 ' O ' ' HA ' ' A' ' 743' ' ' GLN . 46.9 t -101.13 133.73 43.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.967 178.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 783' ' ' SER . . . . . 0.408 ' HB3' ' HE ' ' A' ' 768' ' ' ARG . 48.4 t -121.26 140.48 51.99 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 784' ' ' LYS . . . . . 0.509 ' HE2' ' O ' ' A' ' 741' ' ' LYS . 51.3 mtmt . . . . . 0 C--N 1.321 -0.636 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.614 -178.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 48.1 t60 . . . . . 0 CA--C 1.529 0.147 0 CA-C-O 120.89 0.376 . . . . 0.0 111.062 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 29.9 m-85 -72.9 -30.74 64.16 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.46 -175.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 16.6 tpp85 -61.63 -45.91 92.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.088 173.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -62.24 -46.72 87.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.95 179.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 22.7 mmm -62.11 -39.44 92.54 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.313 -179.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 733' ' ' ILE . . . . . 0.436 ' O ' ' HG3' ' A' ' 737' ' ' MET . 57.9 mt -75.84 -41.33 39.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -178.371 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 8.4 p -66.82 -34.08 67.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 C-N-CA 120.936 -0.305 . . . . 0.0 111.066 -177.605 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 61.7 mt-10 -76.97 -31.54 56.62 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.011 0.434 . . . . 0.0 110.087 175.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 736' ' ' PHE . . . . . 0.461 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 37.6 t80 -63.03 -37.29 86.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.522 178.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 737' ' ' MET . . . . . 0.436 ' HG3' ' O ' ' A' ' 733' ' ' ILE . 52.3 mtm -61.84 -26.51 68.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.944 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -101.65 4.08 40.44 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.122 0.486 . . . . 0.0 111.088 -178.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 40.2 t -88.99 166.63 13.78 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.974 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 30.2 mtpp -87.33 -10.37 52.4 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.861 0.362 . . . . 0.0 110.398 178.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 29.3 mtpp -67.6 124.46 23.32 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.269 177.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 22.9 ptp -75.37 -27.23 59.06 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.492 178.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -137.69 136.53 37.49 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.402 -178.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 744' ' ' LEU . . . . . 0.461 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 34.5 tp -106.89 104.99 14.8 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.19 -0.671 . . . . 0.0 109.19 176.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -87.76 104.6 16.71 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.979 -178.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 746' ' ' PHE . . . . . 0.406 ' HA ' ' HD3' ' A' ' 747' ' ' PRO . 68.2 m-85 -78.41 155.01 79.28 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.351 179.055 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 747' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 746' ' ' PHE . 14.5 Cg_exo -70.04 152.69 67.96 Favored 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 122.358 2.039 . . . . 0.0 111.892 176.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -65.83 -4.53 10.13 Favored 'Trans proline' 0 CA--C 1.529 0.244 0 C-N-CA 122.897 2.398 . . . . 0.0 112.394 178.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 11.6 m -67.57 -18.35 64.98 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.065 177.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 11.0 mp -70.4 109.29 4.68 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.983 -0.376 . . . . 0.0 109.983 175.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -78.2 -178.03 5.43 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 -179.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 20.0 m -52.85 -41.05 63.91 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 111.64 0.237 . . . . 0.0 111.64 -178.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 65.5 m170 -68.93 -44.35 73.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.499 0.19 . . . . 0.0 110.97 179.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -58.28 -49.01 78.64 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.156 0.503 . . . . 0.0 110.143 177.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 755' ' ' ARG . . . . . 0.44 HH11 ' HD3' ' A' ' 755' ' ' ARG . 24.0 mtm180 -63.72 -43.3 96.96 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.833 -179.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 54.4 tp -54.91 -42.35 72.08 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.872 0.367 . . . . 0.0 111.024 179.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 757' ' ' ARG . . . . . 0.434 ' HA ' ' NE ' ' A' ' 757' ' ' ARG . 1.9 mmp_? -62.9 -47.07 84.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.519 176.233 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 758' ' ' VAL . . . . . 0.468 ' CG1' HD13 ' A' ' 780' ' ' ILE . 99.7 t -59.5 -48.05 88.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.895 179.341 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 88.6 m-70 -55.27 -55.41 31.68 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 120.843 0.354 . . . . 0.0 110.438 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -62.43 -38.61 90.4 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.962 -178.223 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 85.2 mt -67.43 -44.97 86.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 C-N-CA 121.144 -0.222 . . . . 0.0 111.081 178.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -65.9 -36.91 84.7 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.18 0.514 . . . . 0.0 110.353 178.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -67.07 -33.38 75.37 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.825 175.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -71.5 -40.18 70.34 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.593 178.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -71.86 -30.66 65.67 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.136 176.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 96.15 31.97 6.98 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.717 -0.754 . . . . 0.0 111.945 -179.12 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 61.5 mt -104.75 -178.96 3.81 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 50.6 ttt180 -100.6 142.85 31.5 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 177.276 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.7 p80 -149.17 141.64 24.29 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.861 0.362 . . . . 0.0 110.785 -178.146 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -160.14 152.42 20.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.696 179.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 6.4 m . . . . . 0 C--N 1.32 -0.686 0 CA-C-O 121.25 0.547 . . . . 0.0 110.904 -177.803 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 49.9 p90 . . . . . 0 N--CA 1.447 -0.578 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 780' ' ' ILE . . . . . 0.468 HD13 ' CG1' ' A' ' 758' ' ' VAL . 17.1 tt -118.04 140.12 42.58 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 C-N-CA 120.405 -0.518 . . . . 0.0 110.905 -179.02 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 25.1 m -121.64 117.98 28.05 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.883 -0.598 . . . . 0.0 109.944 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 22.1 t -100.95 133.95 42.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 179.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 20.0 p -124.09 143.09 50.66 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.391 0.615 . . . . 0.0 110.964 178.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 56.2 mtpt . . . . . 0 C--N 1.326 -0.455 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.421 -177.056 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 728' ' ' HIS . . . . . 0.519 ' O ' ' HG3' ' A' ' 732' ' ' MET . 14.0 t60 . . . . . 0 C--O 1.233 0.231 0 CA-C-O 121.094 0.473 . . . . 0.0 110.155 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -77.88 -29.9 50.53 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.857 -176.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 44.6 ttm-85 -66.06 -37.88 86.93 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 176.416 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -65.84 -41.34 91.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.397 176.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 732' ' ' MET . . . . . 0.519 ' HG3' ' O ' ' A' ' 728' ' ' HIS . 93.5 mtp -63.81 -42.47 97.68 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.428 178.356 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 59.5 mt -71.51 -42.25 72.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.172 -0.467 . . . . 0.0 112.023 -178.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 11.4 p -65.3 -41.31 91.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 C-N-CA 120.784 -0.366 . . . . 0.0 111.162 -176.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -70.85 -33.09 70.29 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.963 0.411 . . . . 0.0 110.291 176.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 736' ' ' PHE . . . . . 0.497 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 11.7 t80 -59.97 -36.99 78.32 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.013 176.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 737' ' ' MET . . . . . 0.63 ' HA ' ' HD3' ' A' ' 784' ' ' LYS . 69.9 mtm -64.16 -32.28 73.8 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.62 177.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -92.4 9.12 35.55 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.791 0.329 . . . . 0.0 111.1 178.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 55.7 m -101.02 167.37 10.29 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.762 0.315 . . . . 0.0 110.87 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 740' ' ' LYS . . . . . 0.427 ' NZ ' ' HB2' ' A' ' 740' ' ' LYS . 0.1 OUTLIER -73.9 -30.02 62.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.179 -179.241 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -58.38 127.9 34.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.768 178.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 69.9 mtm -95.93 -10.62 28.26 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.84 0.353 . . . . 0.0 110.626 178.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 743' ' ' GLN . . . . . 0.41 ' HA ' ' O ' ' A' ' 782' ' ' VAL . 3.7 pt20 -139.67 126.85 21.17 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.063 174.285 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 744' ' ' LEU . . . . . 0.497 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 48.0 tp -102.1 105.69 16.45 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -87.25 105.68 17.39 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.744 178.276 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 746' ' ' PHE . . . . . 0.439 ' HA ' ' HD3' ' A' ' 747' ' ' PRO . 70.6 m-85 -76.04 146.07 78.27 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.821 -178.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 747' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 746' ' ' PHE . 33.1 Cg_exo -62.38 152.36 77.33 Favored 'Trans proline' 0 C--O 1.234 0.285 0 C-N-CA 122.971 2.448 . . . . 0.0 112.51 177.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -65.84 -3.93 9.08 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 123.143 2.562 . . . . 0.0 112.62 177.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 13.8 m -66.56 -25.16 66.51 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.721 176.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.1 mp -71.35 112.27 7.35 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.221 176.336 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 751' ' ' ASN . . . . . 0.434 ' O ' ' HG3' ' A' ' 755' ' ' ARG . 1.6 p-10 -86.31 -177.59 6.26 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 178.237 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 10.8 m -52.18 -45.46 65.13 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 112.592 0.589 . . . . 0.0 112.592 -170.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 33.2 m170 -66.7 -40.35 88.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.653 0.263 . . . . 0.0 111.62 -179.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -67.23 -41.56 85.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.926 0.393 . . . . 0.0 110.55 178.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 755' ' ' ARG . . . . . 0.434 ' HG3' ' O ' ' A' ' 751' ' ' ASN . 43.7 mtm-85 -64.35 -39.28 93.58 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.945 177.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 62.9 tp -54.34 -45.23 72.65 Favored 'General case' 0 C--N 1.332 -0.191 0 O-C-N 123.474 0.484 . . . . 0.0 110.855 176.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 7.7 mmt85 -55.41 -50.06 70.76 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.484 175.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 84.8 t -58.58 -48.32 85.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.02 179.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -56.28 -52.32 64.95 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.707 179.093 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -60.36 -41.7 94.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.753 -177.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 95.0 mt -68.82 -46.79 78.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.192 -179.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -63.54 -35.63 81.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.319 0.581 . . . . 0.0 110.021 178.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -63.5 -39.86 95.56 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.361 176.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -68.3 -44.75 74.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.839 178.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 27.1 m-70 -73.98 -21.44 60.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.61 -176.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 90.3 39.41 6.03 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.251 177.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 64.6 mt -111.12 169.62 8.65 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 178.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 37.3 ttm180 -90.05 132.08 35.58 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 177.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.8 p80 -138.82 136.63 35.83 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 120.726 0.298 . . . . 0.0 110.482 -177.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -162.4 147.67 12.53 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.523 177.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 771' ' ' SER . . . . . 0.466 ' HA ' ' HA ' ' A' ' 780' ' ' ILE . 9.7 m . . . . . 0 N--CA 1.445 -0.681 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.263 178.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 50.8 p90 . . . . . 0 N--CA 1.452 -0.357 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 780' ' ' ILE . . . . . 0.466 ' HA ' ' HA ' ' A' ' 771' ' ' SER . 11.9 tt -114.77 133.65 60.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-O 121.184 0.516 . . . . 0.0 111.039 -176.595 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 34.5 m -115.6 124.03 49.92 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.328 178.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . 0.41 ' O ' ' HA ' ' A' ' 743' ' ' GLN . 59.1 t -103.61 119.7 52.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.692 176.67 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 13.9 m -113.41 133.64 55.07 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 121.049 0.452 . . . . 0.0 111.011 -176.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 784' ' ' LYS . . . . . 0.63 ' HD3' ' HA ' ' A' ' 737' ' ' MET . 56.8 mtmt . . . . . 0 C--N 1.325 -0.484 0 CA-C-O 121.83 0.824 . . . . 0.0 110.354 177.173 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 46.0 t60 . . . . . 0 N--CA 1.461 0.113 0 CA-C-O 121.294 0.569 . . . . 0.0 109.532 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -72.06 -26.09 62.04 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.261 -177.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -65.77 -42.66 90.58 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 176.628 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -68.17 -46.05 71.77 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.629 177.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 35.5 mmm -56.96 -45.12 83.07 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.285 178.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 38.7 mt -67.28 -44.69 87.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.891 -177.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 12.4 p -66.75 -36.12 76.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 C-N-CA 120.298 -0.561 . . . . 0.0 111.015 -177.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 735' ' ' GLU . . . . . 0.404 ' O ' ' HB2' ' A' ' 739' ' ' SER . 45.4 mt-10 -71.88 -28.22 63.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.148 0.499 . . . . 0.0 110.402 176.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 736' ' ' PHE . . . . . 0.431 ' CE2' ' HG3' ' A' ' 784' ' ' LYS . 23.4 t80 -71.18 -40.55 71.19 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.287 174.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 87.2 mtp -62.37 -41.68 98.81 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.099 179.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -80.88 -6.05 58.15 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.278 -179.388 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 739' ' ' SER . . . . . 0.404 ' HB2' ' O ' ' A' ' 735' ' ' GLU . 14.7 t -92.91 167.33 11.9 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.593 -177.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -75.47 -9.68 58.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.817 178.218 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 741' ' ' LYS . . . . . 0.462 ' O ' ' HD3' ' A' ' 784' ' ' LYS . 61.9 mttp -61.35 133.6 56.01 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.538 -178.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 62.7 mtt -99.94 -17.36 17.6 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.076 177.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -144.71 140.53 28.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.155 175.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 744' ' ' LEU . . . . . 0.486 HD13 ' CZ ' ' A' ' 746' ' ' PHE . 0.8 OUTLIER -113.65 108.43 17.12 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 -179.935 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -85.63 96.35 9.64 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.439 176.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 746' ' ' PHE . . . . . 0.486 ' CZ ' HD13 ' A' ' 744' ' ' LEU . 61.1 m-85 -71.12 146.84 93.08 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.28 177.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -65.92 150.89 85.35 Favored 'Trans proline' 0 CA--C 1.529 0.247 0 C-N-CA 122.637 2.224 . . . . 0.0 112.509 -179.293 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -63.74 -6.22 10.33 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.845 2.363 . . . . 0.0 112.362 175.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 34.4 t -61.4 -25.18 67.02 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.077 174.155 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.1 mp -65.2 109.44 2.21 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.816 176.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -80.06 -177.37 6.0 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 173.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 20.0 m -57.68 -43.71 85.25 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -171.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 35.0 m80 -63.92 -39.82 95.04 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 120.954 0.406 . . . . 0.0 110.774 179.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -63.03 -49.03 76.2 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.706 178.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 63.8 mtt85 -57.6 -49.29 76.89 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.549 177.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 756' ' ' LEU . . . . . 0.401 ' HG ' ' NE2' ' A' ' 760' ' ' GLN . 60.5 tp -54.72 -39.73 68.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.303 -179.009 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 23.8 tpt180 -65.04 -39.19 92.99 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.055 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 96.3 t -64.4 -50.98 73.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.752 176.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -53.8 -48.81 69.48 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 123.453 0.47 . . . . 0.0 110.243 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 760' ' ' GLN . . . . . 0.401 ' NE2' ' HG ' ' A' ' 756' ' ' LEU . 69.9 mt-30 -50.96 -51.27 54.19 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.888 176.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 88.5 mt -69.98 -42.33 79.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.439 -174.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -66.21 -38.16 87.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.075 0.464 . . . . 0.0 110.453 179.571 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -67.05 -36.64 82.5 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.127 177.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -65.76 -49.28 68.93 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.533 176.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 13.8 m170 -69.8 -29.42 66.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.636 -175.608 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 100.67 36.14 4.11 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.457 -0.877 . . . . 0.0 112.451 177.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 63.9 mt -111.85 170.64 8.01 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 32.5 ttp180 -89.89 136.52 32.99 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 178.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 5.5 p80 -137.45 121.95 18.39 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-O 121.464 0.65 . . . . 0.0 110.499 -179.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -144.1 153.76 42.49 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.239 -0.892 . . . . 0.0 109.971 -178.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 10.7 m . . . . . 0 C--N 1.319 -0.747 0 CA-C-O 121.041 0.448 . . . . 0.0 110.57 -179.1 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 44.1 p90 . . . . . 0 N--CA 1.448 -0.545 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 12.8 tt -104.09 133.82 47.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-O 121.163 0.506 . . . . 0.0 110.562 -178.571 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 781' ' ' THR . . . . . 0.456 ' HA ' ' O ' ' A' ' 744' ' ' LEU . 17.7 m -118.1 112.55 20.36 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.263 179.687 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 45.3 t -90.91 130.51 39.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 177.076 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 12.8 t -125.3 141.54 52.02 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.444 0.64 . . . . 0.0 111.492 -175.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 784' ' ' LYS . . . . . 0.462 ' HD3' ' O ' ' A' ' 741' ' ' LYS . 55.4 mtpt . . . . . 0 CA--C 1.511 -0.523 0 CA-C-O 122.392 1.092 . . . . 0.0 108.7 175.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 27.4 t60 . . . . . 0 N--CA 1.453 -0.289 0 CA-C-O 120.778 0.323 . . . . 0.0 110.641 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -70.04 -32.03 69.96 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.209 -173.389 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 -58.62 -49.7 76.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.141 0.496 . . . . 0.0 109.828 174.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -61.62 -48.58 80.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.805 178.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 46.8 mmm -56.38 -39.79 73.53 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.599 -179.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 43.0 mt -70.72 -49.15 53.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 12.9 p -65.52 -36.36 77.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 C-N-CA 120.732 -0.387 . . . . 0.0 111.08 -176.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -71.65 -32.29 67.75 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 121.089 0.471 . . . . 0.0 110.423 177.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 736' ' ' PHE . . . . . 0.574 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 24.4 t80 -65.59 -36.54 84.06 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.518 175.596 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 737' ' ' MET . . . . . 0.513 ' HA ' ' HD3' ' A' ' 784' ' ' LYS . 84.9 mtp -65.83 -27.1 68.0 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.331 176.633 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -91.71 -0.62 57.57 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.743 178.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 24.3 t -97.0 168.15 10.64 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.584 -178.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 740' ' ' LYS . . . . . 0.574 ' HA ' ' HE2' ' A' ' 740' ' ' LYS . 11.0 mmpt? -84.6 -11.59 55.71 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.186 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 741' ' ' LYS . . . . . 0.474 ' O ' ' HE2' ' A' ' 784' ' ' LYS . 59.9 mttp -67.31 129.57 40.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.112 177.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 70.2 mtm -91.09 -17.83 25.55 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.648 177.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -136.13 130.06 32.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.605 179.121 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 744' ' ' LEU . . . . . 0.574 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 45.8 tp -112.95 109.0 18.14 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.786 177.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -94.36 110.14 21.93 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.158 -178.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 746' ' ' PHE . . . . . 0.52 ' O ' ' HB2' ' A' ' 779' ' ' PHE . 72.2 m-85 -80.53 156.56 73.23 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.158 -178.444 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 747' ' ' PRO . . . . . 0.435 ' O ' HD13 ' A' ' 750' ' ' LEU . 40.2 Cg_exo -58.9 156.33 33.9 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.966 2.444 . . . . 0.0 112.565 177.353 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -74.19 -11.76 23.15 Favored 'Trans proline' 0 CA--C 1.53 0.295 0 C-N-CA 122.764 2.309 . . . . 0.0 112.77 178.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 17.6 m -71.59 -12.61 61.44 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.989 -0.55 . . . . 0.0 112.354 -176.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 750' ' ' LEU . . . . . 0.435 HD13 ' O ' ' A' ' 747' ' ' PRO . 11.2 mp -61.22 121.53 12.79 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 110.416 -0.216 . . . . 0.0 110.416 176.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 751' ' ' ASN . . . . . 0.571 ' O ' ' HG2' ' A' ' 755' ' ' ARG . 2.0 p30 -80.38 176.92 9.35 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 179.495 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 14.4 t -53.6 -37.26 62.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.913 0.387 . . . . 0.0 111.352 -177.04 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 73.8 m80 -76.07 -27.87 57.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.976 -179.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -72.25 -40.37 67.73 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 175.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 755' ' ' ARG . . . . . 0.571 ' HG2' ' O ' ' A' ' 751' ' ' ASN . 33.1 mmt180 -56.69 -58.58 7.45 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.51 175.181 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 62.0 tp -54.16 -38.63 65.74 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 114.871 -1.059 . . . . 0.0 111.045 -178.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 26.5 tpt180 -57.45 -48.53 78.9 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 120.996 0.427 . . . . 0.0 110.187 178.034 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 79.8 t -65.79 -46.54 88.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.838 179.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -56.05 -50.89 69.71 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.903 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -55.52 -47.98 75.39 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.407 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 96.6 mt -67.58 -49.1 73.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.523 -176.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -63.34 -30.77 71.84 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.224 0.535 . . . . 0.0 110.67 -178.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -70.71 -37.75 73.59 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.768 177.273 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -68.57 -36.99 79.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.361 0.6 . . . . 0.0 110.243 178.291 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 12.0 m170 -74.89 -23.12 58.33 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.438 177.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 84.68 44.4 6.46 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.936 -0.65 . . . . 0.0 112.272 178.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 82.0 mt -111.86 177.63 4.58 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 178.093 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 75.4 ttt180 -96.72 133.47 41.22 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 5.7 p80 -145.92 133.39 20.8 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.079 0.466 . . . . 0.0 111.555 -176.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -170.56 164.59 8.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.215 -0.902 . . . . 0.0 108.976 176.184 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 771' ' ' SER . . . . . 0.471 ' HA ' ' HA ' ' A' ' 780' ' ' ILE . 14.3 m . . . . . 0 C--N 1.32 -0.704 0 CA-C-O 121.357 0.599 . . . . 0.0 112.035 -173.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 779' ' ' PHE . . . . . 0.52 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 37.7 p90 . . . . . 0 N--CA 1.451 -0.409 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 780' ' ' ILE . . . . . 0.471 ' HA ' ' HA ' ' A' ' 771' ' ' SER . 10.8 tt -83.93 135.33 25.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 121.201 0.525 . . . . 0.0 110.826 -176.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 35.2 m -120.38 119.82 34.2 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.479 -179.27 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 43.1 t -95.97 125.12 48.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.322 176.311 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 34.3 t -119.29 130.27 55.32 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.322 0.582 . . . . 0.0 110.789 -176.416 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 784' ' ' LYS . . . . . 0.513 ' HD3' ' HA ' ' A' ' 737' ' ' MET . 48.0 mtmt . . . . . 0 C--N 1.32 -0.679 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 172.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 29.9 t60 . . . . . 0 N--CA 1.463 0.207 0 CA-C-O 121.485 0.66 . . . . 0.0 109.391 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 44.7 m-85 -75.15 -26.76 59.38 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.692 -176.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 23.6 ttt180 -71.22 -36.59 71.91 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 178.32 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -66.39 -42.66 87.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.177 175.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 12.3 mmm -62.0 -40.91 97.28 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.131 176.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 733' ' ' ILE . . . . . 0.449 ' O ' ' HG3' ' A' ' 737' ' ' MET . 49.3 mt -69.22 -44.11 80.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.684 -179.149 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 11.4 p -63.99 -37.01 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 C-N-CA 120.564 -0.454 . . . . 0.0 110.994 -177.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -74.62 -27.26 60.38 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.05 0.452 . . . . 0.0 110.472 176.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 736' ' ' PHE . . . . . 0.553 ' CE1' ' HB2' ' A' ' 744' ' ' LEU . 26.9 t80 -69.36 -35.89 76.31 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.531 175.135 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 737' ' ' MET . . . . . 0.449 ' HG3' ' O ' ' A' ' 733' ' ' ILE . 86.2 mtp -64.27 -39.72 94.5 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.58 178.018 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -78.97 -23.49 44.48 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.54 178.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 33.1 t -73.54 164.13 27.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.465 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 45.2 mtmt -78.54 -22.38 47.33 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.621 -177.023 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 56.1 mtmt -55.43 128.32 33.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.658 -175.138 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 27.0 ptm -86.66 -18.96 29.98 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.898 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 19.8 mm-40 -135.71 139.01 43.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.313 178.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 744' ' ' LEU . . . . . 0.553 ' HB2' ' CE1' ' A' ' 736' ' ' PHE . 37.3 tp -118.44 108.67 15.31 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 176.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -92.27 112.15 23.98 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.049 -178.144 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -88.34 145.15 35.14 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.568 178.044 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 747' ' ' PRO . . . . . 0.447 ' HA ' ' HD3' ' A' ' 748' ' ' PRO . 23.0 Cg_exo -65.0 152.53 82.08 Favored 'Trans proline' 0 N--CA 1.463 -0.313 0 C-N-CA 122.638 2.225 . . . . 0.0 112.037 177.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 748' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 747' ' ' PRO . 13.3 Cg_exo -68.68 -7.32 20.15 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 123.126 2.55 . . . . 0.0 111.462 177.493 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 5.6 m -59.61 -21.4 60.35 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.685 173.013 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.8 mp -73.34 115.4 12.65 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.865 173.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 10.9 p30 -82.7 -178.56 7.13 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 178.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 65.1 m -58.81 -29.0 66.53 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -175.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 54.2 t-80 -71.52 -45.04 63.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.894 0.378 . . . . 0.0 110.087 177.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 754' ' ' ASP . . . . . 0.411 ' O ' HG23 ' A' ' 758' ' ' VAL . 70.9 m-20 -61.49 -51.09 70.09 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.036 178.346 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 22.3 mtm180 -57.96 -43.58 86.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.806 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 51.5 tp -55.45 -41.96 73.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.466 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 19.0 mmm180 -63.77 -47.43 81.0 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.998 -0.281 . . . . 0.0 110.465 176.088 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 758' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 754' ' ' ASP . 61.9 t -56.48 -46.31 82.21 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.97 179.64 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 87.3 m-70 -56.7 -53.68 54.91 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.648 178.024 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -59.44 -40.42 86.76 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.69 -178.045 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 95.6 mt -65.29 -53.78 36.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.106 -179.639 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -62.0 -36.82 82.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.176 0.512 . . . . 0.0 110.597 -179.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -64.84 -31.58 72.88 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.915 177.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -81.86 -36.75 27.9 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.66 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 11.3 m170 -74.57 -23.01 58.7 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.215 179.436 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 95.85 31.09 7.55 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.577 -0.82 . . . . 0.0 112.52 177.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 66.3 mt -108.65 -176.56 3.08 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 110.267 -0.272 . . . . 0.0 110.267 -178.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 768' ' ' ARG . . . . . 0.433 ' HB3' ' HB3' ' A' ' 783' ' ' SER . 17.4 ttm180 -100.95 135.62 42.11 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.439 177.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 7.2 p80 -144.65 135.3 24.66 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.936 -178.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -164.54 150.09 10.24 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.48 177.444 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 771' ' ' SER . . . . . 0.427 ' HA ' ' HA ' ' A' ' 780' ' ' ILE . 3.8 m . . . . . 0 N--CA 1.446 -0.644 0 CA-C-O 120.932 0.396 . . . . 0.0 110.297 179.112 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 38.8 p90 . . . . . 0 N--CA 1.452 -0.359 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 780' ' ' ILE . . . . . 0.427 ' HA ' ' HA ' ' A' ' 771' ' ' SER . 13.3 tt -107.17 134.03 50.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-O 121.057 0.456 . . . . 0.0 111.147 -175.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 5.7 m -118.36 124.25 47.28 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.023 178.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 43.3 t -107.28 127.0 63.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.767 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 783' ' ' SER . . . . . 0.433 ' HB3' ' HB3' ' A' ' 768' ' ' ARG . 22.8 t -112.47 147.16 37.1 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 120.821 0.344 . . . . 0.0 110.493 -178.716 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 784' ' ' LYS . . . . . 0.409 ' HD3' ' HA ' ' A' ' 737' ' ' MET . 17.7 mtmm . . . . . 0 C--N 1.325 -0.472 0 CA-C-O 121.421 0.629 . . . . 0.0 110.073 173.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 18.1 t60 . . . . . 0 C--O 1.233 0.228 0 CA-C-O 120.727 0.298 . . . . 0.0 111.289 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -75.07 -36.85 61.76 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.462 -176.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 27.7 ttm-85 -61.8 -42.36 98.91 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.765 0.316 . . . . 0.0 110.383 175.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -60.44 -45.73 92.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.815 179.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 31.8 mtm -68.52 -33.32 73.92 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.236 -179.286 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 733' ' ' ILE . . . . . 0.542 ' O ' ' HG3' ' A' ' 737' ' ' MET . 58.3 mt -70.34 -49.31 54.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 N-CA-C 111.339 0.126 . . . . 0.0 111.339 178.499 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 13.0 p -62.86 -34.65 67.22 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 120.801 -0.36 . . . . 0.0 110.829 -177.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -70.6 -41.61 72.06 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.021 0.439 . . . . 0.0 110.142 175.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 736' ' ' PHE . . . . . 0.517 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 44.1 t80 -57.59 -35.47 70.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.33 177.777 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 737' ' ' MET . . . . . 0.542 ' HG3' ' O ' ' A' ' 733' ' ' ILE . 87.6 mtp -61.34 -32.89 72.78 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.824 178.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -96.01 -7.18 37.04 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.278 -179.457 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 64.3 m -82.78 168.47 17.14 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.082 -177.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 740' ' ' LYS . . . . . 0.449 ' NZ ' ' HB2' ' A' ' 740' ' ' LYS . 4.4 ttmp? -81.29 -21.85 39.04 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.435 -178.69 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -62.83 127.9 33.41 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.668 179.294 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 25.6 ptt? -88.86 -17.22 30.11 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.617 178.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 28.2 mt-30 -139.05 119.65 14.03 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.139 -178.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 744' ' ' LEU . . . . . 0.517 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 49.1 tp -101.03 105.24 16.43 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.334 176.334 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -89.67 115.89 27.38 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.305 -179.204 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 746' ' ' PHE . . . . . 0.488 ' HB2' HG23 ' A' ' 780' ' ' ILE . 58.5 m-85 -88.27 145.6 36.22 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.934 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -58.28 153.79 44.6 Favored 'Trans proline' 0 CA--C 1.533 0.441 0 C-N-CA 123.178 2.585 . . . . 0.0 112.771 178.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -69.61 -9.37 26.0 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.922 2.415 . . . . 0.0 112.936 -179.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 2.3 p -69.24 -24.07 63.95 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.878 -178.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.8 mp -55.7 117.49 3.68 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.256 175.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -76.68 174.73 10.08 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 13.7 t -55.35 -32.53 62.63 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.649 0.24 . . . . 0.0 111.649 -175.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 40.2 m80 -79.43 -31.86 42.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.456 0.17 . . . . 0.0 110.962 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -66.32 -45.37 80.52 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 174.447 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 63.3 mtt-85 -62.6 -47.42 83.88 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.733 177.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 62.5 tp -55.04 -40.6 70.41 Favored 'General case' 0 N--CA 1.464 0.272 0 O-C-N 123.346 0.404 . . . . 0.0 110.877 179.103 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 27.9 tpt180 -56.87 -51.0 70.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.915 176.011 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 99.1 t -60.51 -49.67 83.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.258 178.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 759' ' ' HIS . . . . . 0.419 ' O ' ' HB2' ' A' ' 763' ' ' GLU . 89.8 m-70 -53.79 -51.2 64.22 Favored 'General case' 0 N--CA 1.463 0.192 0 O-C-N 123.302 0.376 . . . . 0.0 110.635 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -60.59 -44.19 96.52 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -178.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 98.1 mt -66.3 -49.31 76.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.756 0.313 . . . . 0.0 110.963 -177.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -64.32 -32.74 74.47 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.945 0.402 . . . . 0.0 110.59 -179.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 763' ' ' GLU . . . . . 0.419 ' HB2' ' O ' ' A' ' 759' ' ' HIS . 27.3 tt0 -66.01 -37.03 84.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.407 178.612 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 13.7 tp10 -75.0 -43.26 54.88 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.676 177.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 10.6 m-70 -69.22 -24.89 64.08 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.434 -176.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 99.45 29.91 6.82 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.496 -0.859 . . . . 0.0 113.14 174.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 767' ' ' LEU . . . . . 0.423 HD11 ' HG2' ' A' ' 737' ' ' MET . 54.3 mt -107.59 170.76 7.78 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 176.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 30.5 ttt180 -96.55 139.89 31.97 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 119.616 -0.834 . . . . 0.0 109.745 175.143 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.5 p80 -137.19 131.71 32.87 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.428 -0.806 . . . . 0.0 109.837 -176.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -159.62 144.91 15.56 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.306 -179.379 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 771' ' ' SER . . . . . 0.455 ' HA ' ' HA ' ' A' ' 780' ' ' ILE . 8.8 t . . . . . 0 N--CA 1.448 -0.569 0 CA-C-O 121.45 0.643 . . . . 0.0 110.084 178.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 779' ' ' PHE . . . . . 0.465 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 14.3 p90 . . . . . 0 N--CA 1.452 -0.352 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 780' ' ' ILE . . . . . 0.488 HG23 ' HB2' ' A' ' 746' ' ' PHE . 6.2 tt -103.9 130.17 54.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-O 121.138 0.494 . . . . 0.0 110.107 179.079 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 27.1 m -111.13 120.36 42.04 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.449 -179.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 55.8 t -96.42 118.68 43.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 173.066 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 53.9 p -113.61 137.81 51.07 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.458 -177.027 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 59.0 mtpt . . . . . 0 C--N 1.321 -0.633 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 172.68 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 9.7 t60 . . . . . 0 N--CA 1.46 0.064 0 CA-C-O 121.076 0.465 . . . . 0.0 110.792 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 40.6 m-85 -75.56 -31.3 59.98 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.371 -172.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 40.0 ttt-85 -59.77 -45.7 91.45 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.18 174.236 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -61.12 -42.53 98.7 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.536 -179.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 32.8 mmm -62.54 -39.09 92.49 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.925 178.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 733' ' ' ILE . . . . . 0.506 ' O ' ' HB3' ' A' ' 736' ' ' PHE . 68.1 mt -77.76 -39.57 26.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -177.678 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 10.8 p -65.16 -37.69 80.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.817 -178.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -78.19 -29.35 48.43 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 120.811 -0.355 . . . . 0.0 110.37 176.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 736' ' ' PHE . . . . . 0.544 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 29.2 t80 -52.88 -44.79 67.11 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.873 175.281 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 71.1 mtm -67.13 -23.21 65.78 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.732 -179.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -97.09 -9.63 27.63 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.696 0.284 . . . . 0.0 111.529 -178.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 50.7 m -90.01 2.55 55.04 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.604 -177.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 740' ' ' LYS . . . . . 0.446 ' O ' ' HG2' ' A' ' 740' ' ' LYS . 61.5 tttp 65.4 9.76 6.0 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.257 0.551 . . . . 0.0 111.03 -179.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 62.4 mttm -68.27 129.78 40.95 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.625 179.118 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.08 -25.47 47.65 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.064 177.49 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -155.34 148.8 25.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.314 177.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 744' ' ' LEU . . . . . 0.544 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 59.0 tp -124.81 108.27 11.78 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.777 178.642 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -80.78 114.55 19.74 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.91 179.536 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 746' ' ' PHE . . . . . 0.464 ' HB2' HG23 ' A' ' 780' ' ' ILE . 68.1 m-85 -90.93 154.78 45.38 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.354 177.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 747' ' ' PRO . . . . . 0.415 ' O ' HD13 ' A' ' 750' ' ' LEU . 33.8 Cg_exo -59.17 155.36 40.31 Favored 'Trans proline' 0 CA--C 1.533 0.466 0 C-N-CA 122.666 2.244 . . . . 0.0 112.294 176.304 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -75.6 -14.46 19.87 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.653 2.236 . . . . 0.0 112.169 -179.366 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 7.8 p -71.75 -11.08 60.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.594 -175.473 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 750' ' ' LEU . . . . . 0.415 HD13 ' O ' ' A' ' 747' ' ' PRO . 11.1 mp -58.59 113.67 2.12 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 174.091 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 751' ' ' ASN . . . . . 0.578 ' O ' ' HG2' ' A' ' 755' ' ' ARG . 3.1 p30 -75.13 178.94 5.34 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 110.345 -0.243 . . . . 0.0 110.345 -175.325 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 30.2 m -51.76 -42.44 62.37 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 120.606 0.241 . . . . 0.0 111.522 -176.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 70.1 m80 -70.24 -36.98 74.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.106 -179.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 754' ' ' ASP . . . . . 0.43 ' O ' HG23 ' A' ' 758' ' ' VAL . 73.7 m-20 -64.38 -49.47 71.48 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 177.121 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 755' ' ' ARG . . . . . 0.578 ' HG2' ' O ' ' A' ' 751' ' ' ASN . 1.4 mmm-85 -54.36 -57.49 11.08 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.648 178.615 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 66.7 tp -52.29 -41.89 63.28 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 114.978 -1.01 . . . . 0.0 111.901 -178.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -63.09 -45.41 92.21 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 121.195 -0.202 . . . . 0.0 110.73 178.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 758' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 754' ' ' ASP . 93.4 t -60.69 -47.16 94.24 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.728 178.234 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -56.79 -51.48 68.79 Favored 'General case' 0 N--CA 1.462 0.139 0 O-C-N 123.339 0.399 . . . . 0.0 110.206 178.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -54.96 -47.62 74.28 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.671 179.419 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 97.3 mt -63.55 -55.4 23.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.119 -178.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -60.24 -35.13 74.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.968 0.413 . . . . 0.0 110.88 -177.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -66.69 -38.16 86.2 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.144 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -77.22 -36.46 54.68 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.586 0.232 . . . . 0.0 110.448 179.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 9.8 m-70 -65.31 -23.48 67.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.959 0.409 . . . . 0.0 110.709 176.24 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 89.25 35.75 7.91 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.108 177.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 62.9 mt -114.0 177.16 4.74 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.275 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 22.5 ttp180 -95.56 143.92 26.46 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 178.416 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 5.3 p80 -140.32 122.47 15.78 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.092 0.472 . . . . 0.0 110.276 -178.244 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -134.83 155.19 51.07 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.926 -174.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 10.0 m . . . . . 0 C--N 1.313 -0.987 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 172.123 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 11.1 p90 . . . . . 0 C--O 1.234 0.262 0 N-CA-C 109.986 -0.375 . . . . 0.0 109.986 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 780' ' ' ILE . . . . . 0.464 HG23 ' HB2' ' A' ' 746' ' ' PHE . 6.5 tt -126.32 140.26 49.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 120.906 0.384 . . . . 0.0 110.265 177.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 26.3 m -128.23 117.98 22.49 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.656 -179.008 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 49.5 t -86.72 127.86 40.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 174.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 26.2 m -127.83 139.68 52.49 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.345 0.593 . . . . 0.0 112.059 -173.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 784' ' ' LYS . . . . . 0.404 ' HG3' ' CE2' ' A' ' 736' ' ' PHE . 10.0 mtpm? . . . . . 0 C--N 1.326 -0.447 0 CA-C-O 121.93 0.871 . . . . 0.0 109.092 172.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 23.1 t60 . . . . . 0 C--O 1.234 0.25 0 CA-C-O 121.089 0.471 . . . . 0.0 111.392 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -82.41 -37.55 25.37 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.738 -174.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 17.1 tpt180 -55.76 -44.58 77.79 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.975 0.417 . . . . 0.0 109.96 175.721 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 731' ' ' ALA . . . . . 0.432 ' O ' ' HG3' ' A' ' 735' ' ' GLU . . . -63.43 -52.08 63.02 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.872 179.72 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 31.6 mtm -63.63 -33.49 75.74 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.757 -177.433 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 733' ' ' ILE . . . . . 0.404 HD11 HG13 ' A' ' 758' ' ' VAL . 81.2 mt -72.74 -43.13 61.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 -179.898 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 11.9 p -67.98 -36.55 75.96 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.339 -179.204 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 735' ' ' GLU . . . . . 0.432 ' HG3' ' O ' ' A' ' 731' ' ' ALA . 52.4 mt-10 -68.83 -35.84 77.47 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.077 0.465 . . . . 0.0 109.768 175.376 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 736' ' ' PHE . . . . . 0.416 ' CE2' ' HG3' ' A' ' 784' ' ' LYS . 26.8 t80 -61.69 -38.23 87.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.39 178.591 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 737' ' ' MET . . . . . 0.557 ' HA ' ' HD3' ' A' ' 784' ' ' LYS . 42.0 mtm -62.29 -40.23 95.58 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 121.077 -0.249 . . . . 0.0 111.028 179.563 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -81.49 -17.98 46.75 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.948 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 32.7 t -74.08 160.77 30.8 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.905 -178.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 740' ' ' LYS . . . . . 0.555 ' H ' ' HD2' ' A' ' 740' ' ' LYS . 0.0 OUTLIER -77.43 -12.2 59.93 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.819 -178.944 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -67.24 133.29 49.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.154 -0.475 . . . . 0.0 109.859 177.014 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 59.2 mtt -95.76 -20.56 18.77 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.04 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -133.31 124.53 27.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.854 179.268 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 744' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -93.34 97.53 10.65 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 176.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -84.3 101.35 11.87 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.166 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 746' ' ' PHE . . . . . 0.408 ' O ' ' HB2' ' A' ' 779' ' ' PHE . 65.1 m-85 -79.66 154.02 75.94 Favored Pre-proline 0 C--N 1.321 -0.645 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.58 179.29 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -75.27 160.16 39.59 Favored 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 122.759 2.306 . . . . 0.0 111.602 175.049 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -68.14 -4.35 12.46 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.796 2.331 . . . . 0.0 112.612 177.033 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 12.2 p -63.9 -27.13 68.94 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.553 179.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.2 mp -63.22 115.34 4.43 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.466 -0.333 . . . . 0.0 110.552 176.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 751' ' ' ASN . . . . . 0.411 ' O ' ' HG3' ' A' ' 755' ' ' ARG . 2.6 p-10 -91.86 -170.04 2.45 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 174.577 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 12.8 p -46.19 -61.81 1.61 Allowed 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -173.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -55.53 -43.74 76.05 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.412 -178.006 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -62.94 -47.35 83.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.991 -178.286 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 755' ' ' ARG . . . . . 0.411 ' HG3' ' O ' ' A' ' 751' ' ' ASN . 82.8 mtt180 -60.89 -48.22 82.8 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.798 177.345 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 65.3 tp -54.26 -40.98 68.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.059 -179.065 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 9.9 mmt180 -59.02 -48.76 80.41 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.448 175.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 758' ' ' VAL . . . . . 0.404 HG13 HD11 ' A' ' 733' ' ' ILE . 59.3 t -62.27 -48.42 88.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.059 -179.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -57.0 -49.67 75.06 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 110.442 -0.207 . . . . 0.0 110.442 179.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 67.0 mt-30 -56.21 -50.37 71.44 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.599 179.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 95.5 mt -67.32 -46.23 84.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.542 -176.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -62.53 -39.59 94.09 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.838 0.351 . . . . 0.0 110.421 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -65.75 -33.87 76.87 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.58 177.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -73.89 -35.23 64.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.513 178.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 11.3 m170 -79.08 -11.77 60.0 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.389 179.416 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 81.92 21.68 60.89 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.482 179.382 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 71.8 mt -95.06 172.68 7.99 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 -179.183 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 58.0 ttt180 -96.15 132.71 41.27 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.891 0.377 . . . . 0.0 110.226 178.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -133.6 124.62 27.16 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 121.293 0.568 . . . . 0.0 110.537 178.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -145.25 145.24 31.21 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.424 -177.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 14.3 m . . . . . 0 C--N 1.316 -0.849 0 C-N-CA 120.843 -0.343 . . . . 0.0 111.005 -176.938 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 779' ' ' PHE . . . . . 0.408 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 48.0 p90 . . . . . 0 N--CA 1.45 -0.462 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 9.3 tt -102.74 136.76 33.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.587 -177.5 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 18.6 m -120.75 116.04 24.47 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.58 -178.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 47.2 t -92.28 117.03 34.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.841 177.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 34.3 t -111.6 127.79 55.85 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.108 0.48 . . . . 0.0 110.43 -178.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 784' ' ' LYS . . . . . 0.557 ' HD3' ' HA ' ' A' ' 737' ' ' MET . 52.4 mtmt . . . . . 0 C--N 1.321 -0.669 0 CA-C-O 121.486 0.66 . . . . 0.0 109.222 174.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 728' ' ' HIS . . . . . 0.465 ' O ' ' HG2' ' A' ' 732' ' ' MET . 22.3 t60 . . . . . 0 C--O 1.227 -0.09 0 CA-C-O 120.561 0.219 . . . . 0.0 111.161 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -70.75 -39.63 73.15 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.101 -174.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 26.8 ttt180 -55.71 -40.45 72.43 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.215 0.531 . . . . 0.0 110.059 176.188 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 731' ' ' ALA . . . . . 0.482 ' O ' HG12 ' A' ' 734' ' ' VAL . . . -71.82 -42.57 66.86 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.96 179.05 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 732' ' ' MET . . . . . 0.465 ' HG2' ' O ' ' A' ' 728' ' ' HIS . 44.8 mmm -60.65 -37.49 81.69 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.767 0.318 . . . . 0.0 110.895 178.638 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 70.8 mt -71.02 -41.0 76.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.528 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 734' ' ' VAL . . . . . 0.482 HG12 ' O ' ' A' ' 731' ' ' ALA . 10.0 p -67.66 -34.32 67.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.664 -179.167 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 735' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 731' ' ' ALA . 51.9 mt-10 -63.08 -45.56 91.57 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-O 121.349 0.595 . . . . 0.0 109.543 173.436 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 736' ' ' PHE . . . . . 0.422 ' HB2' HD12 ' A' ' 744' ' ' LEU . 41.6 t80 -57.41 -44.52 84.67 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.849 -1.069 . . . . 0.0 111.535 -179.383 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 737' ' ' MET . . . . . 0.412 ' HA ' ' HE2' ' A' ' 784' ' ' LYS . 45.8 mtm -69.15 -34.34 74.85 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.035 -179.345 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -78.04 -28.64 49.07 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.902 0.382 . . . . 0.0 111.224 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 25.2 t -80.69 -172.04 3.43 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.496 -179.225 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 740' ' ' LYS . . . . . 0.653 ' H ' ' HD2' ' A' ' 740' ' ' LYS . 0.0 OUTLIER -110.53 12.46 22.83 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.154 0.502 . . . . 0.0 110.848 -175.094 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -71.75 142.09 49.76 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.368 -0.605 . . . . 0.0 109.368 172.12 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 742' ' ' MET . . . . . 0.498 ' O ' ' HA ' ' A' ' 783' ' ' SER . 17.6 ptp -104.12 -14.91 15.71 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.468 177.454 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -140.7 116.34 10.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.662 179.122 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 744' ' ' LEU . . . . . 0.422 HD12 ' HB2' ' A' ' 736' ' ' PHE . 1.4 tt -89.63 103.55 16.18 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 177.646 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -88.27 99.07 11.95 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.646 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -77.03 153.35 82.64 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.352 178.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_exo -66.23 156.32 65.51 Favored 'Trans proline' 0 CA--C 1.532 0.422 0 C-N-CA 122.8 2.333 . . . . 0.0 112.13 176.045 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -71.41 -5.24 16.61 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.928 2.419 . . . . 0.0 112.665 177.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 23.6 p -65.01 -25.23 67.77 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.156 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.9 mp -60.17 118.12 5.97 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.577 177.441 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -90.12 -176.53 4.89 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.075 176.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 17.4 m -48.29 -53.99 15.31 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 113.237 0.828 . . . . 0.0 113.237 -171.006 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -68.0 -37.86 81.97 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.693 0.282 . . . . 0.0 110.956 -175.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -65.16 -45.58 84.37 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.781 0.324 . . . . 0.0 110.405 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 78.2 mtt180 -58.53 -48.62 80.24 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 174.532 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 56.9 tp -53.68 -43.32 68.81 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.61 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -60.53 -41.73 95.02 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.293 -0.412 . . . . 0.0 109.963 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 91.7 t -64.18 -48.27 86.38 Favored 'Isoleucine or valine' 0 C--O 1.232 0.175 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.067 176.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -55.08 -48.35 73.64 Favored 'General case' 0 N--CA 1.464 0.236 0 O-C-N 123.255 0.347 . . . . 0.0 111.056 -179.737 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -58.98 -48.58 81.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.692 -179.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 98.5 mt -65.65 -49.17 79.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.987 -177.61 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -60.96 -41.41 96.27 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 120.912 0.387 . . . . 0.0 110.841 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -63.28 -39.68 95.27 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.033 -179.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -74.62 -36.79 62.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.807 0.337 . . . . 0.0 110.765 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 11.8 m170 -65.79 -25.06 67.08 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.908 177.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 100.15 14.62 32.94 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.384 177.408 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 39.7 mt -94.52 169.61 10.07 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 -179.48 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 59.8 ttt180 -100.73 152.3 20.64 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 179.228 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 5.8 p80 -153.14 142.82 21.94 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.736 0.303 . . . . 0.0 110.803 -176.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -142.21 160.9 39.33 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.204 178.136 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 4.4 m . . . . . 0 C--N 1.317 -0.814 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.601 176.96 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 43.8 p90 . . . . . 0 N--CA 1.451 -0.385 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 8.3 tt -122.7 141.22 43.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-O 120.928 0.394 . . . . 0.0 110.594 179.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 781' ' ' THR . . . . . 0.408 ' HA ' ' O ' ' A' ' 744' ' ' LEU . 25.7 m -127.14 127.63 44.88 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.468 -179.648 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 35.4 t -106.19 124.44 61.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.653 178.517 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 783' ' ' SER . . . . . 0.498 ' HA ' ' O ' ' A' ' 742' ' ' MET . 55.6 p -112.36 139.55 47.83 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.072 0.463 . . . . 0.0 111.259 -177.114 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 784' ' ' LYS . . . . . 0.412 ' HE2' ' HA ' ' A' ' 737' ' ' MET . 89.6 mttt . . . . . 0 C--N 1.329 -0.301 0 CA-C-O 121.408 0.623 . . . . 0.0 110.326 175.268 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 31.8 t60 . . . . . 0 N--CA 1.461 0.12 0 CA-C-O 121.212 0.529 . . . . 0.0 109.602 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 36.2 m-85 -70.24 -24.24 63.05 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.45 -178.494 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 12.0 ttm180 -70.34 -39.76 74.52 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 178.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -63.96 -41.73 97.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.133 175.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 35.0 mmm -59.83 -43.36 94.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.549 178.004 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 733' ' ' ILE . . . . . 0.453 ' O ' ' HG3' ' A' ' 737' ' ' MET . 48.7 mt -70.03 -45.15 77.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.871 -0.604 . . . . 0.0 112.101 -178.304 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 10.9 p -63.47 -37.12 78.71 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 120.968 -0.293 . . . . 0.0 111.166 -176.075 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -74.02 -36.01 64.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.06 0.457 . . . . 0.0 110.186 176.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 736' ' ' PHE . . . . . 0.465 ' CE1' ' HB2' ' A' ' 744' ' ' LEU . 19.3 t80 -60.76 -37.02 80.41 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.819 175.838 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 737' ' ' MET . . . . . 0.453 ' HG3' ' O ' ' A' ' 733' ' ' ILE . 87.6 mtp -63.23 -36.24 82.98 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.093 178.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -86.28 -16.14 38.5 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.383 -178.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 58.9 m -84.53 169.41 14.48 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.874 0.369 . . . . 0.0 111.316 -177.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -73.36 -16.38 61.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.936 -0.575 . . . . 0.0 112.061 -176.304 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -60.16 134.59 57.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.127 0.489 . . . . 0.0 111.051 -177.338 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 56.6 mtm -92.47 -26.96 17.74 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.935 177.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -137.35 135.68 37.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.311 -179.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 744' ' ' LEU . . . . . 0.465 ' HB2' ' CE1' ' A' ' 736' ' ' PHE . 30.4 tp -112.94 105.37 13.43 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 176.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -91.37 112.65 24.65 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.243 -178.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 746' ' ' PHE . . . . . 0.531 ' O ' ' HB2' ' A' ' 779' ' ' PHE . 87.4 m-85 -85.51 150.07 53.19 Favored Pre-proline 0 C--N 1.321 -0.661 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.154 178.023 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 747' ' ' PRO . . . . . 0.408 ' O ' HD13 ' A' ' 750' ' ' LEU . 11.9 Cg_exo -67.41 158.81 55.29 Favored 'Trans proline' 0 N--CA 1.461 -0.391 0 C-N-CA 122.407 2.071 . . . . 0.0 112.008 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -66.09 -5.64 12.74 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.787 2.324 . . . . 0.0 112.532 176.683 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 3.4 m -63.4 -20.74 65.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.476 -0.783 . . . . 0.0 111.42 178.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 750' ' ' LEU . . . . . 0.408 HD13 ' O ' ' A' ' 747' ' ' PRO . 10.5 mp -69.06 113.85 6.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.372 177.75 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 751' ' ' ASN . . . . . 0.51 HD22 ' C ' ' A' ' 751' ' ' ASN . 0.3 OUTLIER -84.86 -167.36 1.79 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 110.247 -0.279 . . . . 0.0 110.247 179.061 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 6.2 m -52.25 -52.09 54.56 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 111.664 0.246 . . . . 0.0 111.664 -177.059 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 753' ' ' HIS . . . . . 0.451 ' O ' ' HG2' ' A' ' 757' ' ' ARG . 32.0 t-80 -59.54 -49.71 76.7 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.625 -0.261 . . . . 0.0 111.347 179.097 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -56.63 -55.73 30.34 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.168 -176.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 77.1 mtt85 -56.55 -49.69 74.06 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.35 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -53.08 -46.25 68.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.218 -178.07 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 757' ' ' ARG . . . . . 0.451 ' HG2' ' O ' ' A' ' 753' ' ' HIS . 31.9 mmm180 -60.35 -45.86 91.96 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.355 178.48 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 91.9 t -60.45 -47.39 92.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.648 -0.251 . . . . 0.0 110.943 179.067 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 87.8 m-70 -52.33 -56.73 12.95 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.711 178.431 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -60.79 -41.95 96.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.041 -0.527 . . . . 0.0 112.099 -178.377 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.59 -50.5 79.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.749 0.309 . . . . 0.0 110.845 179.257 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -64.39 -36.73 85.1 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.889 0.376 . . . . 0.0 110.58 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -65.32 -40.25 93.49 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.573 178.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.21 -43.37 78.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.053 -0.522 . . . . 0.0 109.852 177.686 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 10.5 m170 -69.09 -17.0 63.81 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.431 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 84.38 34.99 15.3 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.457 177.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 80.1 mt -110.4 172.95 6.56 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.03 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 73.3 ttt180 -92.71 143.75 25.99 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 177.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 5.5 p80 -146.06 121.49 10.32 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.222 0.534 . . . . 0.0 110.638 179.498 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -129.32 138.07 51.37 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.7 -176.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 5.1 m . . . . . 0 C--N 1.318 -0.785 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 174.637 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 779' ' ' PHE . . . . . 0.531 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 45.8 p90 . . . . . 0 N--CA 1.451 -0.408 0 CA-C-O 120.713 0.292 . . . . 0.0 110.274 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 6.7 tt -116.41 135.5 56.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-O 121.278 0.561 . . . . 0.0 110.775 -178.028 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 55.9 m -119.91 120.24 35.83 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.733 -179.496 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 46.5 t -94.14 122.53 45.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.51 176.109 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 45.5 t -114.22 134.05 55.19 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-O 121.072 0.463 . . . . 0.0 110.835 -176.018 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 50.9 mtpt . . . . . 0 C--N 1.327 -0.404 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.771 179.268 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 44.2 t60 . . . . . 0 N--CA 1.464 0.231 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -64.22 -23.03 67.16 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.187 -176.349 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 730' ' ' ARG . . . . . 0.404 ' HA ' HD13 ' A' ' 761' ' ' ILE . 1.8 ttm180 -69.2 -47.69 64.17 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 178.284 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -63.5 -42.43 98.52 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.668 178.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 37.9 mmm -60.63 -38.15 83.83 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.381 179.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 48.8 mt -72.9 -45.99 53.88 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.661 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 11.1 p -64.9 -35.1 74.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 C-N-CA 120.861 -0.335 . . . . 0.0 110.94 -176.665 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -74.73 -33.34 62.34 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 121.023 0.439 . . . . 0.0 110.208 176.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 736' ' ' PHE . . . . . 0.479 ' CE2' ' HG3' ' A' ' 784' ' ' LYS . 32.2 t80 -61.79 -36.26 80.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.913 174.347 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 80.8 mtp -74.14 -26.05 60.1 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.15 177.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -87.77 -24.97 23.62 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.859 0.362 . . . . 0.0 110.609 -176.46 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 77.3 p -89.9 -173.81 4.03 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.45 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -100.92 16.47 25.13 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.436 -176.13 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 741' ' ' LYS . . . . . 0.463 ' O ' ' HD3' ' A' ' 784' ' ' LYS . 58.3 mttp -72.78 132.23 43.33 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 177.049 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 25.7 mmt -88.97 -28.51 20.2 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.727 0.299 . . . . 0.0 110.583 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -141.19 136.76 32.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.321 -177.731 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 744' ' ' LEU . . . . . 0.444 HD13 ' CZ ' ' A' ' 746' ' ' PHE . 0.7 OUTLIER -107.78 103.79 13.14 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 179.059 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -86.52 103.29 14.9 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.981 0.42 . . . . 0.0 110.554 177.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 746' ' ' PHE . . . . . 0.444 ' CZ ' HD13 ' A' ' 744' ' ' LEU . 72.2 m-85 -81.83 151.9 68.27 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.474 176.82 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 747' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 746' ' ' PHE . 22.4 Cg_exo -65.45 153.6 77.48 Favored 'Trans proline' 0 CA--C 1.531 0.367 0 C-N-CA 122.706 2.27 . . . . 0.0 112.47 178.431 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -67.15 -5.68 14.28 Favored 'Trans proline' 0 N--CA 1.474 0.352 0 C-N-CA 123.218 2.612 . . . . 0.0 113.051 179.235 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 23.2 t -71.5 -13.95 61.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.786 179.32 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.9 mp -71.51 112.59 7.75 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 175.281 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 31.1 p30 -85.3 -170.59 3.19 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.425 -179.326 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 19.5 m -57.63 -38.43 74.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.509 0.195 . . . . 0.0 111.366 -176.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 38.2 t-80 -69.64 -48.67 59.13 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.834 178.515 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -59.39 -50.6 73.32 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 121.217 0.532 . . . . 0.0 110.5 -179.178 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 22.9 mtm180 -60.9 -40.59 93.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.339 179.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 54.5 tp -55.54 -44.03 76.36 Favored 'General case' 0 C--N 1.332 -0.194 0 O-C-N 123.287 0.367 . . . . 0.0 110.819 178.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 19.2 tpt180 -59.74 -43.1 94.39 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 121.033 0.444 . . . . 0.0 110.07 179.138 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 48.6 t -64.83 -48.35 84.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.937 178.418 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -57.2 -47.25 81.74 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 110.324 -0.25 . . . . 0.0 110.324 178.407 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -52.03 -53.62 39.79 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.687 177.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 761' ' ' ILE . . . . . 0.404 HD13 ' HA ' ' A' ' 730' ' ' ARG . 74.8 mt -65.82 -43.57 93.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.398 -175.775 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -64.8 -37.0 86.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.987 0.422 . . . . 0.0 110.679 179.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -69.65 -36.92 76.5 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.378 178.478 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -64.51 -49.33 71.76 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.412 175.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 13.1 m170 -69.44 -31.41 69.71 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.365 -176.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 98.77 38.41 3.9 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.203 179.031 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 78.6 mt -111.26 174.39 5.89 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 178.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 768' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' A' ' 768' ' ' ARG . 21.5 ttt180 -93.52 136.6 33.63 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 178.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.7 p80 -142.35 134.24 27.12 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 120.648 0.261 . . . . 0.0 110.805 -177.268 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -146.56 142.91 28.48 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.345 179.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 3.3 p . . . . . 0 C--N 1.318 -0.786 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.276 176.419 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 50.7 p90 . . . . . 0 N--CA 1.447 -0.619 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 15.2 tt -107.85 133.41 52.78 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-O 121.387 0.613 . . . . 0.0 110.733 -179.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 781' ' ' THR . . . . . 0.44 ' HA ' ' O ' ' A' ' 744' ' ' LEU . 26.7 m -116.05 115.75 26.66 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.048 177.686 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 33.5 t -91.04 134.18 30.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 176.112 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 33.7 t -125.26 137.12 54.09 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.126 0.489 . . . . 0.0 110.731 -175.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 784' ' ' LYS . . . . . 0.479 ' HG3' ' CE2' ' A' ' 736' ' ' PHE . 60.1 mtpt . . . . . 0 C--N 1.323 -0.584 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.411 178.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 26.1 t60 . . . . . 0 C--O 1.233 0.236 0 CA-C-O 120.982 0.42 . . . . 0.0 111.252 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 24.7 m-85 -74.46 -35.54 63.31 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.672 -174.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 730' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 730' ' ' ARG . 17.1 ttp85 -64.34 -39.65 94.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.744 0.307 . . . . 0.0 110.351 178.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -64.06 -48.14 77.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.704 178.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 11.9 mtm -61.96 -35.42 78.42 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.145 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 733' ' ' ILE . . . . . 0.508 ' O ' ' HG3' ' A' ' 737' ' ' MET . 66.4 mt -71.72 -49.86 42.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.706 -0.224 . . . . 0.0 111.6 179.316 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 11.2 p -63.58 -34.6 68.63 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 120.988 -0.285 . . . . 0.0 111.39 -175.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -77.49 -31.18 53.46 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.95 0.405 . . . . 0.0 110.356 177.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 736' ' ' PHE . . . . . 0.513 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 0.7 OUTLIER -66.22 -37.01 84.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.447 174.489 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 737' ' ' MET . . . . . 0.508 ' HG3' ' O ' ' A' ' 733' ' ' ILE . 88.7 mtp -61.74 -28.65 69.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.013 179.408 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -102.85 9.55 38.85 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.005 -179.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 7.6 t -96.54 -164.54 1.16 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.028 -179.033 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -108.19 10.66 27.86 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.731 0.301 . . . . 0.0 111.628 -176.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 56.5 mttp -91.7 136.97 32.74 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.827 0.346 . . . . 0.0 110.541 177.679 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.86 -24.63 35.67 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.534 179.501 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -152.87 138.12 17.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.11 0.481 . . . . 0.0 111.092 177.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 744' ' ' LEU . . . . . 0.513 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 59.7 tp -102.67 105.75 16.27 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.607 -179.61 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -87.36 114.16 23.72 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.278 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 746' ' ' PHE . . . . . 0.417 ' HA ' ' HD3' ' A' ' 747' ' ' PRO . 80.9 m-85 -84.77 151.33 57.9 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.501 179.52 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 747' ' ' PRO . . . . . 0.441 ' HB2' ' OG ' ' A' ' 749' ' ' SER . 13.8 Cg_exo -68.33 155.71 68.28 Favored 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 122.606 2.204 . . . . 0.0 112.184 177.456 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -67.94 -3.01 9.73 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 122.995 2.463 . . . . 0.0 112.821 178.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 749' ' ' SER . . . . . 0.441 ' OG ' ' HB2' ' A' ' 747' ' ' PRO . 5.3 p -68.62 -23.18 64.42 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.251 178.648 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.7 mp -63.14 115.65 4.68 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.01 175.166 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -84.62 -171.38 3.59 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.186 -179.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 2.8 m -48.19 -54.25 14.07 Favored 'General case' 0 C--N 1.328 -0.349 0 O-C-N 123.59 0.556 . . . . 0.0 111.914 -178.387 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 34.9 m80 -73.31 -31.16 63.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.462 -175.258 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -64.47 -47.4 79.11 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 176.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 23.3 mtm180 -61.87 -45.98 91.39 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.041 177.353 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 57.8 tp -52.69 -41.82 64.23 Favored 'General case' 0 C--N 1.332 -0.168 0 O-C-N 123.432 0.457 . . . . 0.0 110.848 178.543 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 26.2 tpt180 -61.47 -45.91 92.26 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.952 179.357 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 99.6 t -64.83 -47.42 88.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.188 179.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -55.23 -48.6 73.69 Favored 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 178.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 63.8 mt-30 -52.74 -51.79 59.05 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.516 177.489 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 77.3 mt -66.36 -47.65 83.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.505 -175.341 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -64.22 -39.03 93.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.834 0.349 . . . . 0.0 110.463 -179.113 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -65.86 -40.79 92.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.216 178.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -66.95 -45.52 77.55 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.741 178.276 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 10.7 m170 -70.38 -27.76 64.56 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.445 -177.177 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 98.24 30.69 6.87 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.527 -0.844 . . . . 0.0 112.544 177.592 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 53.1 mt -107.05 162.78 13.55 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 177.677 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 26.0 ttp180 -84.43 132.39 34.57 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.654 -0.418 . . . . 0.0 109.893 178.698 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 4.4 p80 -130.71 123.68 29.83 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-O 121.111 0.482 . . . . 0.0 110.254 178.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -136.83 155.76 49.38 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.944 -179.002 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 9.4 t . . . . . 0 C--N 1.32 -0.687 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 178.307 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 45.3 p90 . . . . . 0 N--CA 1.453 -0.311 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 8.9 tt -127.07 143.49 40.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-O 121.025 0.44 . . . . 0.0 111.166 -175.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 57.3 m -124.6 125.83 44.78 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.678 179.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 47.5 t -102.94 114.29 42.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 176.125 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 11.2 t -110.78 140.0 45.59 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.087 0.47 . . . . 0.0 110.726 -175.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt . . . . . 0 C--N 1.324 -0.506 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.955 176.138 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 728' ' ' HIS . . . . . 0.468 ' O ' ' HG3' ' A' ' 732' ' ' MET . 4.8 t60 . . . . . 0 C--O 1.232 0.167 0 CA-C-O 121.052 0.453 . . . . 0.0 110.452 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -77.03 -31.38 56.28 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.007 -175.229 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 -57.75 -43.23 85.27 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 174.589 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -64.8 -48.22 75.22 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.665 177.589 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 732' ' ' MET . . . . . 0.468 ' HG3' ' O ' ' A' ' 728' ' ' HIS . 92.2 mtp -57.37 -45.76 84.08 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.933 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 733' ' ' ILE . . . . . 0.462 ' O ' ' HG3' ' A' ' 737' ' ' MET . 72.9 mt -67.17 -45.57 86.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.912 -178.236 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 11.3 p -66.98 -38.42 81.33 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 120.594 -0.442 . . . . 0.0 111.065 -176.491 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 735' ' ' GLU . . . . . 0.463 ' O ' ' HB2' ' A' ' 739' ' ' SER . 42.8 mt-10 -72.09 -33.35 67.82 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-O 120.842 0.353 . . . . 0.0 110.114 177.33 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 736' ' ' PHE . . . . . 0.626 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 7.0 t80 -60.12 -42.66 95.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.354 177.31 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 737' ' ' MET . . . . . 0.476 ' SD ' HD11 ' A' ' 767' ' ' LEU . 46.4 mtm -62.4 -25.8 68.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.59 -176.592 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -112.61 12.89 19.9 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.907 0.384 . . . . 0.0 111.152 -178.446 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 739' ' ' SER . . . . . 0.463 ' HB2' ' O ' ' A' ' 735' ' ' GLU . 7.7 t -94.98 7.09 47.18 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.407 -176.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? 65.27 16.81 10.74 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.201 -177.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -97.32 125.04 41.66 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 176.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.0 -20.11 33.36 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.147 -177.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -147.06 129.15 15.55 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.145 -174.528 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 744' ' ' LEU . . . . . 0.626 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 42.6 tp -118.61 102.29 8.76 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 110.067 -0.345 . . . . 0.0 110.067 179.805 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 11.3 mp0 -85.72 108.16 17.93 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.214 -0.448 . . . . 0.0 109.946 177.052 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -75.23 152.02 85.94 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.647 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -64.89 149.59 89.33 Favored 'Trans proline' 0 CA--C 1.53 0.316 0 C-N-CA 122.774 2.316 . . . . 0.0 112.06 177.011 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -67.31 -2.44 8.17 Favored 'Trans proline' 0 N--CA 1.474 0.346 0 C-N-CA 123.239 2.626 . . . . 0.0 113.145 -179.454 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 13.0 t -74.02 -18.1 60.89 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.93 179.351 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.8 mp -64.38 113.76 3.84 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.155 176.409 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 751' ' ' ASN . . . . . 0.461 ' O ' ' HG3' ' A' ' 755' ' ' ARG . 4.5 p30 -81.25 -176.69 6.11 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 -179.019 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 44.3 t -49.44 -49.11 46.59 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.515 -179.065 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 753' ' ' HIS . . . . . 0.401 ' O ' ' HG2' ' A' ' 757' ' ' ARG . 41.1 m80 -67.87 -37.54 81.94 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.524 -178.262 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -64.0 -49.68 71.53 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.142 0.496 . . . . 0.0 110.218 179.176 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 755' ' ' ARG . . . . . 0.461 ' HG3' ' O ' ' A' ' 751' ' ' ASN . 23.5 mtm180 -63.83 -38.46 91.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.208 -179.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 62.1 tp -54.41 -44.71 72.62 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 123.393 0.433 . . . . 0.0 110.779 177.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 757' ' ' ARG . . . . . 0.401 ' HG2' ' O ' ' A' ' 753' ' ' HIS . 31.2 mmm180 -58.9 -47.02 86.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.974 177.775 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 59.0 t -59.24 -48.47 86.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.976 178.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -57.38 -55.02 40.22 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.638 -0.255 . . . . 0.0 110.841 179.498 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -53.45 -46.3 69.84 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 121.097 0.475 . . . . 0.0 111.416 -178.532 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 96.4 mt -68.56 -47.52 76.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.294 -176.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -65.37 -34.1 77.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.937 0.399 . . . . 0.0 110.532 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -64.0 -35.15 79.76 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.39 178.179 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -74.81 -42.64 57.69 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 120.975 0.417 . . . . 0.0 110.848 176.66 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 11.4 m170 -65.28 -26.23 67.99 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.401 -179.127 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 93.29 20.68 31.9 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.928 -0.653 . . . . 0.0 111.838 -179.409 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 767' ' ' LEU . . . . . 0.476 HD11 ' SD ' ' A' ' 737' ' ' MET . 32.6 mt -97.62 166.49 11.48 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 -177.251 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 28.7 ttt180 -85.68 125.18 32.98 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.057 175.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 3.3 p80 -121.2 116.63 25.29 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.113 174.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 41.2 t0 -141.83 156.9 45.53 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.802 -172.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 6.1 p . . . . . 0 C--N 1.319 -0.745 0 CA-C-O 120.982 0.42 . . . . 0.0 111.305 -175.987 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 50.4 p90 . . . . . 0 N--CA 1.449 -0.488 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 12.7 tt -116.06 143.0 27.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-O 121.1 0.476 . . . . 0.0 110.519 -179.231 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 49.5 m -129.72 130.15 45.09 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.639 179.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 98.7 t -106.85 132.27 54.6 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.722 178.223 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 16.4 m -124.88 139.41 53.86 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.208 -179.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 784' ' ' LYS . . . . . 0.429 ' HA ' HD22 ' A' ' 767' ' ' LEU . 27.4 mtpp . . . . . 0 C--N 1.326 -0.445 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.49 -177.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo . . . . . 0 N--CA 1.474 0.378 0 N-CA-C 110.335 -0.679 . . . . 0.0 110.335 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -155.49 136.77 13.95 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.03 0.443 . . . . 0.0 110.608 -175.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . 146.78 -157.23 27.34 Favored Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.99 -0.624 . . . . 0.0 111.79 -179.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 17.2 m -113.49 126.14 70.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.256 0.55 . . . . 0.0 110.25 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -106.41 -30.21 9.25 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.636 -179.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 51.0 m -77.64 72.47 4.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.488 0.661 . . . . 0.0 110.013 177.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 54.1 mt-30 -83.73 141.17 31.64 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.891 -176.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -88.29 4.18 46.91 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.5 175.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . 82.37 -83.99 1.54 Allowed Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 110.259 -1.136 . . . . 0.0 110.259 -174.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 47.0 t -138.68 112.34 7.29 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.845 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 175.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 727' ' ' ASP . . . . . 0.425 ' HB3' ' HB3' ' A' ' 730' ' ' ARG . 14.5 t70 -121.42 134.44 55.1 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.893 -178.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 728' ' ' HIS . . . . . 0.478 ' O ' ' HG2' ' A' ' 732' ' ' MET . 51.1 t60 -54.13 -56.43 18.25 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 123.312 0.382 . . . . 0.0 110.885 -178.75 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 729' ' ' PHE . . . . . 0.419 ' CZ ' ' HB3' ' A' ' 754' ' ' ASP . 66.1 m-85 -71.96 -32.48 67.33 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.314 -173.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 730' ' ' ARG . . . . . 0.425 ' HB3' ' HB3' ' A' ' 727' ' ' ASP . 17.2 ttt180 -67.99 -35.13 77.81 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.152 177.259 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -67.17 -39.84 86.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.324 176.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 732' ' ' MET . . . . . 0.478 ' HG2' ' O ' ' A' ' 728' ' ' HIS . 38.7 mmm -61.86 -40.46 95.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.681 177.729 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 733' ' ' ILE . . . . . 0.413 ' O ' ' HG3' ' A' ' 737' ' ' MET . 64.5 mt -71.53 -42.99 72.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.898 -178.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 8.0 p -64.7 -35.37 74.71 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 C-N-CA 120.738 -0.385 . . . . 0.0 110.763 -177.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -66.33 -47.35 73.79 Favored 'General case' 0 CA--C 1.522 -0.124 0 CA-C-O 121.25 0.547 . . . . 0.0 109.577 173.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 736' ' ' PHE . . . . . 0.599 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 45.2 t80 -52.96 -42.73 65.78 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.015 -0.993 . . . . 0.0 111.676 179.014 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 737' ' ' MET . . . . . 0.413 ' HG3' ' O ' ' A' ' 733' ' ' ILE . 83.6 mtp -61.08 -32.68 72.33 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.673 -177.594 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -101.02 2.38 40.49 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.488 -177.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 60.7 m -98.44 174.45 6.46 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.18 0.514 . . . . 0.0 112.049 -175.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 16.5 ptmt -74.43 -18.26 60.67 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.726 177.023 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 29.9 mttm -57.93 111.18 1.08 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.101 -178.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 26.6 ptt? -78.1 -22.21 49.27 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.219 0.533 . . . . 0.0 109.717 175.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -143.19 135.99 27.7 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.329 -0.851 . . . . 0.0 109.698 178.152 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 744' ' ' LEU . . . . . 0.599 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 36.4 tp -105.69 105.77 15.96 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 179.095 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -86.47 115.41 23.95 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.146 -0.933 . . . . 0.0 110.208 178.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 746' ' ' PHE . . . . . 0.409 ' HA ' ' HD3' ' A' ' 747' ' ' PRO . 68.3 m-85 -90.34 149.73 41.68 Favored Pre-proline 0 C--N 1.319 -0.737 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.756 177.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 747' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 746' ' ' PHE . 11.3 Cg_exo -69.32 156.04 65.62 Favored 'Trans proline' 0 N--CA 1.462 -0.358 0 C-N-CA 122.758 2.305 . . . . 0.0 111.953 177.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -66.15 -4.13 9.82 Favored 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 122.73 2.286 . . . . 0.0 112.771 176.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 32.9 t -67.04 -16.52 64.41 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.516 179.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.8 mp -71.97 128.63 36.33 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.699 0.285 . . . . 0.0 110.391 177.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 751' ' ' ASN . . . . . 0.489 ' O ' ' HG3' ' A' ' 755' ' ' ARG . 4.7 p30 -93.97 -176.89 4.15 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 175.469 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 20.7 t -54.13 -41.81 68.8 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 122.971 0.169 . . . . 0.0 111.303 -177.314 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 49.1 t-80 -65.06 -45.47 85.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.68 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 754' ' ' ASP . . . . . 0.419 ' HB3' ' CZ ' ' A' ' 729' ' ' PHE . 45.2 m-20 -62.03 -43.17 99.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.222 0.534 . . . . 0.0 110.057 -177.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 755' ' ' ARG . . . . . 0.489 ' HG3' ' O ' ' A' ' 751' ' ' ASN . 70.9 mtt-85 -65.21 -46.56 80.21 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.964 177.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 756' ' ' LEU . . . . . 0.582 ' HB2' " H4'" ' A' ' 801' ' ' DGP . 56.1 tp -52.78 -40.87 63.57 Favored 'General case' 0 N--CA 1.463 0.223 0 O-C-N 123.443 0.465 . . . . 0.0 110.533 177.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 757' ' ' ARG . . . . . 0.565 ' HE ' ' HA ' ' A' ' 757' ' ' ARG . 1.6 tpm_? -57.65 -50.81 71.94 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.248 176.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 61.2 t -63.15 -48.08 89.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.297 -179.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -55.74 -46.72 77.75 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.425 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 64.4 mt-30 -56.89 -52.96 63.11 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.949 0.404 . . . . 0.0 111.607 178.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 76.1 mt -65.55 -47.12 87.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.356 -175.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -63.74 -36.55 84.23 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.744 0.307 . . . . 0.0 110.876 -178.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -65.98 -39.16 90.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.719 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -73.99 -39.66 63.5 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.124 178.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 10.5 m170 -70.43 -34.97 73.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.086 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 107.4 31.41 3.77 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.414 -0.898 . . . . 0.0 112.925 176.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 29.3 mt -111.14 164.75 12.52 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 179.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 70.8 ttt-85 -88.5 132.99 34.27 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 -179.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.0 p80 -134.34 130.85 37.57 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.566 -177.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -155.43 146.22 22.29 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.831 -177.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 771' ' ' SER . . . . . 0.409 ' HA ' ' HA ' ' A' ' 780' ' ' ILE . 4.3 m -104.85 126.72 52.21 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-O 121.227 0.537 . . . . 0.0 109.823 176.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 22.3 m -114.52 162.74 16.32 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.077 -176.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 98.79 -135.63 12.25 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.087 -179.016 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 774' ' ' GLU . . . . . 0.506 ' O ' ' HB2' ' A' ' 778' ' ' ARG . 30.0 mt-10 -134.22 -100.58 0.24 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.099 0.476 . . . . 0.0 110.313 -177.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . -127.95 -57.57 0.12 Allowed Glycine 0 N--CA 1.445 -0.737 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 170.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.97 -14.39 62.68 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 121.034 0.445 . . . . 0.0 110.609 173.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 80.5 mtt180 -119.08 17.52 13.23 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.565 175.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 778' ' ' ARG . . . . . 0.506 ' HB2' ' O ' ' A' ' 774' ' ' GLU . 18.0 ttt85 -86.14 120.07 27.12 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.384 0.611 . . . . 0.0 111.432 -176.029 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 37.0 p90 -135.73 162.06 33.81 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 176.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 780' ' ' ILE . . . . . 0.409 ' HA ' ' HA ' ' A' ' 771' ' ' SER . 8.0 tt -116.22 133.54 62.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-O 121.12 0.486 . . . . 0.0 110.904 -177.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 4.0 m -115.17 124.73 52.2 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.365 -178.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 60.0 t -104.89 129.71 57.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 174.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 41.5 t -118.93 143.74 46.84 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.136 0.493 . . . . 0.0 110.979 -177.294 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 784' ' ' LYS . . . . . 0.56 ' HG3' ' CZ ' ' A' ' 736' ' ' PHE . 62.6 mtpt -74.32 -21.28 59.79 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.973 -179.449 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 785' ' ' ARG . . . . . 0.476 ' HA ' ' CZ ' ' A' ' 785' ' ' ARG . 0.5 OUTLIER -88.35 94.91 10.0 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.657 -178.607 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.984 0 CA-C-O 118.608 -0.71 . . . . 0.0 109.843 173.278 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 801' ' ' DGP . . . . . 0.582 " H4'" ' HB2' ' A' ' 756' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo . . . . . 0 N--CA 1.478 0.57 0 N-CA-C 111.535 -0.217 . . . . 0.0 111.535 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -104.5 125.9 51.1 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 178.082 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . 95.04 45.15 3.14 Favored Glycine 0 N--CA 1.445 -0.732 0 C-N-CA 120.627 -0.797 . . . . 0.0 111.203 -175.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 59.9 t -76.48 91.69 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.152 0.501 . . . . 0.0 110.309 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -109.86 110.31 21.24 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.387 0.613 . . . . 0.0 110.585 178.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 17.8 m -132.12 99.85 4.85 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.381 177.308 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 17.0 tt0 -82.99 -3.36 57.12 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.214 0.53 . . . . 0.0 110.25 -175.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -72.49 105.24 4.09 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 174.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . -64.43 -55.04 25.56 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.081 -176.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 3.1 p -110.08 111.11 34.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-O 121.395 0.616 . . . . 0.0 109.719 175.11 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 727' ' ' ASP . . . . . 0.459 ' HB3' ' HB3' ' A' ' 730' ' ' ARG . 19.7 t70 -108.63 128.1 54.55 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.37 -177.744 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 13.5 t60 -62.42 -50.46 71.42 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.638 -176.387 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -77.53 -36.93 51.92 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.398 -172.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 730' ' ' ARG . . . . . 0.459 ' HB3' ' HB3' ' A' ' 727' ' ' ASP . 53.2 ttp180 -59.92 -41.02 90.85 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 175.659 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -65.76 -45.59 81.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.714 178.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 19.3 mmm -58.24 -45.02 88.49 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.93 178.089 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 74.9 mt -70.71 -43.39 77.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.827 -177.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 8.5 p -66.28 -35.5 75.12 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.14 -177.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -77.15 -27.6 53.9 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-O 120.789 0.328 . . . . 0.0 110.449 176.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 736' ' ' PHE . . . . . 0.507 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 25.7 t80 -65.34 -41.1 94.28 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.299 178.015 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 65.6 mtm -63.58 -29.71 70.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.071 0.463 . . . . 0.0 110.518 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -96.45 8.45 44.03 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.026 -0.533 . . . . 0.0 111.097 179.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 44.2 t -93.68 165.88 12.5 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.363 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -84.91 -1.65 56.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.292 -179.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -73.79 160.47 31.44 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.719 179.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 4.4 mpp? -108.89 -28.56 9.09 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.217 175.102 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -142.92 127.68 18.18 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.211 0.529 . . . . 0.0 111.145 178.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 744' ' ' LEU . . . . . 0.507 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 52.7 tp -96.73 106.13 18.37 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.312 179.057 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -90.94 106.07 18.26 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.089 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -75.14 157.18 85.44 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.19 -177.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 747' ' ' PRO . . . . . 0.411 ' HA ' ' HD3' ' A' ' 748' ' ' PRO . 19.6 Cg_exo -68.33 161.8 43.2 Favored 'Trans proline' 0 CA--C 1.535 0.539 0 C-N-CA 122.641 2.228 . . . . 0.0 112.057 175.125 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 748' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 747' ' ' PRO . 5.5 Cg_exo -76.39 -9.75 18.89 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.505 2.137 . . . . 0.0 111.753 178.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 20.1 t -64.07 -21.44 66.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.427 -179.139 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 11.2 mp -61.5 121.24 12.21 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.655 -0.248 . . . . 0.0 110.74 178.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 751' ' ' ASN . . . . . 0.489 ' O ' ' HG2' ' A' ' 755' ' ' ARG . 3.4 p-10 -90.72 -176.65 4.77 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 177.661 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 15.1 m -50.11 -49.83 50.42 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -173.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 38.7 t-80 -54.04 -47.9 71.11 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.977 177.368 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 754' ' ' ASP . . . . . 0.491 ' O ' HG23 ' A' ' 758' ' ' VAL . 57.9 m-20 -62.75 -45.43 92.76 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.629 -176.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 755' ' ' ARG . . . . . 0.489 ' HG2' ' O ' ' A' ' 751' ' ' ASN . 23.7 mmt180 -52.99 -60.59 3.09 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.835 176.263 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 756' ' ' LEU . . . . . 0.41 HD23 " H1'" ' A' ' 801' ' ' DGP . 2.3 tm? -52.62 -45.04 66.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 114.654 -1.157 . . . . 0.0 111.269 -177.298 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 10.2 mmt85 -55.48 -49.04 73.56 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.991 178.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 758' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 754' ' ' ASP . 63.1 t -62.71 -45.34 99.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.738 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -55.69 -54.33 45.61 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.824 179.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 99.3 mt-30 -54.69 -52.04 63.65 Favored 'General case' 0 C--O 1.232 0.183 0 O-C-N 123.25 0.344 . . . . 0.0 111.528 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 94.3 mt -62.77 -50.42 79.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.228 -176.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -64.1 -38.78 92.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.842 0.353 . . . . 0.0 111.166 -178.078 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 763' ' ' GLU . . . . . 0.458 ' CD ' HN21 ' A' ' 801' ' ' DGP . 42.0 tt0 -66.25 -35.83 81.43 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.035 -178.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -85.19 -29.55 24.63 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.757 0.313 . . . . 0.0 110.942 -178.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 6.7 m170 -70.08 -24.44 63.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.835 0.35 . . . . 0.0 110.598 174.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 96.2 28.82 8.88 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.871 -0.681 . . . . 0.0 112.366 177.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 56.0 mt -105.08 170.89 7.61 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 768' ' ' ARG . . . . . 0.566 ' HB3' ' OG ' ' A' ' 783' ' ' SER . 30.4 ttt180 -98.89 140.12 33.53 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 -178.06 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -150.92 134.05 16.04 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.28 0.562 . . . . 0.0 111.782 -176.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -155.47 168.23 27.79 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.493 175.291 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 7.2 m -101.22 140.12 35.95 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.12 0.486 . . . . 0.0 110.694 -176.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 9.6 m -120.66 132.74 55.26 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.859 -0.609 . . . . 0.0 109.81 -178.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 102.41 175.12 27.35 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.889 -0.672 . . . . 0.0 111.493 -175.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -115.83 -61.75 1.69 Allowed 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 -175.179 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . -108.72 -111.6 3.48 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.579 -0.819 . . . . 0.0 113.058 -175.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -67.54 -23.66 65.45 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.876 0.37 . . . . 0.0 111.055 -176.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 74.1 mtp180 -91.44 1.65 56.97 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.91 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 778' ' ' ARG . . . . . . . . . . . . . 41.1 ttt85 -72.56 131.26 42.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.422 0.63 . . . . 0.0 110.922 179.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 49.0 p90 -140.44 -175.16 4.17 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.585 177.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 6.2 tt -121.13 135.64 60.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.85 0.357 . . . . 0.0 110.68 -178.152 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 29.5 m -116.97 124.86 50.39 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.697 -177.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 47.5 t -108.53 124.06 64.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.095 176.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 783' ' ' SER . . . . . 0.566 ' OG ' ' HB3' ' A' ' 768' ' ' ARG . 4.6 p -113.37 140.78 47.75 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 121.311 0.577 . . . . 0.0 111.099 -179.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 784' ' ' LYS . . . . . 0.481 ' HG3' ' CZ ' ' A' ' 736' ' ' PHE . 62.7 mtpt -75.13 -21.57 58.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.084 179.231 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 11.6 mmm180 -80.53 94.22 6.21 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.102 -0.954 . . . . 0.0 111.187 178.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.168 0 CA-C-O 118.819 -0.61 . . . . 0.0 110.292 178.173 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 801' ' ' DGP . . . . . 0.458 HN21 ' CD ' ' A' ' 763' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo . . . . . 0 N--CA 1.476 0.446 0 N-CA-C 110.574 -0.587 . . . . 0.0 110.574 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -136.77 101.83 4.72 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.303 0.573 . . . . 0.0 110.66 -178.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . -138.56 61.18 0.58 Allowed Glycine 0 N--CA 1.446 -0.695 0 N-CA-C 110.741 -0.944 . . . . 0.0 110.741 176.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 50.7 t -95.73 111.82 26.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 120.875 0.369 . . . . 0.0 110.581 -175.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -97.98 -41.01 8.18 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.184 0.516 . . . . 0.0 110.186 174.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 17.9 t -144.93 143.92 30.8 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.745 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 25.8 mp0 -71.23 -34.77 71.1 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.985 0.421 . . . . 0.0 109.926 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 40.0 m-20 -93.99 43.93 1.11 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.906 177.102 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . -75.96 68.69 2.24 Favored Glycine 0 N--CA 1.449 -0.454 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.932 179.219 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 2.8 p -141.73 109.13 2.16 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.705 0 CA-C-O 121.668 0.747 . . . . 0.0 110.648 179.458 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 727' ' ' ASP . . . . . 0.551 ' HB3' ' HB3' ' A' ' 730' ' ' ARG . 8.9 t70 -148.07 120.41 8.42 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 114.809 -1.087 . . . . 0.0 108.286 175.48 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -54.06 -63.31 1.19 Allowed 'General case' 0 C--N 1.327 -0.394 0 O-C-N 123.465 0.478 . . . . 0.0 111.202 -172.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -69.38 -32.96 72.33 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.832 -174.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 730' ' ' ARG . . . . . 0.551 ' HB3' ' HB3' ' A' ' 727' ' ' ASP . 57.8 ttm-85 -64.2 -45.78 86.82 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.227 177.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 731' ' ' ALA . . . . . 0.438 ' HA ' HG12 ' A' ' 734' ' ' VAL . . . -62.24 -42.68 99.53 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.727 179.619 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 26.8 mmm -59.3 -44.71 92.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.687 177.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 733' ' ' ILE . . . . . 0.422 HD11 HG13 ' A' ' 758' ' ' VAL . 66.7 mt -74.01 -43.04 52.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.146 -0.479 . . . . 0.0 112.174 -176.724 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 734' ' ' VAL . . . . . 0.438 HG12 ' HA ' ' A' ' 731' ' ' ALA . 12.1 p -64.62 -40.3 88.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.19 -176.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -77.45 -26.38 51.45 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.367 178.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 736' ' ' PHE . . . . . 0.47 ' CZ ' ' HG3' ' A' ' 784' ' ' LYS . 23.8 t80 -60.52 -39.97 89.75 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.756 174.432 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 67.7 mtm -63.54 -25.38 68.22 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.02 0.438 . . . . 0.0 110.698 177.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -96.96 3.07 52.22 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.26 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 67.0 m -101.52 170.99 7.84 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.801 0.334 . . . . 0.0 110.992 -178.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -85.43 -11.27 54.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.389 -176.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -63.98 128.53 36.24 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.473 176.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 742' ' ' MET . . . . . 0.401 ' HG3' ' HG3' ' A' ' 743' ' ' GLN . 14.5 ptp -83.57 -24.71 31.44 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.838 0.351 . . . . 0.0 110.407 175.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 743' ' ' GLN . . . . . 0.401 ' HG3' ' HG3' ' A' ' 742' ' ' MET . 52.0 mt-30 -134.63 131.83 38.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.286 -178.266 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 744' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -94.71 98.63 10.91 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 175.211 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -83.29 101.3 11.19 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.386 -178.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 746' ' ' PHE . . . . . 0.426 ' HA ' ' HD3' ' A' ' 747' ' ' PRO . 68.1 m-85 -85.56 148.29 48.82 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.734 179.586 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 747' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 746' ' ' PHE . 14.8 Cg_exo -68.29 155.0 70.87 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 122.68 2.253 . . . . 0.0 112.028 176.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -68.02 -8.71 23.48 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.729 2.286 . . . . 0.0 112.46 178.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 32.1 t -63.14 -22.67 67.02 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.284 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 11.2 mp -59.29 118.54 6.06 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 175.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 751' ' ' ASN . . . . . 0.408 HD21 ' HB2' ' A' ' 753' ' ' HIS . 1.0 OUTLIER -81.02 -178.2 6.78 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 179.494 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 14.0 p -54.63 -42.6 71.4 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.688 0.28 . . . . 0.0 111.201 -178.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 753' ' ' HIS . . . . . 0.408 ' HB2' HD21 ' A' ' 751' ' ' ASN . 75.6 m80 -68.99 -40.0 79.03 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.886 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 41.5 m-20 -59.8 -51.0 71.62 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 121.07 0.462 . . . . 0.0 110.261 178.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 43.8 mtt180 -64.96 -43.72 91.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.519 -178.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 756' ' ' LEU . . . . . 0.519 ' HB2' " H4'" ' A' ' 801' ' ' DGP . 55.7 tp -54.26 -41.47 68.84 Favored 'General case' 0 C--N 1.33 -0.242 0 O-C-N 123.367 0.417 . . . . 0.0 110.292 177.518 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 757' ' ' ARG . . . . . 0.616 ' HE ' ' HA ' ' A' ' 757' ' ' ARG . 0.7 OUTLIER -60.39 -48.22 82.68 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.065 176.886 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 758' ' ' VAL . . . . . 0.422 HG13 HD11 ' A' ' 733' ' ' ILE . 58.7 t -59.75 -50.18 81.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.022 178.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -55.26 -50.18 70.15 Favored 'General case' 0 C--O 1.226 -0.156 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.557 179.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -63.93 -37.72 88.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.829 -177.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 96.3 mt -69.54 -44.11 80.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 120.8 0.333 . . . . 0.0 110.65 178.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -66.01 -34.98 79.34 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.201 0.525 . . . . 0.0 110.182 177.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 763' ' ' GLU . . . . . 0.483 ' CD ' HN21 ' A' ' 801' ' ' DGP . 38.5 tt0 -66.53 -38.32 86.92 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.41 175.79 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -69.77 -42.81 73.33 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.906 177.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 11.7 m170 -75.24 -29.33 60.19 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.88 -178.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 92.99 43.49 4.1 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.117 178.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 82.8 mt -110.35 -170.16 1.59 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.923 0.392 . . . . 0.0 110.544 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 768' ' ' ARG . . . . . 0.435 ' HD3' ' HB2' ' A' ' 783' ' ' SER . 60.3 ttt-85 -106.67 126.63 52.52 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.822 -179.226 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -139.77 132.44 28.92 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.066 0.46 . . . . 0.0 111.243 -177.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -156.36 138.87 14.94 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.668 -176.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 771' ' ' SER . . . . . 0.424 ' HA ' ' HA ' ' A' ' 780' ' ' ILE . 19.2 m -85.31 135.81 33.75 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.047 0.451 . . . . 0.0 110.191 178.172 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 3.9 m -116.0 124.42 50.45 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.79 -173.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 89.46 175.39 46.07 Favored Glycine 0 N--CA 1.453 -0.212 0 CA-C-N 115.838 -0.619 . . . . 0.0 112.727 178.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 774' ' ' GLU . . . . . 0.44 ' OE1' ' HD2' ' A' ' 778' ' ' ARG . 4.1 mm-40 -135.42 -167.2 1.97 Allowed 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 122.66 0.384 . . . . 0.0 110.117 178.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . 65.48 -132.11 35.24 Favored Glycine 0 N--CA 1.447 -0.597 0 C-N-CA 120.644 -0.789 . . . . 0.0 111.18 -177.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 16.0 pttp -107.36 6.36 28.3 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.133 0.492 . . . . 0.0 110.06 176.138 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -93.63 -11.04 32.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.657 177.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 778' ' ' ARG . . . . . 0.44 ' HD2' ' OE1' ' A' ' 774' ' ' GLU . 35.1 ttt180 -58.2 122.28 12.77 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.948 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 779' ' ' PHE . . . . . 0.413 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 28.4 p90 -131.46 -171.99 2.74 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 176.657 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 780' ' ' ILE . . . . . 0.424 ' HA ' ' HA ' ' A' ' 771' ' ' SER . 9.8 tt -127.96 131.82 69.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 121.198 0.523 . . . . 0.0 111.238 -177.779 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 13.4 m -113.71 119.22 36.66 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.345 -178.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 43.3 t -102.09 121.15 52.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.007 177.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 783' ' ' SER . . . . . 0.435 ' HB2' ' HD3' ' A' ' 768' ' ' ARG . 4.2 m -109.3 138.96 44.85 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-O 120.738 0.304 . . . . 0.0 110.322 -179.128 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 784' ' ' LYS . . . . . 0.47 ' HG3' ' CZ ' ' A' ' 736' ' ' PHE . 61.4 mtpt -66.95 -51.97 48.65 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.663 178.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 58.7 mmt-85 -118.91 -76.98 0.57 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.357 176.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.288 -0.863 . . . . 0.0 110.064 179.209 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 801' ' ' DGP . . . . . 0.519 " H4'" ' HB2' ' A' ' 756' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo . . . . . 0 N--CA 1.477 0.507 0 N-CA-C 110.293 -0.695 . . . . 0.0 110.293 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 718' ' ' GLU . . . . . 0.451 ' HB3' HG22 ' A' ' 720' ' ' VAL . 5.2 mp0 -105.39 -75.78 0.62 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.49 -175.359 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . 107.28 -12.32 40.15 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.641 -0.79 . . . . 0.0 111.995 179.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 720' ' ' VAL . . . . . 0.451 HG22 ' HB3' ' A' ' 718' ' ' GLU . 22.0 m -90.7 20.7 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.504 -0.348 . . . . 0.0 111.191 -176.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -54.16 -34.34 60.2 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.522 177.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 53.7 m -147.4 93.72 2.28 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.105 175.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -73.77 -72.17 0.28 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.285 178.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -82.53 -86.89 0.1 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.856 176.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . 51.27 45.74 52.17 Favored Glycine 0 C--N 1.333 0.394 0 O-C-N 123.608 0.567 . . . . 0.0 113.259 175.507 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 6.7 p -108.58 112.63 41.2 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.684 0 CA-C-O 121.809 0.814 . . . . 0.0 109.933 -179.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 727' ' ' ASP . . . . . 0.443 ' HB3' ' HB3' ' A' ' 730' ' ' ARG . 3.3 t70 -138.4 154.95 48.9 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 114.777 -1.101 . . . . 0.0 108.606 178.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 15.6 t60 -54.24 -61.42 2.31 Favored 'General case' 0 C--N 1.331 -0.198 0 O-C-N 123.203 0.314 . . . . 0.0 110.63 -177.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -71.21 -33.01 69.52 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.466 -0.333 . . . . 0.0 110.755 -175.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 730' ' ' ARG . . . . . 0.443 ' HB3' ' HB3' ' A' ' 727' ' ' ASP . 10.4 tpt180 -55.31 -47.74 75.16 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.938 0.399 . . . . 0.0 110.355 173.054 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 731' ' ' ALA . . . . . 0.408 ' HA ' HG12 ' A' ' 734' ' ' VAL . . . -64.89 -42.34 94.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.43 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 35.6 mmm -60.62 -39.6 88.81 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.011 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 733' ' ' ILE . . . . . 0.435 HD11 HG13 ' A' ' 758' ' ' VAL . 74.3 mt -74.93 -45.45 43.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.781 -178.412 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 734' ' ' VAL . . . . . 0.408 HG12 ' HA ' ' A' ' 731' ' ' ALA . 11.3 p -66.33 -37.42 79.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 C-N-CA 120.648 -0.421 . . . . 0.0 110.911 -177.577 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -80.59 -21.6 41.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.752 0.311 . . . . 0.0 110.374 178.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 736' ' ' PHE . . . . . 0.599 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 15.8 t80 -61.16 -46.08 91.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.532 174.015 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 64.7 mtm -60.66 -34.53 74.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.546 178.036 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -78.86 -29.63 44.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.182 -179.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 68.6 m -73.55 -17.64 61.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.064 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 58.5 mttp 69.99 17.25 7.46 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 173.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 741' ' ' LYS . . . . . 0.474 ' HE2' ' O ' ' A' ' 743' ' ' GLN . 46.1 mtpt -69.7 139.01 53.38 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 172.13 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -73.31 -31.14 63.84 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.854 0.359 . . . . 0.0 110.675 -178.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 743' ' ' GLN . . . . . 0.474 ' O ' ' HE2' ' A' ' 741' ' ' LYS . 54.9 mt-30 -143.73 136.94 27.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.943 -0.572 . . . . 0.0 109.726 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 744' ' ' LEU . . . . . 0.599 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 52.9 tp -112.24 110.74 21.16 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 176.235 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 745' ' ' GLU . . . . . 0.411 ' H ' ' CD ' ' A' ' 745' ' ' GLU . 0.7 OUTLIER -86.07 108.02 18.08 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.741 178.616 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . 60.6 m-85 -78.97 154.33 77.73 Favored Pre-proline 0 C--N 1.322 -0.623 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.401 177.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 747' ' ' PRO . . . . . 0.46 ' O ' HD13 ' A' ' 750' ' ' LEU . 31.5 Cg_exo -60.4 147.78 92.83 Favored 'Trans proline' 0 CA--C 1.529 0.269 0 C-N-CA 122.689 2.259 . . . . 0.0 112.233 178.029 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -70.73 -7.45 21.37 Favored 'Trans proline' 0 CA--C 1.528 0.187 0 C-N-CA 122.704 2.269 . . . . 0.0 112.689 179.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 24.6 m -71.11 -16.88 62.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.377 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 750' ' ' LEU . . . . . 0.46 HD13 ' O ' ' A' ' 747' ' ' PRO . 10.9 mp -59.97 118.91 6.82 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.096 174.429 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 751' ' ' ASN . . . . . 0.54 ' ND2' ' H ' ' A' ' 753' ' ' HIS . 1.5 p-10 -88.11 -178.69 6.02 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 177.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 19.7 m -53.19 -31.41 42.69 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -176.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 753' ' ' HIS . . . . . 0.54 ' H ' ' ND2' ' A' ' 751' ' ' ASN . 61.8 m170 -79.42 -37.72 36.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.457 0.17 . . . . 0.0 111.124 -179.194 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 754' ' ' ASP . . . . . 0.428 ' HB3' ' HG ' ' A' ' 750' ' ' LEU . 67.6 m-20 -66.43 -44.39 83.02 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.222 0.534 . . . . 0.0 109.758 177.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 755' ' ' ARG . . . . . 0.415 ' CB ' " H5'" ' A' ' 801' ' ' DGP . 74.8 mtt180 -60.6 -50.28 74.16 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.179 177.309 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 756' ' ' LEU . . . . . 0.568 ' HB2' " H4'" ' A' ' 801' ' ' DGP . 55.8 tp -54.54 -39.69 67.93 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.702 179.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 757' ' ' ARG . . . . . 0.416 ' HB3' ' O ' ' A' ' 754' ' ' ASP . 3.8 tpt180 -55.98 -51.78 66.52 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.202 175.305 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 758' ' ' VAL . . . . . 0.435 HG13 HD11 ' A' ' 733' ' ' ILE . 85.5 t -61.33 -49.22 85.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.974 179.356 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 89.6 m-70 -53.59 -56.28 18.5 Favored 'General case' 0 N--CA 1.463 0.217 0 O-C-N 123.419 0.449 . . . . 0.0 110.838 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -55.97 -45.24 78.98 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.057 0.392 . . . . 0.0 112.057 -179.173 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 98.5 mt -66.69 -48.55 79.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.574 0.226 . . . . 0.0 111.069 -178.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -65.44 -32.13 73.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.916 0.389 . . . . 0.0 110.68 -179.029 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 763' ' ' GLU . . . . . 0.409 ' CD ' HN21 ' A' ' 801' ' ' DGP . 24.7 tt0 -69.74 -33.45 72.47 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.347 178.56 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -73.46 -35.85 65.77 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.018 176.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 -67.19 -35.98 80.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.682 175.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 102.01 19.02 15.81 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.18 -179.251 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 71.2 mt -92.35 178.48 5.82 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 18.4 ttt180 -96.43 140.04 31.67 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 174.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.1 p80 -145.63 123.31 11.85 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.22 -179.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -151.07 167.52 27.43 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.07 -179.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 15.1 m -108.53 141.67 40.08 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 121.029 0.443 . . . . 0.0 110.745 -177.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 23.8 t -131.28 146.13 52.18 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.855 -178.058 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 80.68 165.34 33.02 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.727 -0.749 . . . . 0.0 111.798 -176.124 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -128.9 166.1 19.77 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.823 0.311 . . . . 0.0 110.414 179.25 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . 68.08 -133.79 29.06 Favored Glycine 0 N--CA 1.445 -0.715 0 C-N-CA 121.085 -0.579 . . . . 0.0 112.047 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp -91.35 8.38 36.39 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.125 0.488 . . . . 0.0 110.475 178.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 58.9 mtm180 -104.81 3.36 31.05 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.266 170.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 778' ' ' ARG . . . . . . . . . . . . . 19.8 ttt180 -80.73 115.45 20.23 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.598 178.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 45.7 p90 -133.8 166.69 22.07 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.406 -0.815 . . . . 0.0 109.794 -177.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 12.2 tt -102.49 132.59 48.24 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-O 121.155 0.503 . . . . 0.0 110.489 -179.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 6.1 m -113.6 118.75 35.27 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.047 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 50.4 t -98.57 130.23 47.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 177.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 8.5 t -122.26 142.26 50.64 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.063 0.459 . . . . 0.0 110.249 -177.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 9.6 mtpm? -78.69 143.41 36.29 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.751 -178.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 16.5 mtm180 -103.83 -4.57 23.39 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.472 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.16 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.164 175.244 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 801' ' ' DGP . . . . . 0.568 " H4'" ' HB2' ' A' ' 756' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_exo . . . . . 0 N--CA 1.479 0.65 0 N-CA-C 110.765 -0.513 . . . . 0.0 110.765 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 62.83 95.63 0.04 OUTLIER 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.472 0.653 . . . . 0.0 111.02 177.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . 105.61 56.75 0.67 Allowed Glycine 0 N--CA 1.444 -0.827 0 N-CA-C 111.12 -0.792 . . . . 0.0 111.12 -175.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 5.3 p -77.51 108.33 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 CA-C-O 121.715 0.769 . . . . 0.0 110.242 -178.737 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -76.84 93.23 3.7 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.141 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 23.1 t -147.9 120.49 8.56 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.493 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -68.17 -64.44 0.86 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.259 -176.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -71.35 -35.47 71.17 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-O 121.259 0.552 . . . . 0.0 110.124 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . 121.04 -50.38 0.83 Allowed Glycine 0 N--CA 1.444 -0.81 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.586 -179.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 11.2 p -135.62 136.59 50.38 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 CA-C-O 120.975 0.417 . . . . 0.0 110.664 -176.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 727' ' ' ASP . . . . . 0.509 ' HB3' ' HB2' ' A' ' 730' ' ' ARG . 4.5 t70 -64.14 140.37 58.86 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.899 175.553 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 14.3 t60 -61.22 -57.77 11.07 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.621 -172.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -72.35 -22.6 61.13 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.903 -175.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 730' ' ' ARG . . . . . 0.509 ' HB2' ' HB3' ' A' ' 727' ' ' ASP . 0.4 OUTLIER -60.7 -49.59 76.9 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 172.658 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 731' ' ' ALA . . . . . 0.512 ' HA ' HG12 ' A' ' 734' ' ' VAL . . . -59.81 -46.15 90.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.548 178.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 35.5 mmm -55.48 -44.55 76.58 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.011 178.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 59.1 mt -77.38 -38.22 26.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.188 -0.46 . . . . 0.0 112.003 -176.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 734' ' ' VAL . . . . . 0.512 HG12 ' HA ' ' A' ' 731' ' ' ALA . 8.8 p -68.01 -36.69 76.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 O-C-N 122.036 -0.415 . . . . 0.0 110.666 -178.724 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -73.47 -31.77 63.96 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 121.153 0.501 . . . . 0.0 109.804 175.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 736' ' ' PHE . . . . . 0.535 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 22.1 t80 -63.46 -40.82 98.15 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.824 175.293 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 737' ' ' MET . . . . . 0.437 ' SD ' HD11 ' A' ' 767' ' ' LEU . 73.2 mtm -72.99 -6.86 48.26 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.998 0.428 . . . . 0.0 110.833 177.237 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -103.24 0.46 31.63 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.857 174.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 32.8 t -102.67 169.77 8.43 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.28 -178.168 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 2.6 ptmt -90.9 -6.54 54.01 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.063 -177.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 741' ' ' LYS . . . . . 0.542 ' O ' ' HE2' ' A' ' 784' ' ' LYS . 27.6 mtpp -64.47 126.25 27.23 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.586 177.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 3.2 mpp? -67.73 -30.32 69.77 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.439 176.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -149.17 155.0 39.99 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 120.904 0.383 . . . . 0.0 111.372 176.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 744' ' ' LEU . . . . . 0.535 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 69.0 tp -115.17 111.31 20.8 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.277 -176.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -82.72 105.74 13.99 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.417 178.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 746' ' ' PHE . . . . . 0.467 ' O ' ' HB2' ' A' ' 779' ' ' PHE . 71.8 m-85 -79.01 154.81 77.71 Favored Pre-proline 0 C--N 1.325 -0.489 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 176.254 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 747' ' ' PRO . . . . . 0.445 ' O ' HD13 ' A' ' 750' ' ' LEU . 59.6 Cg_endo -76.4 156.39 36.84 Favored 'Trans proline' 0 CA--C 1.533 0.452 0 C-N-CA 122.453 2.102 . . . . 0.0 112.24 178.295 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -68.75 -5.12 14.68 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.959 2.44 . . . . 0.0 113.203 -179.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 4.4 p -69.23 -16.93 63.71 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.86 -178.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 750' ' ' LEU . . . . . 0.445 HD13 ' O ' ' A' ' 747' ' ' PRO . 11.2 mp -63.55 117.98 7.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.337 176.057 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -78.8 -176.95 5.22 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 20.0 t -54.47 -39.51 67.53 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 120.768 0.318 . . . . 0.0 110.871 -177.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 40.1 m80 -73.25 -38.83 65.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.304 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 754' ' ' ASP . . . . . 0.423 ' HB3' ' HG ' ' A' ' 750' ' ' LEU . 66.2 m-20 -63.37 -48.1 79.31 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.928 0.394 . . . . 0.0 110.259 179.287 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 755' ' ' ARG . . . . . 0.563 ' HB2' H5'' ' A' ' 801' ' ' DGP . 74.0 mtt180 -60.62 -46.77 89.02 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.985 177.518 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 60.9 tp -55.2 -44.38 75.28 Favored 'General case' 0 CA--C 1.523 -0.066 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.727 179.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 757' ' ' ARG . . . . . 0.457 ' HE ' ' HA ' ' A' ' 757' ' ' ARG . 2.6 mmp_? -51.5 -54.82 23.19 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.474 174.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 90.6 t -60.21 -46.79 94.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.495 -178.136 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -56.93 -52.22 66.04 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 110.314 -0.254 . . . . 0.0 110.314 178.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 99.3 mt-30 -56.71 -43.68 80.82 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.462 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 95.4 mt -67.08 -50.06 67.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.257 -178.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -62.14 -38.66 89.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.045 0.45 . . . . 0.0 110.523 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -68.03 -30.68 69.97 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.554 178.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -76.49 -42.42 43.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.502 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 38.0 m-70 -75.41 -28.34 59.37 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.956 -179.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 103.67 24.42 7.79 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.657 177.411 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 767' ' ' LEU . . . . . 0.437 HD11 ' SD ' ' A' ' 737' ' ' MET . 79.2 mt -96.16 164.34 12.72 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.878 -0.415 . . . . 0.0 109.878 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 37.9 ttp180 -93.63 112.92 24.9 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.953 0.406 . . . . 0.0 110.151 -178.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . 0.442 ' H ' ' CD2' ' A' ' 769' ' ' HIS . 2.9 p80 -108.54 124.25 50.17 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.625 -178.229 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -137.7 130.27 29.7 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.298 -179.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 771' ' ' SER . . . . . 0.448 ' HA ' ' HA ' ' A' ' 780' ' ' ILE . 12.5 p -96.07 139.62 31.98 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.794 179.054 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 19.2 m -129.45 141.11 51.1 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.178 -177.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 110.67 176.29 20.61 Favored Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.647 -0.787 . . . . 0.0 111.49 -179.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -124.11 108.97 12.9 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.79 0.295 . . . . 0.0 111.424 -175.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . 54.66 -99.34 0.06 OUTLIER Glycine 0 C--N 1.332 0.347 0 CA-C-N 115.673 -0.694 . . . . 0.0 114.043 174.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 58.7 tptt -60.18 -34.48 73.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.097 0.475 . . . . 0.0 111.151 -178.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 68.4 mtp180 -106.48 20.01 19.64 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.752 -177.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 778' ' ' ARG . . . . . 0.404 ' HE ' ' HB2' ' A' ' 771' ' ' SER . 78.9 ttt180 -87.61 122.42 31.27 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.912 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 779' ' ' PHE . . . . . 0.467 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 48.1 p90 -121.77 171.96 8.5 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.157 175.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 780' ' ' ILE . . . . . 0.448 ' HA ' ' HA ' ' A' ' 771' ' ' SER . 12.3 tt -120.68 138.39 51.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 121.063 0.459 . . . . 0.0 110.79 -178.696 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 8.8 m -121.86 120.91 35.92 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.374 -179.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 50.1 t -99.8 115.6 41.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 177.363 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 29.2 t -110.92 136.18 50.34 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 121.266 0.555 . . . . 0.0 110.553 -178.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 784' ' ' LYS . . . . . 0.542 ' HE2' ' O ' ' A' ' 741' ' ' LYS . 52.8 mtmt -80.28 -22.67 41.37 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.136 178.509 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -91.73 109.41 20.73 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.585 -177.828 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.958 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.083 172.912 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 801' ' ' DGP . . . . . 0.563 H5'' ' HB2' ' A' ' 755' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_exo . . . . . 0 N--CA 1.481 0.749 0 N-CA-C 110.48 -0.623 . . . . 0.0 110.48 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -69.36 -39.01 78.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.156 0.503 . . . . 0.0 109.843 178.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . -176.19 144.52 7.06 Favored Glycine 0 N--CA 1.444 -0.784 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.727 177.109 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 40.7 t -94.54 96.25 5.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 175.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -75.67 125.86 29.88 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.578 -172.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 22.8 t -88.02 89.22 7.91 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 172.314 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -73.72 -64.51 0.98 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.127 -177.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -97.86 105.07 17.15 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 174.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . -116.74 39.91 2.54 Favored Glycine 0 N--CA 1.444 -0.797 0 C-N-CA 120.481 -0.866 . . . . 0.0 112.242 -176.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 3.7 p -119.24 89.87 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.666 0 CA-C-O 122.674 1.225 . . . . 0.0 110.523 -179.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 727' ' ' ASP . . . . . 0.428 ' HB3' ' HB3' ' A' ' 730' ' ' ARG . 17.2 t70 -140.94 133.46 28.53 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 113.76 -1.564 . . . . 0.0 108.428 174.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 13.4 t60 -61.1 -49.2 78.24 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 123.344 0.403 . . . . 0.0 110.793 -173.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -71.97 -38.27 69.76 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.994 -176.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 730' ' ' ARG . . . . . 0.428 ' HB3' ' HB3' ' A' ' 727' ' ' ASP . 42.1 ttt85 -62.54 -38.84 91.58 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.184 176.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -64.65 -45.56 86.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.241 176.639 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 32.9 mmm -58.01 -42.74 85.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.886 177.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 733' ' ' ILE . . . . . 0.43 HD11 HG13 ' A' ' 758' ' ' VAL . 72.8 mt -72.25 -42.92 66.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 N-CA-C 111.908 0.336 . . . . 0.0 111.908 -177.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 8.2 p -65.97 -36.99 78.82 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.576 -178.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -78.21 -24.44 47.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.073 0.463 . . . . 0.0 110.405 177.132 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 736' ' ' PHE . . . . . 0.551 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 34.9 t80 -64.43 -41.59 96.49 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.537 175.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 59.7 mtm -64.02 -28.81 70.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.844 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -85.81 -15.29 42.45 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.229 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 61.6 m -81.33 166.87 20.09 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.45 -179.271 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.98 7.22 44.94 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.924 0.392 . . . . 0.0 111.466 -179.579 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 73.5 mttt -85.22 126.92 34.06 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.024 173.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 95.5 mmm -81.6 -17.88 46.71 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.886 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -138.76 136.21 35.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.684 -178.178 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 744' ' ' LEU . . . . . 0.551 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 44.3 tp -120.17 109.97 16.06 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.096 178.62 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -90.09 113.08 24.75 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.457 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 746' ' ' PHE . . . . . 0.484 ' O ' ' HB2' ' A' ' 779' ' ' PHE . 84.1 m-85 -83.08 153.47 66.59 Favored Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.964 176.338 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 747' ' ' PRO . . . . . 0.438 ' O ' HD13 ' A' ' 750' ' ' LEU . 16.8 Cg_exo -67.18 155.79 69.1 Favored 'Trans proline' 0 CA--C 1.532 0.394 0 C-N-CA 122.508 2.139 . . . . 0.0 112.44 178.445 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -68.19 -7.71 20.73 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.838 2.359 . . . . 0.0 112.394 177.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 7.3 m -63.89 -20.25 65.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.552 179.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 750' ' ' LEU . . . . . 0.438 HD13 ' O ' ' A' ' 747' ' ' PRO . 11.2 mp -63.34 122.74 16.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.352 176.445 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 1.6 p30 -84.42 -178.61 6.96 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 15.2 m -48.55 -46.57 39.11 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 123.166 0.291 . . . . 0.0 111.381 179.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 50.9 m80 -72.03 -36.9 69.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.636 -178.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 -60.36 -50.67 72.69 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.133 0.492 . . . . 0.0 109.801 178.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 62.8 mtt85 -61.0 -45.15 95.98 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.181 178.334 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 756' ' ' LEU . . . . . 0.522 ' HB2' " H4'" ' A' ' 801' ' ' DGP . 53.4 tp -52.98 -42.81 65.89 Favored 'General case' 0 C--O 1.235 0.334 0 O-C-N 123.535 0.522 . . . . 0.0 111.03 -179.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 11.0 mmm180 -58.83 -53.69 55.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.017 176.168 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 758' ' ' VAL . . . . . 0.43 HG13 HD11 ' A' ' 733' ' ' ILE . 60.9 t -56.79 -48.68 80.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.401 -179.378 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -55.28 -55.3 33.01 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.596 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 760' ' ' GLN . . . . . 0.424 HE21 HD11 ' A' ' 756' ' ' LEU . 70.3 mt-30 -64.47 -33.37 75.73 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 -176.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 96.9 mt -70.14 -48.64 60.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 C-N-CA 120.894 -0.323 . . . . 0.0 110.464 178.057 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -63.49 -34.6 78.13 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.167 0.508 . . . . 0.0 110.28 177.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 763' ' ' GLU . . . . . 0.478 ' CD ' HN21 ' A' ' 801' ' ' DGP . 38.2 tt0 -64.28 -36.7 84.94 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.652 176.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -70.02 -46.54 64.85 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.189 176.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 11.2 m-70 -65.15 -30.12 71.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.108 -178.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 95.01 25.18 15.03 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.767 -0.73 . . . . 0.0 111.825 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 68.1 mt -99.3 176.93 5.36 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 22.6 ttp180 -99.66 135.29 41.29 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -132.69 127.69 35.33 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.189 0.518 . . . . 0.0 110.691 -178.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -133.85 143.12 48.12 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.98 -177.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 771' ' ' SER . . . . . 0.404 ' HB2' ' HE ' ' A' ' 778' ' ' ARG . 12.7 p -114.29 127.88 56.09 Favored 'General case' 0 C--N 1.317 -0.848 0 CA-C-O 121.275 0.56 . . . . 0.0 110.296 175.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -152.32 157.87 41.96 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.113 -174.204 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 773' ' ' GLY . . . . . 0.4 ' HA3' ' HA ' ' A' ' 778' ' ' ARG . . . 128.85 159.9 10.11 Favored Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 111.382 -0.687 . . . . 0.0 111.382 -177.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -81.31 92.0 6.31 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -175.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . 56.25 -92.28 0.02 OUTLIER Glycine 0 C--N 1.334 0.424 0 O-C-N 123.68 0.613 . . . . 0.0 113.881 172.104 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . 0.578 ' HD2' ' H ' ' A' ' 776' ' ' LYS . 10.9 mptt -65.09 -34.44 78.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.282 0.563 . . . . 0.0 109.551 179.557 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.78 16.64 10.39 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.985 -178.604 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 778' ' ' ARG . . . . . 0.404 ' HE ' ' HB2' ' A' ' 771' ' ' SER . 67.7 ttt180 -76.79 116.59 17.6 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 121.525 0.678 . . . . 0.0 110.13 177.151 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 779' ' ' PHE . . . . . 0.484 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 44.4 p90 -122.85 -172.01 2.4 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.208 -0.906 . . . . 0.0 109.833 -178.312 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 12.6 tt -127.5 133.82 66.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-O 120.984 0.421 . . . . 0.0 110.773 -178.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 24.7 m -119.71 116.01 25.08 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.415 -179.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 38.0 t -94.36 133.88 33.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.872 179.661 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -117.02 135.03 54.01 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.764 0.316 . . . . 0.0 111.16 -179.421 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 23.2 mtpp -66.16 147.15 53.77 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.171 175.267 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 785' ' ' ARG . . . . . 0.478 ' HA ' ' NE ' ' A' ' 785' ' ' ARG . 4.2 mmp_? -133.1 118.37 18.65 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.586 -176.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.973 0 CA-C-O 118.703 -0.665 . . . . 0.0 110.255 -178.884 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 801' ' ' DGP . . . . . 0.522 " H4'" ' HB2' ' A' ' 756' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo . . . . . 0 N--CA 1.478 0.567 0 N-CA-C 110.133 -0.756 . . . . 0.0 110.133 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -108.92 125.67 52.26 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.967 0.413 . . . . 0.0 110.49 -176.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . 172.05 139.75 2.9 Favored Glycine 0 N--CA 1.443 -0.849 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.709 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 16.4 t 58.59 67.3 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.651 0.739 . . . . 0.0 110.363 -178.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 721' ' ' GLU . . . . . 0.43 ' H ' ' CD ' ' A' ' 721' ' ' GLU . 0.3 OUTLIER -97.34 70.26 2.3 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.791 0.805 . . . . 0.0 109.512 178.202 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 7.6 m -69.33 97.49 0.96 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.012 -0.994 . . . . 0.0 111.415 -174.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 92.4 mt-30 -129.99 -52.38 1.13 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.042 175.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -82.78 67.62 8.92 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.688 0.756 . . . . 0.0 110.415 175.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . -162.6 36.76 0.35 Allowed Glycine 0 N--CA 1.441 -1.0 0 CA-C-N 114.942 -1.027 . . . . 0.0 110.87 178.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 3.1 p -111.61 92.54 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.791 0 CA-C-O 122.415 1.103 . . . . 0.0 109.906 -177.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 727' ' ' ASP . . . . . 0.495 ' HB3' ' HB3' ' A' ' 730' ' ' ARG . 5.7 t70 -140.06 133.77 30.43 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 113.839 -1.528 . . . . 0.0 108.17 179.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 30.6 t60 -55.4 -43.95 75.72 Favored 'General case' 0 C--N 1.327 -0.411 0 O-C-N 123.366 0.416 . . . . 0.0 111.359 -173.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 729' ' ' PHE . . . . . 0.467 ' CZ ' ' HB3' ' A' ' 754' ' ' ASP . 55.6 m-85 -80.98 -36.47 30.69 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.679 -175.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 730' ' ' ARG . . . . . 0.495 ' HB3' ' HB3' ' A' ' 727' ' ' ASP . 15.2 tpp85 -56.95 -43.72 81.86 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 174.427 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -64.63 -47.46 78.45 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.239 -179.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 4.5 mtm -65.78 -35.52 80.95 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.164 -178.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 733' ' ' ILE . . . . . 0.507 HD11 HG13 ' A' ' 758' ' ' VAL . 81.2 mt -73.27 -42.78 57.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.581 -0.282 . . . . 0.0 111.535 179.392 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 9.1 p -66.06 -37.53 79.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 120.594 -0.442 . . . . 0.0 110.975 -176.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -75.14 -29.3 60.45 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.881 0.372 . . . . 0.0 110.251 176.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 736' ' ' PHE . . . . . 0.535 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 36.1 t80 -61.8 -40.11 94.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.1 176.535 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 49.1 mtm -62.46 -33.19 74.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.788 178.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -92.08 3.58 54.98 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.069 -178.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 22.8 t -97.44 166.99 11.27 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -88.72 -1.17 57.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.79 0.329 . . . . 0.0 111.132 -178.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 741' ' ' LYS . . . . . 0.509 ' O ' ' HE2' ' A' ' 784' ' ' LYS . 97.0 mttt -66.64 133.13 49.62 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 173.69 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 27.2 ptt? -88.26 -23.2 23.57 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 178.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 743' ' ' GLN . . . . . 0.406 ' HA ' ' O ' ' A' ' 782' ' ' VAL . 4.2 pt20 -141.73 140.46 33.13 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.19 -179.13 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 744' ' ' LEU . . . . . 0.535 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 57.0 tp -118.76 103.65 9.85 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.353 177.437 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 745' ' ' GLU . . . . . 0.444 ' H ' ' CD ' ' A' ' 745' ' ' GLU . 0.1 OUTLIER -87.69 109.22 19.53 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.855 179.295 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 746' ' ' PHE . . . . . 0.412 ' HA ' ' HD3' ' A' ' 747' ' ' PRO . 75.3 m-85 -77.01 148.3 78.41 Favored Pre-proline 0 C--N 1.321 -0.669 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.36 178.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 747' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 746' ' ' PHE . 25.5 Cg_exo -62.66 151.14 85.24 Favored 'Trans proline' 0 CA--C 1.529 0.263 0 C-N-CA 122.711 2.274 . . . . 0.0 112.237 179.348 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -65.76 -7.4 16.46 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.781 2.321 . . . . 0.0 112.619 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 41.6 t -68.63 -17.64 64.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.953 178.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.1 mp -66.07 110.69 3.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.919 173.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -82.08 -176.93 6.4 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 175.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 14.6 m -49.59 -48.56 48.75 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -174.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 753' ' ' HIS . . . . . 0.457 ' O ' ' HG2' ' A' ' 757' ' ' ARG . 37.4 t-80 -56.73 -46.84 81.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.508 178.099 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 754' ' ' ASP . . . . . 0.467 ' HB3' ' CZ ' ' A' ' 729' ' ' PHE . 58.9 m-20 -65.34 -46.63 79.48 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.803 -176.021 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 755' ' ' ARG . . . . . 0.545 ' HB2' H5'' ' A' ' 801' ' ' DGP . 80.8 mtt180 -59.66 -45.64 91.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.672 177.385 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 756' ' ' LEU . . . . . 0.529 ' HB2' " H4'" ' A' ' 801' ' ' DGP . 3.2 tm? -54.75 -45.82 74.21 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.768 179.173 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 757' ' ' ARG . . . . . 0.457 ' HG2' ' O ' ' A' ' 753' ' ' HIS . 31.1 mmm180 -54.69 -50.34 68.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.213 -0.448 . . . . 0.0 109.868 177.332 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 758' ' ' VAL . . . . . 0.507 HG13 HD11 ' A' ' 733' ' ' ILE . 73.6 t -59.24 -48.0 88.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.01 178.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 88.4 m-70 -54.74 -58.83 5.97 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.444 -0.343 . . . . 0.0 110.87 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -60.05 -36.23 76.85 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -177.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 91.5 mt -70.78 -48.43 57.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 C-N-CA 121.123 -0.231 . . . . 0.0 111.133 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -65.45 -34.32 78.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.208 0.528 . . . . 0.0 110.273 179.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 763' ' ' GLU . . . . . 0.481 ' CD ' HN21 ' A' ' 801' ' ' DGP . 35.2 tt0 -63.5 -37.27 86.66 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.241 176.337 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -74.0 -39.44 63.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.557 178.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 10.4 m170 -69.7 -22.18 63.43 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.36 179.369 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 89.37 23.39 34.35 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.112 179.047 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 72.2 mt -93.26 -179.38 5.05 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 -179.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 768' ' ' ARG . . . . . 0.408 ' HE ' ' HB3' ' A' ' 783' ' ' SER . 61.2 ttp180 -104.68 127.97 52.6 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 177.385 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 5.5 p80 -135.27 130.0 34.46 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.024 0.44 . . . . 0.0 110.681 -176.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -149.08 155.67 41.08 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.276 -178.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 15.8 m -103.81 146.75 28.18 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.724 -177.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 23.0 t -134.01 145.88 49.89 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 179.307 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 99.5 -174.88 27.51 Favored Glycine 0 N--CA 1.446 -0.633 0 C-N-CA 120.54 -0.838 . . . . 0.0 111.77 -178.288 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -136.07 132.81 36.64 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.452 0.168 . . . . 0.0 111.162 -176.037 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . 63.14 -116.42 9.32 Favored Glycine 0 C--N 1.331 0.272 0 CA-C-N 116.014 -0.539 . . . . 0.0 113.447 173.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -82.59 -15.55 51.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.847 0.356 . . . . 0.0 110.864 -178.332 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 83.6 mtt180 -96.5 12.3 31.98 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.81 175.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 778' ' ' ARG . . . . . . . . . . . . . 59.7 ttt180 -85.82 120.49 27.3 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.153 176.318 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 779' ' ' PHE . . . . . 0.401 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 40.7 p90 -120.59 178.46 4.67 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.402 -0.817 . . . . 0.0 109.473 178.272 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 11.5 tt -125.41 135.02 65.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-O 121.076 0.465 . . . . 0.0 110.678 -178.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 25.0 m -119.3 120.64 37.56 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.406 -179.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . 0.406 ' O ' ' HA ' ' A' ' 743' ' ' GLN . 46.9 t -101.13 133.73 43.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.967 178.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 783' ' ' SER . . . . . 0.408 ' HB3' ' HE ' ' A' ' 768' ' ' ARG . 48.4 t -121.26 140.48 51.99 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 784' ' ' LYS . . . . . 0.509 ' HE2' ' O ' ' A' ' 741' ' ' LYS . 51.3 mtmt -75.06 143.73 43.33 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.614 -178.139 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -107.29 89.7 3.08 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.13 179.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.471 -0.776 . . . . 0.0 110.301 -177.859 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 801' ' ' DGP . . . . . 0.545 H5'' ' HB2' ' A' ' 755' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_endo . . . . . 0 N--CA 1.48 0.724 0 N-CA-C 110.549 -0.597 . . . . 0.0 110.549 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -77.13 149.53 35.65 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.172 -178.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . 117.77 20.7 4.48 Favored Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 120.719 -0.753 . . . . 0.0 111.604 -175.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 34.6 m -69.73 -20.04 23.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-O 121.191 0.519 . . . . 0.0 110.595 -179.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -84.77 85.37 7.46 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 175.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 6.8 m -107.3 98.01 7.69 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.275 -174.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -128.4 135.79 50.01 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.757 0.313 . . . . 0.0 110.511 175.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -74.79 -70.29 0.42 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.991 -0.549 . . . . 0.0 109.801 175.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . -115.66 -118.84 3.18 Favored Glycine 0 N--CA 1.444 -0.8 0 N-CA-C 110.154 -1.178 . . . . 0.0 110.154 171.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 8.7 p -163.89 119.97 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 121.611 0.72 . . . . 0.0 110.412 172.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 727' ' ' ASP . . . . . 0.414 ' HB3' ' HB3' ' A' ' 730' ' ' ARG . 19.7 t70 -84.3 150.11 25.62 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.066 179.526 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 48.1 t60 -52.77 -54.28 36.14 Favored 'General case' 0 C--N 1.331 -0.237 0 O-C-N 123.374 0.421 . . . . 0.0 111.062 -178.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 29.9 m-85 -72.9 -30.74 64.16 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.46 -175.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 730' ' ' ARG . . . . . 0.414 ' HB3' ' HB3' ' A' ' 727' ' ' ASP . 16.6 tpp85 -61.63 -45.91 92.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.088 173.618 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -62.24 -46.72 87.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.95 179.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 22.7 mmm -62.11 -39.44 92.54 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.313 -179.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 733' ' ' ILE . . . . . 0.436 ' O ' ' HG3' ' A' ' 737' ' ' MET . 57.9 mt -75.84 -41.33 39.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -178.371 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 8.4 p -66.82 -34.08 67.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 C-N-CA 120.936 -0.305 . . . . 0.0 111.066 -177.605 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 61.7 mt-10 -76.97 -31.54 56.62 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.011 0.434 . . . . 0.0 110.087 175.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 736' ' ' PHE . . . . . 0.461 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 37.6 t80 -63.03 -37.29 86.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.522 178.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 737' ' ' MET . . . . . 0.436 ' HG3' ' O ' ' A' ' 733' ' ' ILE . 52.3 mtm -61.84 -26.51 68.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.944 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -101.65 4.08 40.44 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.122 0.486 . . . . 0.0 111.088 -178.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 40.2 t -88.99 166.63 13.78 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.974 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 30.2 mtpp -87.33 -10.37 52.4 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.861 0.362 . . . . 0.0 110.398 178.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 29.3 mtpp -67.6 124.46 23.32 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.269 177.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 22.9 ptp -75.37 -27.23 59.06 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.492 178.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -137.69 136.53 37.49 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.402 -178.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 744' ' ' LEU . . . . . 0.461 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 34.5 tp -106.89 104.99 14.8 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.19 -0.671 . . . . 0.0 109.19 176.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -87.76 104.6 16.71 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.979 -178.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 746' ' ' PHE . . . . . 0.406 ' HA ' ' HD3' ' A' ' 747' ' ' PRO . 68.2 m-85 -78.41 155.01 79.28 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.351 179.055 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 747' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 746' ' ' PHE . 14.5 Cg_exo -70.04 152.69 67.96 Favored 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 122.358 2.039 . . . . 0.0 111.892 176.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -65.83 -4.53 10.13 Favored 'Trans proline' 0 CA--C 1.529 0.244 0 C-N-CA 122.897 2.398 . . . . 0.0 112.394 178.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 11.6 m -67.57 -18.35 64.98 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.065 177.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 11.0 mp -70.4 109.29 4.68 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.983 -0.376 . . . . 0.0 109.983 175.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -78.2 -178.03 5.43 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 -179.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 20.0 m -52.85 -41.05 63.91 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 111.64 0.237 . . . . 0.0 111.64 -178.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 65.5 m170 -68.93 -44.35 73.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.499 0.19 . . . . 0.0 110.97 179.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -58.28 -49.01 78.64 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.156 0.503 . . . . 0.0 110.143 177.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 755' ' ' ARG . . . . . 0.44 HH11 ' HD3' ' A' ' 755' ' ' ARG . 24.0 mtm180 -63.72 -43.3 96.96 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.833 -179.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 756' ' ' LEU . . . . . 0.543 ' HB2' " H4'" ' A' ' 801' ' ' DGP . 54.4 tp -54.91 -42.35 72.08 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.872 0.367 . . . . 0.0 111.024 179.273 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 757' ' ' ARG . . . . . 0.434 ' HA ' ' NE ' ' A' ' 757' ' ' ARG . 1.9 mmp_? -62.9 -47.07 84.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.519 176.233 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 758' ' ' VAL . . . . . 0.468 ' CG1' HD13 ' A' ' 780' ' ' ILE . 99.7 t -59.5 -48.05 88.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.895 179.341 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 88.6 m-70 -55.27 -55.41 31.68 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 120.843 0.354 . . . . 0.0 110.438 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -62.43 -38.61 90.4 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.962 -178.223 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 85.2 mt -67.43 -44.97 86.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 C-N-CA 121.144 -0.222 . . . . 0.0 111.081 178.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -65.9 -36.91 84.7 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.18 0.514 . . . . 0.0 110.353 178.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -67.07 -33.38 75.37 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.825 175.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -71.5 -40.18 70.34 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.593 178.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -71.86 -30.66 65.67 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.136 176.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 96.15 31.97 6.98 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.717 -0.754 . . . . 0.0 111.945 -179.12 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 61.5 mt -104.75 -178.96 3.81 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 768' ' ' ARG . . . . . 0.515 ' HD3' ' O ' ' A' ' 786' ' ' ALA . 50.6 ttt180 -100.6 142.85 31.5 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 177.276 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.7 p80 -149.17 141.64 24.29 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.861 0.362 . . . . 0.0 110.785 -178.146 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -160.14 152.42 20.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.696 179.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 6.4 m -95.92 136.92 35.72 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.25 0.547 . . . . 0.0 110.904 -177.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 772' ' ' SER . . . . . 0.531 ' O ' ' HA ' ' A' ' 778' ' ' ARG . 46.8 t -114.99 144.21 43.96 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.419 -179.46 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 95.56 168.86 35.55 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.651 -0.785 . . . . 0.0 111.988 -177.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 774' ' ' GLU . . . . . 0.441 ' O ' ' HD2' ' A' ' 778' ' ' ARG . 26.1 mt-10 -87.73 -77.48 0.34 Allowed 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 -177.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . -125.32 -76.37 0.27 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.58 -176.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 53.2 mttp -70.89 -31.18 67.76 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.992 0.425 . . . . 0.0 110.023 178.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -83.06 -3.05 56.87 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.638 176.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 778' ' ' ARG . . . . . 0.531 ' HA ' ' O ' ' A' ' 772' ' ' SER . 30.9 ttt85 -78.36 115.18 17.89 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.721 0.772 . . . . 0.0 111.75 -174.363 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 49.9 p90 -128.86 -176.68 3.93 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 114.569 -1.196 . . . . 0.0 108.498 176.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 780' ' ' ILE . . . . . 0.468 HD13 ' CG1' ' A' ' 758' ' ' VAL . 17.1 tt -118.04 140.12 42.58 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 C-N-CA 120.405 -0.518 . . . . 0.0 110.905 -179.02 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 25.1 m -121.64 117.98 28.05 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.883 -0.598 . . . . 0.0 109.944 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 22.1 t -100.95 133.95 42.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 179.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 20.0 p -124.09 143.09 50.66 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.391 0.615 . . . . 0.0 110.964 178.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 56.2 mtpt -69.13 -50.52 47.18 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.421 -177.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 24.2 mmm180 -118.86 -59.22 1.88 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.379 -176.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 786' ' ' ALA . . . . . 0.515 ' O ' ' HD3' ' A' ' 768' ' ' ARG . . . . . . . . 0 C--O 1.245 0.862 0 CA-C-O 118.345 -0.836 . . . . 0.0 110.218 -179.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 801' ' ' DGP . . . . . 0.543 " H4'" ' HB2' ' A' ' 756' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo . . . . . 0 N--CA 1.475 0.436 0 N-CA-C 110.4 -0.654 . . . . 0.0 110.4 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -105.2 -77.79 0.58 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.272 0.558 . . . . 0.0 110.076 -179.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . -178.61 152.16 11.14 Favored Glycine 0 N--CA 1.446 -0.677 0 N-CA-C 110.598 -1.001 . . . . 0.0 110.598 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 35.5 m -107.82 -15.08 9.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 117.217 0.508 . . . . 0.0 110.802 -177.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 721' ' ' GLU . . . . . 0.464 ' H ' ' CD ' ' A' ' 721' ' ' GLU . 2.1 mp0 -71.74 -10.04 59.18 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.259 179.705 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 13.5 m -67.45 -17.57 64.75 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.823 178.043 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -139.97 -174.25 3.87 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.07 177.49 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -90.26 -4.57 57.09 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.227 0.537 . . . . 0.0 109.573 173.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . 91.82 -26.84 11.18 Favored Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 110.37 -1.092 . . . . 0.0 110.37 -170.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 27.9 t -106.91 91.49 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.654 0 CA-C-O 121.357 0.599 . . . . 0.0 110.098 176.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 727' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -84.94 152.27 23.63 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 170.302 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 728' ' ' HIS . . . . . 0.519 ' O ' ' HG3' ' A' ' 732' ' ' MET . 14.0 t60 -53.81 -50.91 65.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.094 0.473 . . . . 0.0 110.155 -176.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -77.88 -29.9 50.53 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.857 -176.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 44.6 ttm-85 -66.06 -37.88 86.93 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 176.416 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -65.84 -41.34 91.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.397 176.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 732' ' ' MET . . . . . 0.519 ' HG3' ' O ' ' A' ' 728' ' ' HIS . 93.5 mtp -63.81 -42.47 97.68 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.428 178.356 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 59.5 mt -71.51 -42.25 72.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.172 -0.467 . . . . 0.0 112.023 -178.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 11.4 p -65.3 -41.31 91.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 C-N-CA 120.784 -0.366 . . . . 0.0 111.162 -176.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -70.85 -33.09 70.29 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.963 0.411 . . . . 0.0 110.291 176.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 736' ' ' PHE . . . . . 0.497 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 11.7 t80 -59.97 -36.99 78.32 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.013 176.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 737' ' ' MET . . . . . 0.63 ' HA ' ' HD3' ' A' ' 784' ' ' LYS . 69.9 mtm -64.16 -32.28 73.8 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.62 177.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -92.4 9.12 35.55 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.791 0.329 . . . . 0.0 111.1 178.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 55.7 m -101.02 167.37 10.29 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.762 0.315 . . . . 0.0 110.87 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 740' ' ' LYS . . . . . 0.427 ' NZ ' ' HB2' ' A' ' 740' ' ' LYS . 0.1 OUTLIER -73.9 -30.02 62.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.179 -179.241 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -58.38 127.9 34.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.768 178.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 69.9 mtm -95.93 -10.62 28.26 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.84 0.353 . . . . 0.0 110.626 178.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 743' ' ' GLN . . . . . 0.41 ' HA ' ' O ' ' A' ' 782' ' ' VAL . 3.7 pt20 -139.67 126.85 21.17 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.063 174.285 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 744' ' ' LEU . . . . . 0.497 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 48.0 tp -102.1 105.69 16.45 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -87.25 105.68 17.39 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.744 178.276 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 746' ' ' PHE . . . . . 0.439 ' HA ' ' HD3' ' A' ' 747' ' ' PRO . 70.6 m-85 -76.04 146.07 78.27 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.821 -178.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 747' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 746' ' ' PHE . 33.1 Cg_exo -62.38 152.36 77.33 Favored 'Trans proline' 0 C--O 1.234 0.285 0 C-N-CA 122.971 2.448 . . . . 0.0 112.51 177.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -65.84 -3.93 9.08 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 123.143 2.562 . . . . 0.0 112.62 177.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 13.8 m -66.56 -25.16 66.51 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.721 176.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.1 mp -71.35 112.27 7.35 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.221 176.336 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 751' ' ' ASN . . . . . 0.434 ' O ' ' HG3' ' A' ' 755' ' ' ARG . 1.6 p-10 -86.31 -177.59 6.26 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 178.237 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 10.8 m -52.18 -45.46 65.13 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 112.592 0.589 . . . . 0.0 112.592 -170.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 33.2 m170 -66.7 -40.35 88.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.653 0.263 . . . . 0.0 111.62 -179.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -67.23 -41.56 85.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.926 0.393 . . . . 0.0 110.55 178.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 755' ' ' ARG . . . . . 0.434 ' HG3' ' O ' ' A' ' 751' ' ' ASN . 43.7 mtm-85 -64.35 -39.28 93.58 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.945 177.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 62.9 tp -54.34 -45.23 72.65 Favored 'General case' 0 C--N 1.332 -0.191 0 O-C-N 123.474 0.484 . . . . 0.0 110.855 176.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 7.7 mmt85 -55.41 -50.06 70.76 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.484 175.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 84.8 t -58.58 -48.32 85.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.02 179.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -56.28 -52.32 64.95 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.707 179.093 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -60.36 -41.7 94.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.753 -177.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 95.0 mt -68.82 -46.79 78.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.192 -179.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -63.54 -35.63 81.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.319 0.581 . . . . 0.0 110.021 178.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 763' ' ' GLU . . . . . 0.446 ' CD ' HN21 ' A' ' 801' ' ' DGP . 39.7 tt0 -63.5 -39.86 95.56 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.361 176.524 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -68.3 -44.75 74.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.839 178.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 27.1 m-70 -73.98 -21.44 60.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.61 -176.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 90.3 39.41 6.03 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.251 177.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 64.6 mt -111.12 169.62 8.65 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 178.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 37.3 ttm180 -90.05 132.08 35.58 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 177.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.8 p80 -138.82 136.63 35.83 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 120.726 0.298 . . . . 0.0 110.482 -177.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -162.4 147.67 12.53 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.523 177.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 771' ' ' SER . . . . . 0.466 ' HA ' ' HA ' ' A' ' 780' ' ' ILE . 9.7 m -109.74 138.97 45.34 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.263 178.154 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 6.2 t -122.16 154.23 37.71 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 -178.267 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 87.22 -174.08 45.07 Favored Glycine 0 N--CA 1.445 -0.738 0 C-N-CA 120.589 -0.815 . . . . 0.0 112.001 -177.038 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -146.45 170.27 17.2 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.842 0.354 . . . . 0.0 110.852 178.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . 62.8 -133.51 43.91 Favored Glycine 0 N--CA 1.448 -0.554 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.684 178.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -84.72 -1.97 56.95 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.705 0.288 . . . . 0.0 110.754 -176.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 -113.17 12.14 18.97 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.109 -179.446 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 778' ' ' ARG . . . . . . . . . . . . . 35.7 ttt180 -81.68 112.97 19.34 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 121.169 0.509 . . . . 0.0 109.96 173.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 50.8 p90 -118.76 160.4 21.95 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.858 -176.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 780' ' ' ILE . . . . . 0.466 ' HA ' ' HA ' ' A' ' 771' ' ' SER . 11.9 tt -114.77 133.65 60.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-O 121.184 0.516 . . . . 0.0 111.039 -176.595 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 34.5 m -115.6 124.03 49.92 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.328 178.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . 0.41 ' O ' ' HA ' ' A' ' 743' ' ' GLN . 59.1 t -103.61 119.7 52.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.692 176.67 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 13.9 m -113.41 133.64 55.07 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 121.049 0.452 . . . . 0.0 111.011 -176.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 784' ' ' LYS . . . . . 0.63 ' HD3' ' HA ' ' A' ' 737' ' ' MET . 56.8 mtmt -81.75 -7.92 59.64 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.83 0.824 . . . . 0.0 110.354 177.173 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 785' ' ' ARG . . . . . 0.641 ' HA ' ' NE ' ' A' ' 785' ' ' ARG . 3.2 mmp_? -92.29 84.75 5.24 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 114.872 -1.058 . . . . 0.0 109.436 172.231 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.954 0 CA-C-O 118.387 -0.816 . . . . 0.0 110.522 -177.509 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 801' ' ' DGP . . . . . 0.446 HN21 ' CD ' ' A' ' 763' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo . . . . . 0 N--CA 1.478 0.586 0 N-CA-C 110.918 -0.455 . . . . 0.0 110.918 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -129.03 178.95 6.03 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.876 178.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . 84.15 30.04 29.4 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.726 -0.749 . . . . 0.0 111.456 -177.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 45.0 t -83.58 -37.74 13.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.164 0.507 . . . . 0.0 110.303 -178.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -78.69 141.69 37.73 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.358 -179.552 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 14.6 m -96.89 -33.08 11.75 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.5 -178.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -101.63 112.15 24.63 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 178.19 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -67.57 -2.48 6.72 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -171.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . 89.51 79.79 1.33 Allowed Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 120.556 -0.831 . . . . 0.0 112.188 176.121 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 5.8 p -130.63 121.39 50.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.378 0.609 . . . . 0.0 110.955 -178.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 727' ' ' ASP . . . . . 0.437 ' HB2' ' HB2' ' A' ' 730' ' ' ARG . 4.1 m-20 -81.34 151.62 27.91 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.044 172.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 46.0 t60 -54.24 -48.11 71.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.294 0.569 . . . . 0.0 109.532 176.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -72.06 -26.09 62.04 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.261 -177.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 730' ' ' ARG . . . . . 0.437 ' HB2' ' HB2' ' A' ' 727' ' ' ASP . 12.0 tpt180 -65.77 -42.66 90.58 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 176.628 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -68.17 -46.05 71.77 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.629 177.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 35.5 mmm -56.96 -45.12 83.07 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.285 178.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 38.7 mt -67.28 -44.69 87.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.891 -177.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 12.4 p -66.75 -36.12 76.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 C-N-CA 120.298 -0.561 . . . . 0.0 111.015 -177.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 735' ' ' GLU . . . . . 0.404 ' O ' ' HB2' ' A' ' 739' ' ' SER . 45.4 mt-10 -71.88 -28.22 63.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.148 0.499 . . . . 0.0 110.402 176.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 736' ' ' PHE . . . . . 0.431 ' CE2' ' HG3' ' A' ' 784' ' ' LYS . 23.4 t80 -71.18 -40.55 71.19 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.287 174.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 87.2 mtp -62.37 -41.68 98.81 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.099 179.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -80.88 -6.05 58.15 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.278 -179.388 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 739' ' ' SER . . . . . 0.404 ' HB2' ' O ' ' A' ' 735' ' ' GLU . 14.7 t -92.91 167.33 11.9 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.593 -177.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -75.47 -9.68 58.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.817 178.218 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 741' ' ' LYS . . . . . 0.462 ' O ' ' HD3' ' A' ' 784' ' ' LYS . 61.9 mttp -61.35 133.6 56.01 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.538 -178.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 62.7 mtt -99.94 -17.36 17.6 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.076 177.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -144.71 140.53 28.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.155 175.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 744' ' ' LEU . . . . . 0.486 HD13 ' CZ ' ' A' ' 746' ' ' PHE . 0.8 OUTLIER -113.65 108.43 17.12 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 -179.935 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -85.63 96.35 9.64 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.439 176.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 746' ' ' PHE . . . . . 0.486 ' CZ ' HD13 ' A' ' 744' ' ' LEU . 61.1 m-85 -71.12 146.84 93.08 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.28 177.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -65.92 150.89 85.35 Favored 'Trans proline' 0 CA--C 1.529 0.247 0 C-N-CA 122.637 2.224 . . . . 0.0 112.509 -179.293 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -63.74 -6.22 10.33 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.845 2.363 . . . . 0.0 112.362 175.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 34.4 t -61.4 -25.18 67.02 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.077 174.155 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.1 mp -65.2 109.44 2.21 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.816 176.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -80.06 -177.37 6.0 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 173.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 20.0 m -57.68 -43.71 85.25 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -171.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 35.0 m80 -63.92 -39.82 95.04 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 120.954 0.406 . . . . 0.0 110.774 179.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -63.03 -49.03 76.2 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.706 178.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 755' ' ' ARG . . . . . 0.55 ' CB ' " H5'" ' A' ' 801' ' ' DGP . 63.8 mtt85 -57.6 -49.29 76.89 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.549 177.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 756' ' ' LEU . . . . . 0.479 ' HB2' " H4'" ' A' ' 801' ' ' DGP . 60.5 tp -54.72 -39.73 68.51 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.303 -179.009 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 23.8 tpt180 -65.04 -39.19 92.99 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.055 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 96.3 t -64.4 -50.98 73.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.752 176.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -53.8 -48.81 69.48 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 123.453 0.47 . . . . 0.0 110.243 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 760' ' ' GLN . . . . . 0.401 ' NE2' ' HG ' ' A' ' 756' ' ' LEU . 69.9 mt-30 -50.96 -51.27 54.19 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.888 176.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 88.5 mt -69.98 -42.33 79.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.439 -174.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -66.21 -38.16 87.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.075 0.464 . . . . 0.0 110.453 179.571 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 763' ' ' GLU . . . . . 0.523 ' CD ' HN21 ' A' ' 801' ' ' DGP . 29.7 tt0 -67.05 -36.64 82.5 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.127 177.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -65.76 -49.28 68.93 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.533 176.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 13.8 m170 -69.8 -29.42 66.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.636 -175.608 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 100.67 36.14 4.11 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.457 -0.877 . . . . 0.0 112.451 177.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 63.9 mt -111.85 170.64 8.01 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 32.5 ttp180 -89.89 136.52 32.99 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 178.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 5.5 p80 -137.45 121.95 18.39 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-O 121.464 0.65 . . . . 0.0 110.499 -179.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -144.1 153.76 42.49 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.239 -0.892 . . . . 0.0 109.971 -178.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 10.7 m -109.97 139.71 44.77 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.041 0.448 . . . . 0.0 110.57 -179.1 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 35.6 m -139.27 149.3 44.13 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.022 -177.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 134.41 177.46 14.96 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.596 -0.812 . . . . 0.0 111.923 178.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -105.64 107.55 18.6 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 -175.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . 59.42 -105.03 0.63 Allowed Glycine 0 N--CA 1.453 -0.168 0 CA-C-N 115.905 -0.589 . . . . 0.0 113.489 174.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -78.5 -23.72 46.23 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.015 0.436 . . . . 0.0 110.785 -178.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 61.1 mtp180 -85.71 13.44 7.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.023 0.439 . . . . 0.0 110.218 178.022 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 778' ' ' ARG . . . . . . . . . . . . . 50.4 ttt180 -72.61 116.96 13.7 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.964 175.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 44.1 p90 -118.92 165.27 14.28 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.781 -177.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 12.8 tt -104.09 133.82 47.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-O 121.163 0.506 . . . . 0.0 110.562 -178.571 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 781' ' ' THR . . . . . 0.456 ' HA ' ' O ' ' A' ' 744' ' ' LEU . 17.7 m -118.1 112.55 20.36 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.263 179.687 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 45.3 t -90.91 130.51 39.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 177.076 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 12.8 t -125.3 141.54 52.02 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.444 0.64 . . . . 0.0 111.492 -175.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 784' ' ' LYS . . . . . 0.462 ' HD3' ' O ' ' A' ' 741' ' ' LYS . 55.4 mtpt -92.68 -15.01 27.26 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-O 122.392 1.092 . . . . 0.0 108.7 175.517 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -99.89 111.27 23.59 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 113.473 -1.694 . . . . 0.0 111.016 -173.051 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.492 -0.766 . . . . 0.0 109.337 172.993 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 801' ' ' DGP . . . . . 0.55 " H5'" ' CB ' ' A' ' 755' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo . . . . . 0 N--CA 1.476 0.474 0 N-CA-C 110.796 -0.501 . . . . 0.0 110.796 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 718' ' ' GLU . . . . . 0.429 ' CD ' ' H ' ' A' ' 718' ' ' GLU . 1.7 mp0 -71.82 -43.05 66.24 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 177.583 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . 81.73 30.77 34.76 Favored Glycine 0 N--CA 1.446 -0.657 0 CA-C-N 115.533 -0.758 . . . . 0.0 112.656 179.23 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 23.2 t -107.06 78.76 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.11 0.481 . . . . 0.0 110.032 179.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -97.54 -30.22 13.0 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.742 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 17.4 m -79.91 96.05 6.26 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 177.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 16.7 tm0? -75.0 -50.5 16.33 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.495 -174.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -110.78 88.44 2.78 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.297 0.57 . . . . 0.0 110.224 -178.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . -140.66 49.51 0.78 Allowed Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 111.023 -0.831 . . . . 0.0 111.023 178.182 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 44.1 t -113.15 108.19 24.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.901 0.381 . . . . 0.0 110.072 -175.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 727' ' ' ASP . . . . . 0.431 ' HB3' ' HB3' ' A' ' 730' ' ' ARG . 14.4 t70 -129.1 139.11 52.12 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.04 178.69 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 27.4 t60 -65.82 -58.49 5.5 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.641 -177.029 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -70.04 -32.03 69.96 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.209 -173.389 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 730' ' ' ARG . . . . . 0.431 ' HB3' ' HB3' ' A' ' 727' ' ' ASP . 12.3 tpt180 -58.62 -49.7 76.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.141 0.496 . . . . 0.0 109.828 174.625 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -61.62 -48.58 80.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.805 178.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 46.8 mmm -56.38 -39.79 73.53 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.599 -179.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 43.0 mt -70.72 -49.15 53.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 12.9 p -65.52 -36.36 77.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 C-N-CA 120.732 -0.387 . . . . 0.0 111.08 -176.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -71.65 -32.29 67.75 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 121.089 0.471 . . . . 0.0 110.423 177.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 736' ' ' PHE . . . . . 0.574 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 24.4 t80 -65.59 -36.54 84.06 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.518 175.596 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 737' ' ' MET . . . . . 0.513 ' HA ' ' HD3' ' A' ' 784' ' ' LYS . 84.9 mtp -65.83 -27.1 68.0 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.331 176.633 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -91.71 -0.62 57.57 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.743 178.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 24.3 t -97.0 168.15 10.64 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.584 -178.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 740' ' ' LYS . . . . . 0.574 ' HA ' ' HE2' ' A' ' 740' ' ' LYS . 11.0 mmpt? -84.6 -11.59 55.71 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.186 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 741' ' ' LYS . . . . . 0.474 ' O ' ' HE2' ' A' ' 784' ' ' LYS . 59.9 mttp -67.31 129.57 40.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.112 177.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 70.2 mtm -91.09 -17.83 25.55 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.648 177.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -136.13 130.06 32.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.605 179.121 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 744' ' ' LEU . . . . . 0.574 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 45.8 tp -112.95 109.0 18.14 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.786 177.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -94.36 110.14 21.93 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.158 -178.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 746' ' ' PHE . . . . . 0.52 ' O ' ' HB2' ' A' ' 779' ' ' PHE . 72.2 m-85 -80.53 156.56 73.23 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.158 -178.444 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 747' ' ' PRO . . . . . 0.435 ' O ' HD13 ' A' ' 750' ' ' LEU . 40.2 Cg_exo -58.9 156.33 33.9 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.966 2.444 . . . . 0.0 112.565 177.353 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -74.19 -11.76 23.15 Favored 'Trans proline' 0 CA--C 1.53 0.295 0 C-N-CA 122.764 2.309 . . . . 0.0 112.77 178.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 17.6 m -71.59 -12.61 61.44 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.989 -0.55 . . . . 0.0 112.354 -176.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 750' ' ' LEU . . . . . 0.435 HD13 ' O ' ' A' ' 747' ' ' PRO . 11.2 mp -61.22 121.53 12.79 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 110.416 -0.216 . . . . 0.0 110.416 176.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 751' ' ' ASN . . . . . 0.571 ' O ' ' HG2' ' A' ' 755' ' ' ARG . 2.0 p30 -80.38 176.92 9.35 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 179.495 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 14.4 t -53.6 -37.26 62.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.913 0.387 . . . . 0.0 111.352 -177.04 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 73.8 m80 -76.07 -27.87 57.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.976 -179.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -72.25 -40.37 67.73 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 175.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 755' ' ' ARG . . . . . 0.571 ' HG2' ' O ' ' A' ' 751' ' ' ASN . 33.1 mmt180 -56.69 -58.58 7.45 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.51 175.181 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 62.0 tp -54.16 -38.63 65.74 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 114.871 -1.059 . . . . 0.0 111.045 -178.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 26.5 tpt180 -57.45 -48.53 78.9 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 120.996 0.427 . . . . 0.0 110.187 178.034 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 79.8 t -65.79 -46.54 88.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.838 179.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -56.05 -50.89 69.71 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.903 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -55.52 -47.98 75.39 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.407 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 96.6 mt -67.58 -49.1 73.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.523 -176.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -63.34 -30.77 71.84 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.224 0.535 . . . . 0.0 110.67 -178.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 763' ' ' GLU . . . . . 0.441 ' CD ' HN21 ' A' ' 801' ' ' DGP . 39.9 tt0 -70.71 -37.75 73.59 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.768 177.273 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -68.57 -36.99 79.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.361 0.6 . . . . 0.0 110.243 178.291 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 12.0 m170 -74.89 -23.12 58.33 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.438 177.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 84.68 44.4 6.46 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.936 -0.65 . . . . 0.0 112.272 178.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 82.0 mt -111.86 177.63 4.58 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 178.093 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 75.4 ttt180 -96.72 133.47 41.22 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 5.7 p80 -145.92 133.39 20.8 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.079 0.466 . . . . 0.0 111.555 -176.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -170.56 164.59 8.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.215 -0.902 . . . . 0.0 108.976 176.184 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 771' ' ' SER . . . . . 0.471 ' HA ' ' HA ' ' A' ' 780' ' ' ILE . 14.3 m -110.17 146.76 34.97 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.357 0.599 . . . . 0.0 112.035 -173.83 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 20.1 m -109.76 155.81 21.11 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.14 175.395 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 90.01 -179.44 44.02 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.345 -0.931 . . . . 0.0 111.723 -178.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -134.21 144.95 48.76 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.787 0.293 . . . . 0.0 111.183 -176.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . 65.44 -117.29 9.85 Favored Glycine 0 N--CA 1.452 -0.256 0 CA-C-N 115.802 -0.635 . . . . 0.0 113.124 174.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 23.0 ttpp -98.81 -7.34 27.6 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.957 0.408 . . . . 0.0 110.125 -177.639 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 85.1 mtt180 -92.28 4.33 53.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.603 0.716 . . . . 0.0 109.463 172.004 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 778' ' ' ARG . . . . . 0.403 ' HD2' HH11 ' A' ' 778' ' ' ARG . 22.5 ttt180 -77.75 135.59 38.03 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.726 -1.125 . . . . 0.0 109.686 177.334 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 779' ' ' PHE . . . . . 0.52 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 37.7 p90 -136.39 137.54 40.63 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.685 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 780' ' ' ILE . . . . . 0.471 ' HA ' ' HA ' ' A' ' 771' ' ' SER . 10.8 tt -83.93 135.33 25.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 121.201 0.525 . . . . 0.0 110.826 -176.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 35.2 m -120.38 119.82 34.2 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.479 -179.27 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 43.1 t -95.97 125.12 48.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.322 176.311 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 34.3 t -119.29 130.27 55.32 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.322 0.582 . . . . 0.0 110.789 -176.416 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 784' ' ' LYS . . . . . 0.513 ' HD3' ' HA ' ' A' ' 737' ' ' MET . 48.0 mtmt -77.79 -19.33 55.23 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 172.568 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 14.0 mmt180 -84.14 102.88 12.9 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.231 174.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.36 -0.829 . . . . 0.0 109.533 177.498 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 801' ' ' DGP . . . . . 0.441 HN21 ' CD ' ' A' ' 763' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo . . . . . 0 N--CA 1.474 0.372 0 N-CA-C 110.405 -0.652 . . . . 0.0 110.405 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 60.65 99.16 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 O-C-N 123.691 0.619 . . . . 0.0 111.402 -178.623 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . 100.16 51.16 1.27 Allowed Glycine 0 N--CA 1.445 -0.746 0 C-N-CA 120.595 -0.812 . . . . 0.0 111.558 -177.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 39.5 t -77.37 92.16 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 177.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -123.86 87.17 2.69 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.46 -173.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 25.4 p -87.49 -39.75 14.91 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 169.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 37.1 tt0 55.01 41.32 31.97 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 114.685 -1.143 . . . . 0.0 109.872 175.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -97.13 -156.92 0.56 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.834 -1.076 . . . . 0.0 110.38 -178.29 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . 98.95 75.31 1.19 Allowed Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 120.628 -0.796 . . . . 0.0 111.487 -177.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 8.7 p -156.09 131.67 1.73 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-O 120.962 0.411 . . . . 0.0 110.627 -176.214 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 727' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -68.55 151.61 46.52 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 174.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 29.9 t60 -52.82 -44.2 66.5 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.485 0.66 . . . . 0.0 109.391 174.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 44.7 m-85 -75.15 -26.76 59.38 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.692 -176.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 23.6 ttt180 -71.22 -36.59 71.91 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 178.32 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -66.39 -42.66 87.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.177 175.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 12.3 mmm -62.0 -40.91 97.28 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.131 176.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 733' ' ' ILE . . . . . 0.449 ' O ' ' HG3' ' A' ' 737' ' ' MET . 49.3 mt -69.22 -44.11 80.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.684 -179.149 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 11.4 p -63.99 -37.01 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 C-N-CA 120.564 -0.454 . . . . 0.0 110.994 -177.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -74.62 -27.26 60.38 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.05 0.452 . . . . 0.0 110.472 176.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 736' ' ' PHE . . . . . 0.553 ' CE1' ' HB2' ' A' ' 744' ' ' LEU . 26.9 t80 -69.36 -35.89 76.31 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.531 175.135 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 737' ' ' MET . . . . . 0.449 ' HG3' ' O ' ' A' ' 733' ' ' ILE . 86.2 mtp -64.27 -39.72 94.5 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.58 178.018 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -78.97 -23.49 44.48 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.54 178.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 33.1 t -73.54 164.13 27.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.465 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 45.2 mtmt -78.54 -22.38 47.33 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.621 -177.023 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 56.1 mtmt -55.43 128.32 33.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.658 -175.138 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 27.0 ptm -86.66 -18.96 29.98 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.898 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 19.8 mm-40 -135.71 139.01 43.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.313 178.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 744' ' ' LEU . . . . . 0.553 ' HB2' ' CE1' ' A' ' 736' ' ' PHE . 37.3 tp -118.44 108.67 15.31 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 176.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -92.27 112.15 23.98 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.049 -178.144 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -88.34 145.15 35.14 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.568 178.044 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 747' ' ' PRO . . . . . 0.447 ' HA ' ' HD3' ' A' ' 748' ' ' PRO . 23.0 Cg_exo -65.0 152.53 82.08 Favored 'Trans proline' 0 N--CA 1.463 -0.313 0 C-N-CA 122.638 2.225 . . . . 0.0 112.037 177.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 748' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 747' ' ' PRO . 13.3 Cg_exo -68.68 -7.32 20.15 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 123.126 2.55 . . . . 0.0 111.462 177.493 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 5.6 m -59.61 -21.4 60.35 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.685 173.013 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.8 mp -73.34 115.4 12.65 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.865 173.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 10.9 p30 -82.7 -178.56 7.13 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 178.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 65.1 m -58.81 -29.0 66.53 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -175.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 54.2 t-80 -71.52 -45.04 63.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.894 0.378 . . . . 0.0 110.087 177.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 754' ' ' ASP . . . . . 0.411 ' O ' HG23 ' A' ' 758' ' ' VAL . 70.9 m-20 -61.49 -51.09 70.09 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.036 178.346 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 755' ' ' ARG . . . . . 0.614 ' HB2' H5'' ' A' ' 801' ' ' DGP . 22.3 mtm180 -57.96 -43.58 86.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.806 179.643 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 756' ' ' LEU . . . . . 0.465 ' CD1' " H1'" ' A' ' 801' ' ' DGP . 51.5 tp -55.45 -41.96 73.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.466 179.845 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 19.0 mmm180 -63.77 -47.43 81.0 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.998 -0.281 . . . . 0.0 110.465 176.088 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 758' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 754' ' ' ASP . 61.9 t -56.48 -46.31 82.21 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.97 179.64 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 87.3 m-70 -56.7 -53.68 54.91 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.648 178.024 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -59.44 -40.42 86.76 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.69 -178.045 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 95.6 mt -65.29 -53.78 36.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.106 -179.639 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -62.0 -36.82 82.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.176 0.512 . . . . 0.0 110.597 -179.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -64.84 -31.58 72.88 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.915 177.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -81.86 -36.75 27.9 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.66 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 11.3 m170 -74.57 -23.01 58.7 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.215 179.436 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 95.85 31.09 7.55 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.577 -0.82 . . . . 0.0 112.52 177.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 66.3 mt -108.65 -176.56 3.08 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 110.267 -0.272 . . . . 0.0 110.267 -178.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 768' ' ' ARG . . . . . 0.433 ' HB3' ' HB3' ' A' ' 783' ' ' SER . 17.4 ttm180 -100.95 135.62 42.11 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.439 177.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 7.2 p80 -144.65 135.3 24.66 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.936 -178.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -164.54 150.09 10.24 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.48 177.444 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 771' ' ' SER . . . . . 0.427 ' HA ' ' HA ' ' A' ' 780' ' ' ILE . 3.8 m -113.95 132.88 55.8 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-O 120.932 0.396 . . . . 0.0 110.297 179.112 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 772' ' ' SER . . . . . 0.505 ' O ' ' HA ' ' A' ' 778' ' ' ARG . 24.8 m -113.38 145.77 40.58 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.105 -178.653 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 99.91 -169.26 21.89 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.887 -0.673 . . . . 0.0 111.684 -178.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -143.19 139.77 30.45 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.819 0.343 . . . . 0.0 111.332 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . 65.9 -123.36 24.04 Favored Glycine 0 N--CA 1.448 -0.503 0 CA-C-N 115.656 -0.702 . . . . 0.0 112.592 177.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 16.8 tppt? -85.58 -2.7 58.43 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.466 0.65 . . . . 0.0 110.054 -179.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -96.95 0.74 49.4 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.828 172.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 778' ' ' ARG . . . . . 0.505 ' HA ' ' O ' ' A' ' 772' ' ' SER . 31.6 ttt180 -97.47 117.82 32.57 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.6 -178.549 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 38.8 p90 -127.34 158.52 37.03 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.148 -179.497 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 780' ' ' ILE . . . . . 0.427 ' HA ' ' HA ' ' A' ' 771' ' ' SER . 13.3 tt -107.17 134.03 50.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-O 121.057 0.456 . . . . 0.0 111.147 -175.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 5.7 m -118.36 124.25 47.28 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.023 178.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 43.3 t -107.28 127.0 63.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.767 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 783' ' ' SER . . . . . 0.433 ' HB3' ' HB3' ' A' ' 768' ' ' ARG . 22.8 t -112.47 147.16 37.1 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 120.821 0.344 . . . . 0.0 110.493 -178.716 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 784' ' ' LYS . . . . . 0.409 ' HD3' ' HA ' ' A' ' 737' ' ' MET . 17.7 mtmm -76.88 -12.49 59.97 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.421 0.629 . . . . 0.0 110.073 173.537 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 16.8 mmm180 -94.9 113.94 25.73 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.483 -0.781 . . . . 0.0 111.071 179.609 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.244 0.801 0 CA-C-O 118.635 -0.698 . . . . 0.0 109.565 175.329 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 801' ' ' DGP . . . . . 0.614 H5'' ' HB2' ' A' ' 755' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo . . . . . 0 N--CA 1.478 0.581 0 N-CA-C 109.994 -0.81 . . . . 0.0 109.994 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -101.78 103.45 14.18 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 177.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . 166.5 108.67 0.21 Allowed Glycine 0 N--CA 1.443 -0.839 0 C-N-CA 120.693 -0.765 . . . . 0.0 111.67 -176.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 25.7 t 57.31 68.45 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.446 0 CA-C-O 121.676 0.751 . . . . 0.0 110.245 -178.228 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -67.54 -34.64 77.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.565 176.016 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 14.2 m -116.06 103.32 10.45 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.505 -0.771 . . . . 0.0 109.595 174.136 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -64.34 -40.15 95.31 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.209 0.528 . . . . 0.0 109.825 177.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -102.21 94.46 5.75 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.109 175.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . -123.43 26.55 6.0 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.039 -177.602 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 2.9 p -91.07 96.22 6.15 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 CA-C-O 122.33 1.062 . . . . 0.0 110.048 -179.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 727' ' ' ASP . . . . . 0.462 ' HB3' ' HB3' ' A' ' 730' ' ' ARG . 9.9 t70 -102.77 140.62 36.81 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 114.334 -1.303 . . . . 0.0 109.545 -178.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 18.1 t60 -55.69 -47.47 76.73 Favored 'General case' 0 C--N 1.328 -0.337 0 O-C-N 123.365 0.416 . . . . 0.0 111.289 -177.27 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -75.07 -36.85 61.76 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.462 -176.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 730' ' ' ARG . . . . . 0.462 ' HB3' ' HB3' ' A' ' 727' ' ' ASP . 27.7 ttm-85 -61.8 -42.36 98.91 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.765 0.316 . . . . 0.0 110.383 175.811 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -60.44 -45.73 92.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.815 179.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 31.8 mtm -68.52 -33.32 73.92 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.236 -179.286 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 733' ' ' ILE . . . . . 0.542 ' O ' ' HG3' ' A' ' 737' ' ' MET . 58.3 mt -70.34 -49.31 54.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 N-CA-C 111.339 0.126 . . . . 0.0 111.339 178.499 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 13.0 p -62.86 -34.65 67.22 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 120.801 -0.36 . . . . 0.0 110.829 -177.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -70.6 -41.61 72.06 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.021 0.439 . . . . 0.0 110.142 175.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 736' ' ' PHE . . . . . 0.517 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 44.1 t80 -57.59 -35.47 70.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.33 177.777 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 737' ' ' MET . . . . . 0.542 ' HG3' ' O ' ' A' ' 733' ' ' ILE . 87.6 mtp -61.34 -32.89 72.78 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.824 178.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -96.01 -7.18 37.04 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.278 -179.457 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 64.3 m -82.78 168.47 17.14 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.082 -177.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 740' ' ' LYS . . . . . 0.449 ' NZ ' ' HB2' ' A' ' 740' ' ' LYS . 4.4 ttmp? -81.29 -21.85 39.04 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.435 -178.69 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -62.83 127.9 33.41 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.668 179.294 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 25.6 ptt? -88.86 -17.22 30.11 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.617 178.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 28.2 mt-30 -139.05 119.65 14.03 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.139 -178.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 744' ' ' LEU . . . . . 0.517 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 49.1 tp -101.03 105.24 16.43 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.334 176.334 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -89.67 115.89 27.38 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.305 -179.204 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 746' ' ' PHE . . . . . 0.488 ' HB2' HG23 ' A' ' 780' ' ' ILE . 58.5 m-85 -88.27 145.6 36.22 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.934 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -58.28 153.79 44.6 Favored 'Trans proline' 0 CA--C 1.533 0.441 0 C-N-CA 123.178 2.585 . . . . 0.0 112.771 178.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -69.61 -9.37 26.0 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.922 2.415 . . . . 0.0 112.936 -179.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 2.3 p -69.24 -24.07 63.95 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.878 -178.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.8 mp -55.7 117.49 3.68 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.256 175.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -76.68 174.73 10.08 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 13.7 t -55.35 -32.53 62.63 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.649 0.24 . . . . 0.0 111.649 -175.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 40.2 m80 -79.43 -31.86 42.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.456 0.17 . . . . 0.0 110.962 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -66.32 -45.37 80.52 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 174.447 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 755' ' ' ARG . . . . . 0.522 ' HB2' " H5'" ' A' ' 801' ' ' DGP . 63.3 mtt-85 -62.6 -47.42 83.88 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.733 177.456 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 756' ' ' LEU . . . . . 0.513 ' HB2' " H4'" ' A' ' 801' ' ' DGP . 62.5 tp -55.04 -40.6 70.41 Favored 'General case' 0 N--CA 1.464 0.272 0 O-C-N 123.346 0.404 . . . . 0.0 110.877 179.103 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 27.9 tpt180 -56.87 -51.0 70.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.915 176.011 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 99.1 t -60.51 -49.67 83.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.258 178.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 759' ' ' HIS . . . . . 0.419 ' O ' ' HB2' ' A' ' 763' ' ' GLU . 89.8 m-70 -53.79 -51.2 64.22 Favored 'General case' 0 N--CA 1.463 0.192 0 O-C-N 123.302 0.376 . . . . 0.0 110.635 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -60.59 -44.19 96.52 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -178.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 98.1 mt -66.3 -49.31 76.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.756 0.313 . . . . 0.0 110.963 -177.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -64.32 -32.74 74.47 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.945 0.402 . . . . 0.0 110.59 -179.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 763' ' ' GLU . . . . . 0.419 ' HB2' ' O ' ' A' ' 759' ' ' HIS . 27.3 tt0 -66.01 -37.03 84.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.407 178.612 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 13.7 tp10 -75.0 -43.26 54.88 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.676 177.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 10.6 m-70 -69.22 -24.89 64.08 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.434 -176.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 99.45 29.91 6.82 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.496 -0.859 . . . . 0.0 113.14 174.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 767' ' ' LEU . . . . . 0.423 HD11 ' HG2' ' A' ' 737' ' ' MET . 54.3 mt -107.59 170.76 7.78 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 176.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 30.5 ttt180 -96.55 139.89 31.97 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 119.616 -0.834 . . . . 0.0 109.745 175.143 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.5 p80 -137.19 131.71 32.87 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.428 -0.806 . . . . 0.0 109.837 -176.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -159.62 144.91 15.56 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.306 -179.379 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 771' ' ' SER . . . . . 0.455 ' HA ' ' HA ' ' A' ' 780' ' ' ILE . 8.8 t -110.3 149.31 30.38 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.45 0.643 . . . . 0.0 110.084 178.55 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 772' ' ' SER . . . . . 0.459 ' O ' ' HA ' ' A' ' 778' ' ' ARG . 29.3 t -147.15 157.7 43.69 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.161 -173.578 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 773' ' ' GLY . . . . . 0.514 ' HA3' ' O ' ' A' ' 777' ' ' ARG . . . 90.53 175.41 44.6 Favored Glycine 0 N--CA 1.448 -0.523 0 O-C-N 123.623 0.577 . . . . 0.0 112.159 178.421 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -135.08 149.21 50.03 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 110.322 -0.251 . . . . 0.0 110.322 178.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . 63.8 -128.05 37.11 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 121.227 -0.511 . . . . 0.0 112.137 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -77.1 -5.25 48.23 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.989 0.423 . . . . 0.0 110.625 178.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 777' ' ' ARG . . . . . 0.514 ' O ' ' HA3' ' A' ' 773' ' ' GLY . 31.5 mmt180 -99.2 4.3 46.67 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.294 175.091 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 778' ' ' ARG . . . . . 0.459 ' HA ' ' O ' ' A' ' 772' ' ' SER . 65.6 ttt180 -93.42 111.2 22.8 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-O 121.315 0.579 . . . . 0.0 110.315 178.278 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 779' ' ' PHE . . . . . 0.465 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 14.3 p90 -140.88 156.08 46.18 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.453 -174.248 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 780' ' ' ILE . . . . . 0.488 HG23 ' HB2' ' A' ' 746' ' ' PHE . 6.2 tt -103.9 130.17 54.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-O 121.138 0.494 . . . . 0.0 110.107 179.079 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 27.1 m -111.13 120.36 42.04 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.449 -179.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 55.8 t -96.42 118.68 43.27 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 173.066 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 53.9 p -113.61 137.81 51.07 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.458 -177.027 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 59.0 mtpt -68.2 -85.35 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 172.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 53.92 27.56 7.45 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 123.431 0.457 . . . . 0.0 111.919 168.054 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.959 0 CA-C-O 118.49 -0.767 . . . . 0.0 110.121 -177.692 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 801' ' ' DGP . . . . . 0.522 " H5'" ' HB2' ' A' ' 755' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_exo . . . . . 0 N--CA 1.478 0.584 0 N-CA-C 110.362 -0.668 . . . . 0.0 110.362 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -145.65 97.68 3.01 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.993 0.425 . . . . 0.0 110.069 -177.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . -103.29 50.59 0.88 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.253 -178.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 35.3 m -86.74 3.31 4.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.988 0.423 . . . . 0.0 111.065 -179.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -148.91 134.46 18.65 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 -179.368 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 7.2 t -112.66 100.13 8.47 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 -179.183 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 723' ' ' GLN . . . . . 0.549 ' HA ' ' NH2' ' A' ' 730' ' ' ARG . 25.9 mp0 -60.47 -35.32 75.61 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.652 -0.704 . . . . 0.0 112.089 -172.575 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -85.21 90.53 7.91 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.215 0.531 . . . . 0.0 110.203 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . 175.8 99.93 0.13 Allowed Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.005 -179.715 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 17.2 t -88.07 79.63 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.6 0.714 . . . . 0.0 109.68 -179.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 727' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -109.12 142.86 39.28 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 114.941 -1.027 . . . . 0.0 110.29 -177.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 9.7 t60 -55.68 -56.28 22.25 Favored 'General case' 0 C--N 1.332 -0.185 0 O-C-N 123.652 0.595 . . . . 0.0 110.792 -179.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 40.6 m-85 -75.56 -31.3 59.98 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.371 -172.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 730' ' ' ARG . . . . . 0.549 ' NH2' ' HA ' ' A' ' 723' ' ' GLN . 40.0 ttt-85 -59.77 -45.7 91.45 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.18 174.236 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -61.12 -42.53 98.7 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.536 -179.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 32.8 mmm -62.54 -39.09 92.49 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.925 178.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 733' ' ' ILE . . . . . 0.506 ' O ' ' HB3' ' A' ' 736' ' ' PHE . 68.1 mt -77.76 -39.57 26.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -177.678 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 10.8 p -65.16 -37.69 80.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.817 -178.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -78.19 -29.35 48.43 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 120.811 -0.355 . . . . 0.0 110.37 176.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 736' ' ' PHE . . . . . 0.544 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 29.2 t80 -52.88 -44.79 67.11 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.873 175.281 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 71.1 mtm -67.13 -23.21 65.78 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.732 -179.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -97.09 -9.63 27.63 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.696 0.284 . . . . 0.0 111.529 -178.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 50.7 m -90.01 2.55 55.04 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.604 -177.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 740' ' ' LYS . . . . . 0.446 ' O ' ' HG2' ' A' ' 740' ' ' LYS . 61.5 tttp 65.4 9.76 6.0 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.257 0.551 . . . . 0.0 111.03 -179.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 62.4 mttm -68.27 129.78 40.95 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.625 179.118 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.08 -25.47 47.65 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.064 177.49 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -155.34 148.8 25.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.314 177.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 744' ' ' LEU . . . . . 0.544 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 59.0 tp -124.81 108.27 11.78 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.777 178.642 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -80.78 114.55 19.74 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.91 179.536 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 746' ' ' PHE . . . . . 0.464 ' HB2' HG23 ' A' ' 780' ' ' ILE . 68.1 m-85 -90.93 154.78 45.38 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.354 177.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 747' ' ' PRO . . . . . 0.415 ' O ' HD13 ' A' ' 750' ' ' LEU . 33.8 Cg_exo -59.17 155.36 40.31 Favored 'Trans proline' 0 CA--C 1.533 0.466 0 C-N-CA 122.666 2.244 . . . . 0.0 112.294 176.304 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -75.6 -14.46 19.87 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.653 2.236 . . . . 0.0 112.169 -179.366 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 7.8 p -71.75 -11.08 60.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.594 -175.473 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 750' ' ' LEU . . . . . 0.415 HD13 ' O ' ' A' ' 747' ' ' PRO . 11.1 mp -58.59 113.67 2.12 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 174.091 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 751' ' ' ASN . . . . . 0.578 ' O ' ' HG2' ' A' ' 755' ' ' ARG . 3.1 p30 -75.13 178.94 5.34 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 110.345 -0.243 . . . . 0.0 110.345 -175.325 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 30.2 m -51.76 -42.44 62.37 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 120.606 0.241 . . . . 0.0 111.522 -176.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 70.1 m80 -70.24 -36.98 74.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.106 -179.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 754' ' ' ASP . . . . . 0.43 ' O ' HG23 ' A' ' 758' ' ' VAL . 73.7 m-20 -64.38 -49.47 71.48 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 177.121 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 755' ' ' ARG . . . . . 0.578 ' HG2' ' O ' ' A' ' 751' ' ' ASN . 1.4 mmm-85 -54.36 -57.49 11.08 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.648 178.615 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 66.7 tp -52.29 -41.89 63.28 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 114.978 -1.01 . . . . 0.0 111.901 -178.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -63.09 -45.41 92.21 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 121.195 -0.202 . . . . 0.0 110.73 178.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 758' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 754' ' ' ASP . 93.4 t -60.69 -47.16 94.24 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.728 178.234 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -56.79 -51.48 68.79 Favored 'General case' 0 N--CA 1.462 0.139 0 O-C-N 123.339 0.399 . . . . 0.0 110.206 178.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -54.96 -47.62 74.28 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.671 179.419 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 97.3 mt -63.55 -55.4 23.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.119 -178.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -60.24 -35.13 74.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.968 0.413 . . . . 0.0 110.88 -177.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -66.69 -38.16 86.2 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.144 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -77.22 -36.46 54.68 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.586 0.232 . . . . 0.0 110.448 179.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 9.8 m-70 -65.31 -23.48 67.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.959 0.409 . . . . 0.0 110.709 176.24 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 89.25 35.75 7.91 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.108 177.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 62.9 mt -114.0 177.16 4.74 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.275 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 22.5 ttp180 -95.56 143.92 26.46 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 178.416 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 5.3 p80 -140.32 122.47 15.78 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.092 0.472 . . . . 0.0 110.276 -178.244 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -134.83 155.19 51.07 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.926 -174.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 10.0 m -120.79 129.57 53.64 Favored 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 172.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 16.0 t -153.61 176.68 11.79 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.106 -171.079 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 118.8 165.6 13.27 Favored Glycine 0 N--CA 1.441 -1.0 0 C-N-CA 120.877 -0.678 . . . . 0.0 111.577 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 774' ' ' GLU . . . . . 0.429 ' H ' ' HB2' ' A' ' 777' ' ' ARG . 39.8 mm-40 -70.54 178.8 2.8 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.653 0.263 . . . . 0.0 110.69 178.679 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . -57.75 -35.75 75.97 Favored Glycine 0 CA--C 1.519 0.312 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.349 179.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -102.3 12.09 37.16 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.84 0.352 . . . . 0.0 110.87 178.231 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 777' ' ' ARG . . . . . 0.429 ' HB2' ' H ' ' A' ' 774' ' ' GLU . 17.3 mmm180 -137.03 19.34 3.0 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.236 -175.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 778' ' ' ARG . . . . . . . . . . . . . 49.2 ttt180 -75.78 113.99 13.87 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.375 0.607 . . . . 0.0 111.589 -177.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 11.1 p90 -135.07 -166.92 1.9 Allowed 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.241 -0.89 . . . . 0.0 109.986 -179.635 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 780' ' ' ILE . . . . . 0.464 HG23 ' HB2' ' A' ' 746' ' ' PHE . 6.5 tt -126.32 140.26 49.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 120.906 0.384 . . . . 0.0 110.265 177.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 26.3 m -128.23 117.98 22.49 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.656 -179.008 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 49.5 t -86.72 127.86 40.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 174.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 26.2 m -127.83 139.68 52.49 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.345 0.593 . . . . 0.0 112.059 -173.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 784' ' ' LYS . . . . . 0.404 ' HG3' ' CE2' ' A' ' 736' ' ' PHE . 10.0 mtpm? -85.23 -12.88 51.54 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.93 0.871 . . . . 0.0 109.092 172.205 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 16.6 mmm180 -76.37 139.5 40.99 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 114.114 -1.403 . . . . 0.0 110.657 174.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.917 0 CA-C-O 118.734 -0.651 . . . . 0.0 110.41 177.847 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 801' ' ' DGP . . . . . 0.471 " H5'" ' CB ' ' A' ' 755' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo . . . . . 0 N--CA 1.475 0.413 0 N-CA-C 111.52 -0.223 . . . . 0.0 111.52 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -74.79 149.7 39.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.047 0.451 . . . . 0.0 111.707 -176.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . -138.5 99.9 0.28 Allowed Glycine 0 N--CA 1.444 -0.771 0 N-CA-C 110.906 -0.877 . . . . 0.0 110.906 174.036 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 15.4 m -78.39 56.38 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.432 0.634 . . . . 0.0 111.344 -175.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -75.56 -60.04 2.48 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.591 -179.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 10.3 m -75.62 95.25 3.33 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.01 -177.104 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -103.47 83.37 2.16 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 176.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -113.33 -179.0 3.52 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.612 -175.796 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . 81.07 72.71 1.22 Allowed Glycine 0 N--CA 1.448 -0.559 0 N-CA-C 110.715 -0.954 . . . . 0.0 110.715 -176.672 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 2.9 p -105.74 108.57 25.36 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.945 0 CA-C-O 121.922 0.868 . . . . 0.0 110.987 -171.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 727' ' ' ASP . . . . . 0.533 ' HB3' ' HB3' ' A' ' 730' ' ' ARG . 8.1 t70 -128.85 128.45 43.89 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 114.772 -1.104 . . . . 0.0 108.217 172.26 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 23.1 t60 -57.94 -45.54 86.42 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.089 0.471 . . . . 0.0 111.392 -172.057 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -82.41 -37.55 25.37 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.738 -174.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 730' ' ' ARG . . . . . 0.533 ' HB3' ' HB3' ' A' ' 727' ' ' ASP . 17.1 tpt180 -55.76 -44.58 77.79 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.975 0.417 . . . . 0.0 109.96 175.721 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 731' ' ' ALA . . . . . 0.432 ' O ' ' HG3' ' A' ' 735' ' ' GLU . . . -63.43 -52.08 63.02 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.872 179.72 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 31.6 mtm -63.63 -33.49 75.74 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.757 -177.433 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 733' ' ' ILE . . . . . 0.404 HD11 HG13 ' A' ' 758' ' ' VAL . 81.2 mt -72.74 -43.13 61.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 -179.898 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 11.9 p -67.98 -36.55 75.96 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.339 -179.204 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 735' ' ' GLU . . . . . 0.432 ' HG3' ' O ' ' A' ' 731' ' ' ALA . 52.4 mt-10 -68.83 -35.84 77.47 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.077 0.465 . . . . 0.0 109.768 175.376 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 736' ' ' PHE . . . . . 0.416 ' CE2' ' HG3' ' A' ' 784' ' ' LYS . 26.8 t80 -61.69 -38.23 87.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.39 178.591 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 737' ' ' MET . . . . . 0.557 ' HA ' ' HD3' ' A' ' 784' ' ' LYS . 42.0 mtm -62.29 -40.23 95.58 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 121.077 -0.249 . . . . 0.0 111.028 179.563 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -81.49 -17.98 46.75 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.948 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 32.7 t -74.08 160.77 30.8 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.905 -178.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 740' ' ' LYS . . . . . 0.555 ' H ' ' HD2' ' A' ' 740' ' ' LYS . 0.0 OUTLIER -77.43 -12.2 59.93 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.819 -178.944 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -67.24 133.29 49.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.154 -0.475 . . . . 0.0 109.859 177.014 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 59.2 mtt -95.76 -20.56 18.77 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.04 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -133.31 124.53 27.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.854 179.268 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 744' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -93.34 97.53 10.65 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 176.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -84.3 101.35 11.87 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.166 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 746' ' ' PHE . . . . . 0.408 ' O ' ' HB2' ' A' ' 779' ' ' PHE . 65.1 m-85 -79.66 154.02 75.94 Favored Pre-proline 0 C--N 1.321 -0.645 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.58 179.29 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -75.27 160.16 39.59 Favored 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 122.759 2.306 . . . . 0.0 111.602 175.049 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -68.14 -4.35 12.46 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.796 2.331 . . . . 0.0 112.612 177.033 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 12.2 p -63.9 -27.13 68.94 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.553 179.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.2 mp -63.22 115.34 4.43 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.466 -0.333 . . . . 0.0 110.552 176.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 751' ' ' ASN . . . . . 0.411 ' O ' ' HG3' ' A' ' 755' ' ' ARG . 2.6 p-10 -91.86 -170.04 2.45 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 174.577 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 12.8 p -46.19 -61.81 1.61 Allowed 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -173.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -55.53 -43.74 76.05 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.412 -178.006 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -62.94 -47.35 83.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.991 -178.286 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 755' ' ' ARG . . . . . 0.544 ' HB2' " H5'" ' A' ' 801' ' ' DGP . 82.8 mtt180 -60.89 -48.22 82.8 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.798 177.345 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 65.3 tp -54.26 -40.98 68.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.059 -179.065 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 9.9 mmt180 -59.02 -48.76 80.41 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.448 175.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 758' ' ' VAL . . . . . 0.404 HG13 HD11 ' A' ' 733' ' ' ILE . 59.3 t -62.27 -48.42 88.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.059 -179.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -57.0 -49.67 75.06 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 110.442 -0.207 . . . . 0.0 110.442 179.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 67.0 mt-30 -56.21 -50.37 71.44 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.599 179.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 95.5 mt -67.32 -46.23 84.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.542 -176.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -62.53 -39.59 94.09 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.838 0.351 . . . . 0.0 110.421 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -65.75 -33.87 76.87 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.58 177.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -73.89 -35.23 64.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.513 178.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 11.3 m170 -79.08 -11.77 60.0 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.389 179.416 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 81.92 21.68 60.89 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.482 179.382 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 71.8 mt -95.06 172.68 7.99 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 -179.183 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 768' ' ' ARG . . . . . 0.425 ' HD2' ' O ' ' A' ' 786' ' ' ALA . 58.0 ttt180 -96.15 132.71 41.27 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.891 0.377 . . . . 0.0 110.226 178.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -133.6 124.62 27.16 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 121.293 0.568 . . . . 0.0 110.537 178.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -145.25 145.24 31.21 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.424 -177.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 14.3 m -115.68 143.99 44.58 Favored 'General case' 0 C--N 1.316 -0.849 0 C-N-CA 120.843 -0.343 . . . . 0.0 111.005 -176.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 28.4 t -119.71 148.11 43.79 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.641 -0.708 . . . . 0.0 109.478 179.09 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 103.36 -178.8 25.54 Favored Glycine 0 N--CA 1.447 -0.606 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.08 -178.037 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -101.05 -84.39 0.43 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -175.282 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . -117.01 -86.65 1.22 Allowed Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.267 -0.968 . . . . 0.0 113.011 -174.247 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -76.4 -14.72 60.05 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.649 0.261 . . . . 0.0 111.434 -176.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 777' ' ' ARG . . . . . 0.427 HH11 ' HD3' ' A' ' 777' ' ' ARG . 47.1 mtt180 -107.0 7.35 29.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.821 0.343 . . . . 0.0 110.952 175.4 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 778' ' ' ARG . . . . . . . . . . . . . 47.0 ttt180 -74.59 119.22 18.49 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.029 0.442 . . . . 0.0 110.193 177.391 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 779' ' ' PHE . . . . . 0.408 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 48.0 p90 -117.41 148.47 41.74 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.842 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 9.3 tt -102.74 136.76 33.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.587 -177.5 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 18.6 m -120.75 116.04 24.47 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.58 -178.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 47.2 t -92.28 117.03 34.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.841 177.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 34.3 t -111.6 127.79 55.85 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.108 0.48 . . . . 0.0 110.43 -178.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 784' ' ' LYS . . . . . 0.557 ' HD3' ' HA ' ' A' ' 737' ' ' MET . 52.4 mtmt -83.53 -24.53 31.61 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.486 0.66 . . . . 0.0 109.222 174.481 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 20.9 mmt180 -90.64 162.43 14.96 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.99 -1.005 . . . . 0.0 110.801 179.467 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 786' ' ' ALA . . . . . 0.425 ' O ' ' HD2' ' A' ' 768' ' ' ARG . . . . . . . . 0 C--O 1.25 1.086 0 O-C-N 123.994 0.809 . . . . 0.0 111.372 178.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 801' ' ' DGP . . . . . 0.742 ' H8 ' ' OP3' ' A' ' 801' ' ' DGP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo . . . . . 0 N--CA 1.483 0.864 0 N-CA-C 111.245 -0.329 . . . . 0.0 111.245 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 718' ' ' GLU . . . . . 0.518 ' CD ' ' H ' ' A' ' 718' ' ' GLU . 0.1 OUTLIER -62.24 -30.12 70.88 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.787 178.527 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . -76.75 72.43 2.02 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.082 -0.807 . . . . 0.0 111.082 174.099 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 3.7 p -81.33 109.59 15.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 121.694 0.759 . . . . 0.0 110.922 -177.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.32 127.64 33.2 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 114.976 -1.011 . . . . 0.0 108.801 178.148 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 34.5 t -116.26 10.27 14.78 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -167.495 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -55.83 144.74 26.72 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.662 175.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -52.35 -37.36 55.92 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.785 -176.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . 144.85 -57.98 0.52 Allowed Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.733 -0.746 . . . . 0.0 111.93 178.718 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 27.9 t -104.89 97.89 6.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.692 0.758 . . . . 0.0 109.712 -177.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 727' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -127.98 139.71 52.41 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 114.727 -1.124 . . . . 0.0 109.006 178.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 728' ' ' HIS . . . . . 0.465 ' O ' ' HG2' ' A' ' 732' ' ' MET . 22.3 t60 -54.41 -55.19 31.19 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 123.534 0.521 . . . . 0.0 111.161 -176.545 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -70.75 -39.63 73.15 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.101 -174.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 26.8 ttt180 -55.71 -40.45 72.43 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.215 0.531 . . . . 0.0 110.059 176.188 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 731' ' ' ALA . . . . . 0.482 ' O ' HG12 ' A' ' 734' ' ' VAL . . . -71.82 -42.57 66.86 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.96 179.05 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 732' ' ' MET . . . . . 0.465 ' HG2' ' O ' ' A' ' 728' ' ' HIS . 44.8 mmm -60.65 -37.49 81.69 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.767 0.318 . . . . 0.0 110.895 178.638 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 70.8 mt -71.02 -41.0 76.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.888 -0.597 . . . . 0.0 111.528 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 734' ' ' VAL . . . . . 0.482 HG12 ' O ' ' A' ' 731' ' ' ALA . 10.0 p -67.66 -34.32 67.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.664 -179.167 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 735' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 731' ' ' ALA . 51.9 mt-10 -63.08 -45.56 91.57 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-O 121.349 0.595 . . . . 0.0 109.543 173.436 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 736' ' ' PHE . . . . . 0.422 ' HB2' HD12 ' A' ' 744' ' ' LEU . 41.6 t80 -57.41 -44.52 84.67 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.849 -1.069 . . . . 0.0 111.535 -179.383 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 737' ' ' MET . . . . . 0.412 ' HA ' ' HE2' ' A' ' 784' ' ' LYS . 45.8 mtm -69.15 -34.34 74.85 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.035 -179.345 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -78.04 -28.64 49.07 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.902 0.382 . . . . 0.0 111.224 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 25.2 t -80.69 -172.04 3.43 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.496 -179.225 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 740' ' ' LYS . . . . . 0.653 ' H ' ' HD2' ' A' ' 740' ' ' LYS . 0.0 OUTLIER -110.53 12.46 22.83 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.154 0.502 . . . . 0.0 110.848 -175.094 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -71.75 142.09 49.76 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.368 -0.605 . . . . 0.0 109.368 172.12 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 742' ' ' MET . . . . . 0.498 ' O ' ' HA ' ' A' ' 783' ' ' SER . 17.6 ptp -104.12 -14.91 15.71 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.468 177.454 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -140.7 116.34 10.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.662 179.122 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 744' ' ' LEU . . . . . 0.422 HD12 ' HB2' ' A' ' 736' ' ' PHE . 1.4 tt -89.63 103.55 16.18 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 177.646 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -88.27 99.07 11.95 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.646 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -77.03 153.35 82.64 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.352 178.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_exo -66.23 156.32 65.51 Favored 'Trans proline' 0 CA--C 1.532 0.422 0 C-N-CA 122.8 2.333 . . . . 0.0 112.13 176.045 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 748' ' ' PRO . . . . . 0.404 ' HB2' ' O ' ' A' ' 776' ' ' LYS . 53.5 Cg_endo -71.41 -5.24 16.61 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.928 2.419 . . . . 0.0 112.665 177.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 23.6 p -65.01 -25.23 67.77 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.156 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.9 mp -60.17 118.12 5.97 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.577 177.441 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -90.12 -176.53 4.89 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.075 176.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 17.4 m -48.29 -53.99 15.31 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 113.237 0.828 . . . . 0.0 113.237 -171.006 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -68.0 -37.86 81.97 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.693 0.282 . . . . 0.0 110.956 -175.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -65.16 -45.58 84.37 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.781 0.324 . . . . 0.0 110.405 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 755' ' ' ARG . . . . . 0.404 ' HB2' " H5'" ' A' ' 801' ' ' DGP . 78.2 mtt180 -58.53 -48.62 80.24 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 174.532 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 756' ' ' LEU . . . . . 0.421 ' HB2' " H4'" ' A' ' 801' ' ' DGP . 56.9 tp -53.68 -43.32 68.81 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.61 179.894 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -60.53 -41.73 95.02 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.293 -0.412 . . . . 0.0 109.963 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 91.7 t -64.18 -48.27 86.38 Favored 'Isoleucine or valine' 0 C--O 1.232 0.175 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.067 176.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -55.08 -48.35 73.64 Favored 'General case' 0 N--CA 1.464 0.236 0 O-C-N 123.255 0.347 . . . . 0.0 111.056 -179.737 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -58.98 -48.58 81.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.692 -179.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 98.5 mt -65.65 -49.17 79.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.987 -177.61 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -60.96 -41.41 96.27 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 120.912 0.387 . . . . 0.0 110.841 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 763' ' ' GLU . . . . . 0.434 ' CD ' HN21 ' A' ' 801' ' ' DGP . 37.7 tt0 -63.28 -39.68 95.27 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.033 -179.602 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -74.62 -36.79 62.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.807 0.337 . . . . 0.0 110.765 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 11.8 m170 -65.79 -25.06 67.08 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.908 177.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 100.15 14.62 32.94 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.384 177.408 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 39.7 mt -94.52 169.61 10.07 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 -179.48 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 768' ' ' ARG . . . . . 0.594 ' HB2' ' HA ' ' A' ' 786' ' ' ALA . 59.8 ttt180 -100.73 152.3 20.64 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 179.228 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 5.8 p80 -153.14 142.82 21.94 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.736 0.303 . . . . 0.0 110.803 -176.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -142.21 160.9 39.33 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.204 178.136 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 4.4 m -124.74 135.64 53.17 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.601 176.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 38.7 m -135.64 140.96 44.95 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.816 -175.247 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 115.01 170.74 16.47 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 121.147 -0.549 . . . . 0.0 111.952 178.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -109.77 129.89 55.58 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.788 0.327 . . . . 0.0 111.463 -177.216 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . 61.31 -112.05 4.39 Favored Glycine 0 N--CA 1.451 -0.342 0 CA-C-N 115.843 -0.617 . . . . 0.0 113.251 172.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . 0.406 ' HA ' ' HD2' ' A' ' 776' ' ' LYS . 19.3 tptm -97.63 -0.76 45.11 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.147 0.499 . . . . 0.0 110.607 -177.534 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 9.8 mtm-85 -91.38 0.49 57.51 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 172.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 778' ' ' ARG . . . . . . . . . . . . . 55.8 ttt85 -83.51 125.45 31.76 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 114.431 -1.259 . . . . 0.0 110.909 -176.565 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 43.8 p90 -118.92 170.61 8.87 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.816 178.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 8.3 tt -122.7 141.22 43.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-O 120.928 0.394 . . . . 0.0 110.594 179.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 781' ' ' THR . . . . . 0.408 ' HA ' ' O ' ' A' ' 744' ' ' LEU . 25.7 m -127.14 127.63 44.88 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.468 -179.648 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 35.4 t -106.19 124.44 61.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.653 178.517 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 783' ' ' SER . . . . . 0.498 ' HA ' ' O ' ' A' ' 742' ' ' MET . 55.6 p -112.36 139.55 47.83 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.072 0.463 . . . . 0.0 111.259 -177.114 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 784' ' ' LYS . . . . . 0.412 ' HE2' ' HA ' ' A' ' 737' ' ' MET . 89.6 mttt -69.4 -28.22 65.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.408 0.623 . . . . 0.0 110.326 175.268 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 785' ' ' ARG . . . . . 0.566 ' HA ' ' NE ' ' A' ' 785' ' ' ARG . 4.1 mmp_? -87.15 114.31 23.64 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.821 177.342 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 786' ' ' ALA . . . . . 0.594 ' HA ' ' HB2' ' A' ' 768' ' ' ARG . . . . . . . . 0 C--O 1.245 0.841 0 CA-C-O 118.438 -0.792 . . . . 0.0 111.136 -175.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 801' ' ' DGP . . . . . 0.56 ' H8 ' ' OP3' ' A' ' 801' ' ' DGP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo . . . . . 0 N--CA 1.474 0.354 0 N-CA-C 110.876 -0.471 . . . . 0.0 110.876 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -102.54 114.67 29.08 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.225 -179.155 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . -75.52 81.9 0.95 Allowed Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 121.098 -0.572 . . . . 0.0 112.334 179.7 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 48.5 t -92.39 115.28 30.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 121.027 0.441 . . . . 0.0 110.496 -178.113 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -107.57 156.32 19.15 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.758 -0.655 . . . . 0.0 109.424 175.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 14.9 m -75.97 103.57 6.1 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.887 -178.349 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -79.29 93.07 5.22 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.061 0.458 . . . . 0.0 109.822 175.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -140.01 151.62 45.61 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.866 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . 91.12 51.26 2.63 Favored Glycine 0 N--CA 1.445 -0.753 0 N-CA-C 110.068 -1.213 . . . . 0.0 110.068 -172.166 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 17.4 t -98.14 104.69 16.26 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 CA-C-O 120.94 0.4 . . . . 0.0 110.752 -171.246 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 727' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -72.55 158.93 34.75 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 173.038 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 31.8 t60 -55.28 -51.36 66.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.212 0.529 . . . . 0.0 109.602 177.422 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 36.2 m-85 -70.24 -24.24 63.05 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.45 -178.494 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 730' ' ' ARG . . . . . . . . . . . . . 12.0 ttm180 -70.34 -39.76 74.52 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 178.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -63.96 -41.73 97.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.133 175.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 35.0 mmm -59.83 -43.36 94.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.549 178.004 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 733' ' ' ILE . . . . . 0.453 ' O ' ' HG3' ' A' ' 737' ' ' MET . 48.7 mt -70.03 -45.15 77.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.871 -0.604 . . . . 0.0 112.101 -178.304 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 10.9 p -63.47 -37.12 78.71 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 120.968 -0.293 . . . . 0.0 111.166 -176.075 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -74.02 -36.01 64.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.06 0.457 . . . . 0.0 110.186 176.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 736' ' ' PHE . . . . . 0.465 ' CE1' ' HB2' ' A' ' 744' ' ' LEU . 19.3 t80 -60.76 -37.02 80.41 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.819 175.838 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 737' ' ' MET . . . . . 0.453 ' HG3' ' O ' ' A' ' 733' ' ' ILE . 87.6 mtp -63.23 -36.24 82.98 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.093 178.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -86.28 -16.14 38.5 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.383 -178.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 58.9 m -84.53 169.41 14.48 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.874 0.369 . . . . 0.0 111.316 -177.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -73.36 -16.38 61.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.936 -0.575 . . . . 0.0 112.061 -176.304 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -60.16 134.59 57.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.127 0.489 . . . . 0.0 111.051 -177.338 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 56.6 mtm -92.47 -26.96 17.74 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.935 177.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -137.35 135.68 37.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.311 -179.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 744' ' ' LEU . . . . . 0.465 ' HB2' ' CE1' ' A' ' 736' ' ' PHE . 30.4 tp -112.94 105.37 13.43 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 176.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -91.37 112.65 24.65 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.243 -178.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 746' ' ' PHE . . . . . 0.531 ' O ' ' HB2' ' A' ' 779' ' ' PHE . 87.4 m-85 -85.51 150.07 53.19 Favored Pre-proline 0 C--N 1.321 -0.661 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.154 178.023 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 747' ' ' PRO . . . . . 0.408 ' O ' HD13 ' A' ' 750' ' ' LEU . 11.9 Cg_exo -67.41 158.81 55.29 Favored 'Trans proline' 0 N--CA 1.461 -0.391 0 C-N-CA 122.407 2.071 . . . . 0.0 112.008 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -66.09 -5.64 12.74 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.787 2.324 . . . . 0.0 112.532 176.683 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 3.4 m -63.4 -20.74 65.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.476 -0.783 . . . . 0.0 111.42 178.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 750' ' ' LEU . . . . . 0.408 HD13 ' O ' ' A' ' 747' ' ' PRO . 10.5 mp -69.06 113.85 6.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.372 177.75 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 751' ' ' ASN . . . . . 0.51 HD22 ' C ' ' A' ' 751' ' ' ASN . 0.3 OUTLIER -84.86 -167.36 1.79 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 110.247 -0.279 . . . . 0.0 110.247 179.061 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 6.2 m -52.25 -52.09 54.56 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 111.664 0.246 . . . . 0.0 111.664 -177.059 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 753' ' ' HIS . . . . . 0.451 ' O ' ' HG2' ' A' ' 757' ' ' ARG . 32.0 t-80 -59.54 -49.71 76.7 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.625 -0.261 . . . . 0.0 111.347 179.097 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -56.63 -55.73 30.34 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.168 -176.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 755' ' ' ARG . . . . . 0.492 ' HB2' H5'' ' A' ' 801' ' ' DGP . 77.1 mtt85 -56.55 -49.69 74.06 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.35 -179.788 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 756' ' ' LEU . . . . . 0.477 HD23 " H1'" ' A' ' 801' ' ' DGP . 3.1 tm? -53.08 -46.25 68.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.218 -178.07 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 757' ' ' ARG . . . . . 0.451 ' HG2' ' O ' ' A' ' 753' ' ' HIS . 31.9 mmm180 -60.35 -45.86 91.96 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.355 178.48 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 91.9 t -60.45 -47.39 92.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.648 -0.251 . . . . 0.0 110.943 179.067 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 87.8 m-70 -52.33 -56.73 12.95 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.711 178.431 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -60.79 -41.95 96.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.041 -0.527 . . . . 0.0 112.099 -178.377 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.59 -50.5 79.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.749 0.309 . . . . 0.0 110.845 179.257 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -64.39 -36.73 85.1 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.889 0.376 . . . . 0.0 110.58 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 763' ' ' GLU . . . . . 0.447 ' CD ' HN21 ' A' ' 801' ' ' DGP . 31.8 tt0 -65.32 -40.25 93.49 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.573 178.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.21 -43.37 78.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.053 -0.522 . . . . 0.0 109.852 177.686 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 10.5 m170 -69.09 -17.0 63.81 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.431 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 84.38 34.99 15.3 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.457 177.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 80.1 mt -110.4 172.95 6.56 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.03 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 73.3 ttt180 -92.71 143.75 25.99 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 177.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 5.5 p80 -146.06 121.49 10.32 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.222 0.534 . . . . 0.0 110.638 179.498 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -129.32 138.07 51.37 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.7 -176.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 5.1 m -104.02 128.08 51.59 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 174.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 20.4 p -132.06 150.22 52.21 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.783 -175.125 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 117.79 -157.68 15.03 Favored Glycine 0 N--CA 1.444 -0.77 0 N-CA-C 111.435 -0.666 . . . . 0.0 111.435 -177.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -94.76 -88.79 0.24 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.605 0.241 . . . . 0.0 111.585 -178.746 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . -142.93 -66.21 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.622 -0.799 . . . . 0.0 112.08 -179.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -79.62 -28.28 40.95 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.108 0.48 . . . . 0.0 110.439 179.079 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 777' ' ' ARG . . . . . 0.438 HH11 ' HD3' ' A' ' 777' ' ' ARG . 51.4 mtt180 -97.38 3.11 51.14 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.51 175.857 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 778' ' ' ARG . . . . . . . . . . . . . 28.2 ttt180 -72.42 129.48 38.46 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.0 178.657 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 779' ' ' PHE . . . . . 0.531 ' HB2' ' O ' ' A' ' 746' ' ' PHE . 45.8 p90 -121.34 166.53 13.92 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.274 -178.309 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 6.7 tt -116.41 135.5 56.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-O 121.278 0.561 . . . . 0.0 110.775 -178.028 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 55.9 m -119.91 120.24 35.83 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.733 -179.496 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 46.5 t -94.14 122.53 45.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.51 176.109 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 45.5 t -114.22 134.05 55.19 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-O 121.072 0.463 . . . . 0.0 110.835 -176.018 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 50.9 mtpt -88.03 -43.23 11.87 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.771 179.268 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 785' ' ' ARG . . . . . 0.699 ' HA ' ' NE ' ' A' ' 785' ' ' ARG . 2.0 mmp_? -121.08 122.3 39.75 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.665 -175.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.882 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.323 176.574 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 801' ' ' DGP . . . . . 0.527 " H3'" ' OP3' ' A' ' 801' ' ' DGP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_endo . . . . . 0 N--CA 1.478 0.6 0 N-CA-C 109.892 -0.849 . . . . 0.0 109.892 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 718' ' ' GLU . . . . . 0.401 ' OE1' ' HA ' ' A' ' 718' ' ' GLU . 5.5 mm-40 -78.87 70.23 5.17 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.169 0.509 . . . . 0.0 110.85 178.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . -87.79 65.66 3.49 Favored Glycine 0 N--CA 1.445 -0.726 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.72 178.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 3.4 p -126.72 100.34 6.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-O 121.574 0.702 . . . . 0.0 110.227 178.345 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -65.71 114.09 4.75 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.556 177.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 46.7 m -74.08 120.13 19.25 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.954 -0.388 . . . . 0.0 109.954 178.615 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 47.7 tt0 -71.53 -47.82 52.74 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.238 -0.437 . . . . 0.0 109.872 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -156.28 -167.57 2.47 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.374 178.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . 86.0 31.71 19.65 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.538 -0.839 . . . . 0.0 112.516 178.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 17.4 t -89.27 100.52 10.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 176.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 727' ' ' ASP . . . . . 0.531 ' CG ' ' HB2' ' A' ' 730' ' ' ARG . 2.1 p-10 -75.89 137.41 40.39 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.748 -175.327 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 44.2 t60 -51.1 -54.97 20.15 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 114.842 -1.072 . . . . 0.0 111.948 -175.671 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -64.22 -23.03 67.16 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.187 -176.349 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 730' ' ' ARG . . . . . 0.531 ' HB2' ' CG ' ' A' ' 727' ' ' ASP . 1.8 ttm180 -69.2 -47.69 64.17 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 178.284 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -63.5 -42.43 98.52 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.668 178.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 37.9 mmm -60.63 -38.15 83.83 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.381 179.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 733' ' ' ILE . . . . . . . . . . . . . 48.8 mt -72.9 -45.99 53.88 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.661 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 11.1 p -64.9 -35.1 74.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 C-N-CA 120.861 -0.335 . . . . 0.0 110.94 -176.665 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -74.73 -33.34 62.34 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 121.023 0.439 . . . . 0.0 110.208 176.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 736' ' ' PHE . . . . . 0.479 ' CE2' ' HG3' ' A' ' 784' ' ' LYS . 32.2 t80 -61.79 -36.26 80.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.913 174.347 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 737' ' ' MET . . . . . . . . . . . . . 80.8 mtp -74.14 -26.05 60.1 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.15 177.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -87.77 -24.97 23.62 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.859 0.362 . . . . 0.0 110.609 -176.46 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 77.3 p -89.9 -173.81 4.03 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.45 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -100.92 16.47 25.13 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.436 -176.13 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 741' ' ' LYS . . . . . 0.463 ' O ' ' HD3' ' A' ' 784' ' ' LYS . 58.3 mttp -72.78 132.23 43.33 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 177.049 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 25.7 mmt -88.97 -28.51 20.2 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.727 0.299 . . . . 0.0 110.583 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -141.19 136.76 32.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.321 -177.731 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 744' ' ' LEU . . . . . 0.444 HD13 ' CZ ' ' A' ' 746' ' ' PHE . 0.7 OUTLIER -107.78 103.79 13.14 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 179.059 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -86.52 103.29 14.9 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.981 0.42 . . . . 0.0 110.554 177.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 746' ' ' PHE . . . . . 0.444 ' CZ ' HD13 ' A' ' 744' ' ' LEU . 72.2 m-85 -81.83 151.9 68.27 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.474 176.82 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 747' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 746' ' ' PHE . 22.4 Cg_exo -65.45 153.6 77.48 Favored 'Trans proline' 0 CA--C 1.531 0.367 0 C-N-CA 122.706 2.27 . . . . 0.0 112.47 178.431 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -67.15 -5.68 14.28 Favored 'Trans proline' 0 N--CA 1.474 0.352 0 C-N-CA 123.218 2.612 . . . . 0.0 113.051 179.235 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 23.2 t -71.5 -13.95 61.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.786 179.32 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.9 mp -71.51 112.59 7.75 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 175.281 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 31.1 p30 -85.3 -170.59 3.19 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.425 -179.326 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 19.5 m -57.63 -38.43 74.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.509 0.195 . . . . 0.0 111.366 -176.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 38.2 t-80 -69.64 -48.67 59.13 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.834 178.515 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -59.39 -50.6 73.32 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 121.217 0.532 . . . . 0.0 110.5 -179.178 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 755' ' ' ARG . . . . . 0.454 ' HB2' " H5'" ' A' ' 801' ' ' DGP . 22.9 mtm180 -60.9 -40.59 93.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.339 179.645 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 756' ' ' LEU . . . . . 0.504 ' HB2' " H4'" ' A' ' 801' ' ' DGP . 54.5 tp -55.54 -44.03 76.36 Favored 'General case' 0 C--N 1.332 -0.194 0 O-C-N 123.287 0.367 . . . . 0.0 110.819 178.399 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 19.2 tpt180 -59.74 -43.1 94.39 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 121.033 0.444 . . . . 0.0 110.07 179.138 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 48.6 t -64.83 -48.35 84.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.937 178.418 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -57.2 -47.25 81.74 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 110.324 -0.25 . . . . 0.0 110.324 178.407 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -52.03 -53.62 39.79 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.687 177.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 761' ' ' ILE . . . . . 0.404 HD13 ' HA ' ' A' ' 730' ' ' ARG . 74.8 mt -65.82 -43.57 93.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.398 -175.775 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -64.8 -37.0 86.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.987 0.422 . . . . 0.0 110.679 179.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 763' ' ' GLU . . . . . 0.508 ' CD ' HN21 ' A' ' 801' ' ' DGP . 40.7 tt0 -69.65 -36.92 76.5 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.378 178.478 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -64.51 -49.33 71.76 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.412 175.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 13.1 m170 -69.44 -31.41 69.71 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.365 -176.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 98.77 38.41 3.9 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.203 179.031 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 78.6 mt -111.26 174.39 5.89 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 178.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 768' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' A' ' 768' ' ' ARG . 21.5 ttt180 -93.52 136.6 33.63 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 178.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 6.7 p80 -142.35 134.24 27.12 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 120.648 0.261 . . . . 0.0 110.805 -177.268 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -146.56 142.91 28.48 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.345 179.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 3.3 p -127.97 125.69 39.95 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.276 176.419 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 772' ' ' SER . . . . . . . . . . . . . 3.0 p -157.73 -176.73 6.1 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.117 -173.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 126.96 -107.46 0.9 Allowed Glycine 0 N--CA 1.449 -0.434 0 N-CA-C 111.455 -0.658 . . . . 0.0 111.455 -179.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 774' ' ' GLU . . . . . 0.596 ' O ' ' HB2' ' A' ' 778' ' ' ARG . 44.8 mt-10 -124.82 -175.84 3.39 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 175.014 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . -71.1 -49.27 28.02 Favored Glycine 0 N--CA 1.445 -0.706 0 C-N-CA 120.094 -1.05 . . . . 0.0 111.148 174.528 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.04 -38.98 69.42 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.216 -0.492 . . . . 0.0 111.159 177.461 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 777' ' ' ARG . . . . . 0.406 ' O ' ' HG2' ' A' ' 777' ' ' ARG . 33.2 ttp85 -106.91 27.93 8.48 Favored 'General case' 0 N--CA 1.439 -0.984 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.679 -170.198 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 778' ' ' ARG . . . . . 0.596 ' HB2' ' O ' ' A' ' 774' ' ' GLU . 60.8 ttt180 -72.25 111.17 7.23 Favored 'General case' 0 C--N 1.315 -0.918 0 C-N-CA 119.814 -0.754 . . . . 0.0 110.187 177.096 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 50.7 p90 -113.33 156.68 22.97 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 115.114 -0.948 . . . . 0.0 109.481 -177.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 15.2 tt -107.85 133.41 52.78 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-O 121.387 0.613 . . . . 0.0 110.733 -179.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 781' ' ' THR . . . . . 0.44 ' HA ' ' O ' ' A' ' 744' ' ' LEU . 26.7 m -116.05 115.75 26.66 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.048 177.686 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 33.5 t -91.04 134.18 30.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 176.112 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 33.7 t -125.26 137.12 54.09 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.126 0.489 . . . . 0.0 110.731 -175.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 784' ' ' LYS . . . . . 0.479 ' HG3' ' CE2' ' A' ' 736' ' ' PHE . 60.1 mtpt -86.78 -18.63 30.61 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.411 178.775 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 18.4 mmm180 -115.4 -81.42 0.61 Allowed 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.246 -178.26 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 786' ' ' ALA . . . . . 0.401 ' O ' ' HD3' ' A' ' 768' ' ' ARG . . . . . . . . 0 C--O 1.244 0.794 0 CA-C-O 118.158 -0.925 . . . . 0.0 110.257 -179.409 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 801' ' ' DGP . . . . . 0.508 HN21 ' CD ' ' A' ' 763' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_endo . . . . . 0 N--CA 1.479 0.658 0 N-CA-C 110.774 -0.51 . . . . 0.0 110.774 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.82 -36.98 1.97 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.159 0.504 . . . . 0.0 110.719 -178.628 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . 124.19 50.06 0.21 Allowed Glycine 0 N--CA 1.443 -0.873 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.16 179.384 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 720' ' ' VAL . . . . . . . . . . . . . 11.7 p -65.51 -21.78 29.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 121.284 0.564 . . . . 0.0 110.062 176.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -66.47 146.99 53.93 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.965 176.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 33.0 t -162.0 158.53 25.21 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 178.525 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 43.3 tt0 -83.26 62.66 6.8 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.708 0.766 . . . . 0.0 109.556 179.029 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 724' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -139.06 -174.08 3.75 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 179.824 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . 57.78 48.18 83.65 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.933 -0.651 . . . . 0.0 111.882 -177.122 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 18.1 t -77.63 82.07 0.83 Allowed 'Isoleucine or valine' 0 CA--C 1.512 -0.481 0 CA-C-O 121.69 0.757 . . . . 0.0 109.127 -175.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 727' ' ' ASP . . . . . 0.449 ' HB3' ' CB ' ' A' ' 730' ' ' ARG . 13.2 t70 -107.48 133.93 51.25 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.144 -174.459 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 728' ' ' HIS . . . . . . . . . . . . . 26.1 t60 -55.17 -52.66 62.6 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 123.473 0.483 . . . . 0.0 111.252 -178.237 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 24.7 m-85 -74.46 -35.54 63.31 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.672 -174.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 730' ' ' ARG . . . . . 0.449 ' CB ' ' HB3' ' A' ' 727' ' ' ASP . 17.1 ttp85 -64.34 -39.65 94.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.744 0.307 . . . . 0.0 110.351 178.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -64.06 -48.14 77.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.704 178.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 732' ' ' MET . . . . . . . . . . . . . 11.9 mtm -61.96 -35.42 78.42 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.145 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 733' ' ' ILE . . . . . 0.508 ' O ' ' HG3' ' A' ' 737' ' ' MET . 66.4 mt -71.72 -49.86 42.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.706 -0.224 . . . . 0.0 111.6 179.316 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 11.2 p -63.58 -34.6 68.63 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 120.988 -0.285 . . . . 0.0 111.39 -175.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 735' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -77.49 -31.18 53.46 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.95 0.405 . . . . 0.0 110.356 177.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 736' ' ' PHE . . . . . 0.513 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 0.7 OUTLIER -66.22 -37.01 84.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.447 174.489 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 737' ' ' MET . . . . . 0.508 ' HG3' ' O ' ' A' ' 733' ' ' ILE . 88.7 mtp -61.74 -28.65 69.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.013 179.408 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -102.85 9.55 38.85 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.005 -179.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 739' ' ' SER . . . . . . . . . . . . . 7.6 t -96.54 -164.54 1.16 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.028 -179.033 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -108.19 10.66 27.86 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.731 0.301 . . . . 0.0 111.628 -176.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 56.5 mttp -91.7 136.97 32.74 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.827 0.346 . . . . 0.0 110.541 177.679 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.86 -24.63 35.67 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.534 179.501 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -152.87 138.12 17.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.11 0.481 . . . . 0.0 111.092 177.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 744' ' ' LEU . . . . . 0.513 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 59.7 tp -102.67 105.75 16.27 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.607 -179.61 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -87.36 114.16 23.72 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.278 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 746' ' ' PHE . . . . . 0.417 ' HA ' ' HD3' ' A' ' 747' ' ' PRO . 80.9 m-85 -84.77 151.33 57.9 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.501 179.52 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 747' ' ' PRO . . . . . 0.441 ' HB2' ' OG ' ' A' ' 749' ' ' SER . 13.8 Cg_exo -68.33 155.71 68.28 Favored 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 122.606 2.204 . . . . 0.0 112.184 177.456 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -67.94 -3.01 9.73 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 122.995 2.463 . . . . 0.0 112.821 178.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 749' ' ' SER . . . . . 0.441 ' OG ' ' HB2' ' A' ' 747' ' ' PRO . 5.3 p -68.62 -23.18 64.42 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.251 178.648 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.7 mp -63.14 115.65 4.68 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.01 175.166 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 751' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -84.62 -171.38 3.59 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.186 -179.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 2.8 m -48.19 -54.25 14.07 Favored 'General case' 0 C--N 1.328 -0.349 0 O-C-N 123.59 0.556 . . . . 0.0 111.914 -178.387 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 753' ' ' HIS . . . . . . . . . . . . . 34.9 m80 -73.31 -31.16 63.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.462 -175.258 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -64.47 -47.4 79.11 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 176.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 755' ' ' ARG . . . . . . . . . . . . . 23.3 mtm180 -61.87 -45.98 91.39 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.041 177.353 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 756' ' ' LEU . . . . . 0.58 ' HB2' " H4'" ' A' ' 801' ' ' DGP . 57.8 tp -52.69 -41.82 64.23 Favored 'General case' 0 C--N 1.332 -0.168 0 O-C-N 123.432 0.457 . . . . 0.0 110.848 178.543 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 757' ' ' ARG . . . . . . . . . . . . . 26.2 tpt180 -61.47 -45.91 92.26 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.952 179.357 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 99.6 t -64.83 -47.42 88.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.188 179.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -55.23 -48.6 73.69 Favored 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 178.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 63.8 mt-30 -52.74 -51.79 59.05 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.516 177.489 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 77.3 mt -66.36 -47.65 83.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.505 -175.341 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -64.22 -39.03 93.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.834 0.349 . . . . 0.0 110.463 -179.113 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 763' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -65.86 -40.79 92.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.216 178.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 764' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -66.95 -45.52 77.55 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.741 178.276 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 10.7 m170 -70.38 -27.76 64.56 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.445 -177.177 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 98.24 30.69 6.87 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.527 -0.844 . . . . 0.0 112.544 177.592 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 767' ' ' LEU . . . . . . . . . . . . . 53.1 mt -107.05 162.78 13.55 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 177.677 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 26.0 ttp180 -84.43 132.39 34.57 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.654 -0.418 . . . . 0.0 109.893 178.698 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 4.4 p80 -130.71 123.68 29.83 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-O 121.111 0.482 . . . . 0.0 110.254 178.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -136.83 155.76 49.38 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.944 -179.002 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 9.4 t -113.05 162.01 16.4 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 178.307 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 772' ' ' SER . . . . . 0.509 ' O ' ' HA ' ' A' ' 778' ' ' ARG . 23.0 t -151.52 149.66 29.47 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.61 -179.233 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 89.13 167.96 43.36 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.988 -0.625 . . . . 0.0 111.883 -178.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -125.79 138.42 53.84 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.762 0.315 . . . . 0.0 111.007 179.113 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . 65.68 -120.43 16.9 Favored Glycine 0 N--CA 1.449 -0.488 0 CA-C-N 115.871 -0.604 . . . . 0.0 112.559 177.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 20.5 tptm -74.96 -10.83 59.85 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.271 0.558 . . . . 0.0 110.39 -179.336 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 19.6 mtt180 -91.18 -6.32 53.65 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.944 176.17 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 778' ' ' ARG . . . . . 0.509 ' HA ' ' O ' ' A' ' 772' ' ' SER . 36.9 ttt180 -81.11 120.74 25.22 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.186 0.517 . . . . 0.0 111.152 -175.092 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 45.3 p90 -134.47 174.67 10.28 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.291 -0.868 . . . . 0.0 108.809 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 8.9 tt -127.07 143.49 40.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-O 121.025 0.44 . . . . 0.0 111.166 -175.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 57.3 m -124.6 125.83 44.78 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.678 179.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 47.5 t -102.94 114.29 42.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 176.125 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 11.2 t -110.78 140.0 45.59 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.087 0.47 . . . . 0.0 110.726 -175.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 784' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -80.63 -36.48 32.55 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.955 176.138 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 19.2 mmm180 -104.13 156.07 18.19 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.098 -178.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.365 -0.826 . . . . 0.0 109.708 175.993 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 801' ' ' DGP . . . . . 0.832 ' H8 ' ' OP3' ' A' ' 801' ' ' DGP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 717' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo . . . . . 0 N--CA 1.481 0.74 0 N-CA-C 110.542 -0.599 . . . . 0.0 110.542 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -111.9 -17.26 12.95 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.334 -177.477 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 719' ' ' GLY . . . . . . . . . . . . . . . 83.27 57.21 2.53 Favored Glycine 0 N--CA 1.444 -0.773 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 -175.3 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 720' ' ' VAL . . . . . 0.404 HG12 ' HA ' ' A' ' 764' ' ' GLU . 35.2 m -127.12 163.22 30.44 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 CA-C-O 121.186 0.517 . . . . 0.0 110.321 -176.385 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 721' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -143.89 92.59 2.35 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.695 179.216 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 50.9 m -69.91 105.7 2.91 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.848 -172.2 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 723' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -107.3 103.98 13.48 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.833 179.14 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 724' ' ' ASP . . . . . 0.493 ' CG ' ' H ' ' A' ' 725' ' ' GLY . 14.4 t70 -104.09 -156.26 0.56 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.794 -176.269 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 725' ' ' GLY . . . . . 0.493 ' H ' ' CG ' ' A' ' 724' ' ' ASP . . . 99.72 -79.95 0.5 Allowed Glycine 0 N--CA 1.445 -0.738 0 N-CA-C 111.137 -0.785 . . . . 0.0 111.137 -176.544 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 726' ' ' VAL . . . . . . . . . . . . . 14.9 p -170.29 137.9 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 176.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 727' ' ' ASP . . . . . 0.438 ' HB3' ' CB ' ' A' ' 730' ' ' ARG . 13.4 t70 -159.71 134.98 8.19 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 177.319 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 728' ' ' HIS . . . . . 0.468 ' O ' ' HG3' ' A' ' 732' ' ' MET . 4.8 t60 -64.02 -46.55 83.96 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.452 -175.328 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 729' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -77.03 -31.38 56.28 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.007 -175.229 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 730' ' ' ARG . . . . . 0.438 ' CB ' ' HB3' ' A' ' 727' ' ' ASP . 15.7 tpt180 -57.75 -43.23 85.27 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 174.589 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 731' ' ' ALA . . . . . . . . . . . . . . . -64.8 -48.22 75.22 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.665 177.589 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 732' ' ' MET . . . . . 0.468 ' HG3' ' O ' ' A' ' 728' ' ' HIS . 92.2 mtp -57.37 -45.76 84.08 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.933 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 733' ' ' ILE . . . . . 0.462 ' O ' ' HG3' ' A' ' 737' ' ' MET . 72.9 mt -67.17 -45.57 86.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.912 -178.236 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 734' ' ' VAL . . . . . . . . . . . . . 11.3 p -66.98 -38.42 81.33 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 120.594 -0.442 . . . . 0.0 111.065 -176.491 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 735' ' ' GLU . . . . . 0.463 ' O ' ' HB2' ' A' ' 739' ' ' SER . 42.8 mt-10 -72.09 -33.35 67.82 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-O 120.842 0.353 . . . . 0.0 110.114 177.33 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 736' ' ' PHE . . . . . 0.626 ' CD1' ' HB2' ' A' ' 744' ' ' LEU . 7.0 t80 -60.12 -42.66 95.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.354 177.31 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 737' ' ' MET . . . . . 0.476 ' SD ' HD11 ' A' ' 767' ' ' LEU . 46.4 mtm -62.4 -25.8 68.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.59 -176.592 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 738' ' ' ALA . . . . . . . . . . . . . . . -112.61 12.89 19.9 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.907 0.384 . . . . 0.0 111.152 -178.446 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 739' ' ' SER . . . . . 0.463 ' HB2' ' O ' ' A' ' 735' ' ' GLU . 7.7 t -94.98 7.09 47.18 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.407 -176.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 740' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? 65.27 16.81 10.74 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.201 -177.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 741' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -97.32 125.04 41.66 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 176.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 742' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.0 -20.11 33.36 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.147 -177.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 743' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -147.06 129.15 15.55 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.145 -174.528 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 744' ' ' LEU . . . . . 0.626 ' HB2' ' CD1' ' A' ' 736' ' ' PHE . 42.6 tp -118.61 102.29 8.76 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 110.067 -0.345 . . . . 0.0 110.067 179.805 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 745' ' ' GLU . . . . . . . . . . . . . 11.3 mp0 -85.72 108.16 17.93 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.214 -0.448 . . . . 0.0 109.946 177.052 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 746' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -75.23 152.02 85.94 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.647 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 747' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -64.89 149.59 89.33 Favored 'Trans proline' 0 CA--C 1.53 0.316 0 C-N-CA 122.774 2.316 . . . . 0.0 112.06 177.011 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 748' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -67.31 -2.44 8.17 Favored 'Trans proline' 0 N--CA 1.474 0.346 0 C-N-CA 123.239 2.626 . . . . 0.0 113.145 -179.454 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 749' ' ' SER . . . . . . . . . . . . . 13.0 t -74.02 -18.1 60.89 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.93 179.351 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 750' ' ' LEU . . . . . . . . . . . . . 10.8 mp -64.38 113.76 3.84 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.155 176.409 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 751' ' ' ASN . . . . . 0.461 ' O ' ' HG3' ' A' ' 755' ' ' ARG . 4.5 p30 -81.25 -176.69 6.11 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 -179.019 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 752' ' ' SER . . . . . . . . . . . . . 44.3 t -49.44 -49.11 46.59 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.515 -179.065 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 753' ' ' HIS . . . . . 0.401 ' O ' ' HG2' ' A' ' 757' ' ' ARG . 41.1 m80 -67.87 -37.54 81.94 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.524 -178.262 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -64.0 -49.68 71.53 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.142 0.496 . . . . 0.0 110.218 179.176 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 755' ' ' ARG . . . . . 0.461 ' HG3' ' O ' ' A' ' 751' ' ' ASN . 23.5 mtm180 -63.83 -38.46 91.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.208 -179.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 756' ' ' LEU . . . . . . . . . . . . . 62.1 tp -54.41 -44.71 72.62 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 123.393 0.433 . . . . 0.0 110.779 177.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 757' ' ' ARG . . . . . 0.401 ' HG2' ' O ' ' A' ' 753' ' ' HIS . 31.2 mmm180 -58.9 -47.02 86.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.974 177.775 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 758' ' ' VAL . . . . . . . . . . . . . 59.0 t -59.24 -48.47 86.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.976 178.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 759' ' ' HIS . . . . . . . . . . . . . 91.5 m-70 -57.38 -55.02 40.22 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.638 -0.255 . . . . 0.0 110.841 179.498 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 760' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -53.45 -46.3 69.84 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 121.097 0.475 . . . . 0.0 111.416 -178.532 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 761' ' ' ILE . . . . . . . . . . . . . 96.4 mt -68.56 -47.52 76.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.294 -176.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 762' ' ' ALA . . . . . . . . . . . . . . . -65.37 -34.1 77.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.937 0.399 . . . . 0.0 110.532 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 763' ' ' GLU . . . . . 0.407 ' CD ' HN21 ' A' ' 801' ' ' DGP . 36.5 tt0 -64.0 -35.15 79.76 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.39 178.179 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 764' ' ' GLU . . . . . 0.404 ' HA ' HG12 ' A' ' 720' ' ' VAL . 39.8 tt0 -74.81 -42.64 57.69 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 120.975 0.417 . . . . 0.0 110.848 176.66 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 765' ' ' HIS . . . . . . . . . . . . . 11.4 m170 -65.28 -26.23 67.99 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.401 -179.127 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 766' ' ' GLY . . . . . . . . . . . . . . . 93.29 20.68 31.9 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.928 -0.653 . . . . 0.0 111.838 -179.409 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 767' ' ' LEU . . . . . 0.476 HD11 ' SD ' ' A' ' 737' ' ' MET . 32.6 mt -97.62 166.49 11.48 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 -177.251 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 768' ' ' ARG . . . . . . . . . . . . . 28.7 ttt180 -85.68 125.18 32.98 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.057 175.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 769' ' ' HIS . . . . . . . . . . . . . 3.3 p80 -121.2 116.63 25.29 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.113 174.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 770' ' ' ASP . . . . . . . . . . . . . 41.2 t0 -141.83 156.9 45.53 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.802 -172.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 771' ' ' SER . . . . . . . . . . . . . 6.1 p -126.22 144.49 50.76 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 120.982 0.42 . . . . 0.0 111.305 -175.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 772' ' ' SER . . . . . 0.418 ' O ' ' HA ' ' A' ' 778' ' ' ARG . 15.2 m -134.3 137.58 44.34 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.535 -178.323 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 773' ' ' GLY . . . . . 0.455 ' HA3' ' HA ' ' A' ' 778' ' ' ARG . . . 122.97 -176.95 16.61 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.916 -0.659 . . . . 0.0 112.727 177.795 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 774' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -84.88 -92.64 0.08 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.559 0.219 . . . . 0.0 111.385 -176.299 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 775' ' ' GLY . . . . . . . . . . . . . . . -118.91 -82.64 0.81 Allowed Glycine 0 N--CA 1.451 -0.345 0 N-CA-C 111.536 -0.626 . . . . 0.0 111.536 178.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 776' ' ' LYS . . . . . . . . . . . . . 21.3 tptm -70.93 -26.13 63.05 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.388 0.613 . . . . 0.0 109.593 175.441 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 777' ' ' ARG . . . . . . . . . . . . . 3.3 mmt180 -86.56 8.24 22.93 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.044 175.529 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 778' ' ' ARG . . . . . 0.455 ' HA ' ' HA3' ' A' ' 773' ' ' GLY . 46.6 ttt85 -97.84 110.84 23.33 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 121.46 0.648 . . . . 0.0 110.717 177.525 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 779' ' ' PHE . . . . . . . . . . . . . 50.4 p90 -110.92 172.68 6.73 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.819 -177.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 780' ' ' ILE . . . . . . . . . . . . . 12.7 tt -116.06 143.0 27.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-O 121.1 0.476 . . . . 0.0 110.519 -179.231 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 781' ' ' THR . . . . . . . . . . . . . 49.5 m -129.72 130.15 45.09 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.639 179.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 782' ' ' VAL . . . . . . . . . . . . . 98.7 t -106.85 132.27 54.6 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.722 178.223 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 783' ' ' SER . . . . . . . . . . . . . 16.4 m -124.88 139.41 53.86 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.208 -179.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 784' ' ' LYS . . . . . 0.429 ' HA ' HD22 ' A' ' 767' ' ' LEU . 27.4 mtpp -68.57 137.59 54.42 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.49 -177.287 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 785' ' ' ARG . . . . . . . . . . . . . 16.0 mmm180 -147.47 98.72 3.03 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.394 -179.266 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 786' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.514 -0.755 . . . . 0.0 110.384 179.026 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 801' ' ' DGP . . . . . 0.897 " H3'" ' OP3' ' A' ' 801' ' ' DGP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_